*HEADER    PROTEIN FIBRIL                          01-NOV-18   6I2O              
*TITLE     SOLUTION NMR STRUCTURE OF PILE1 FROM STREPTOCOCCUS SANGUINIS          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TYPE IV PILIN PILE1;                                       
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS SANGUINIS;                        
*SOURCE   3 ORGANISM_TAXID: 1305;                                                
*SOURCE   4 GENE: PILE1, SSV_2241;                                               
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI DH1;                             
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 536056                                      
*KEYWDS    TYPE IV PILIN, PILIN, PILUS, PROTEIN FIBRIL                           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    J.L.BERRY,Y.XU                                                        
*REVDAT   1   13-MAR-19 6I2O    0                                                
# Restraints file 1: talos_dihedral.tbl
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       (resid 101 and name ca ) ( resid 101 and name c)  1.0   -81.3 20.0 2
assign ( resid 101 and name n  ) ( resid 101 and name ca)
       ( resid 101 and name c  ) (resid 102 and name n)  1.0   173.1 20.0 2
assign ( resid 101 and name c  ) (resid 102 and name n)
       (resid 102 and name ca ) ( resid 102 and name c)  1.0   -68.7 20.0 2
assign ( resid 102 and name n  ) ( resid 102 and name ca)
       ( resid 102 and name c  ) (resid 103 and name n)  1.0   138.1 20.0 2
assign ( resid 102 and name c  ) (resid 103 and name n)
       (resid 103 and name ca ) ( resid 103 and name c)  1.0   -75.5 20.0 2
assign ( resid 103 and name n  ) ( resid 103 and name ca)
       ( resid 103 and name c  ) (resid 104 and name n)  1.0   136.4 20.0 2
assign ( resid 103 and name c  ) (resid 104 and name n)
       (resid 104 and name ca ) ( resid 104 and name c)  1.0  -103.1 21.2 2
assign ( resid 104 and name n  ) ( resid 104 and name ca)
       ( resid 104 and name c  ) (resid 105 and name n)  1.0   129.8 20.0 2
assign ( resid 104 and name c  ) (resid 105 and name n)
       (resid 105 and name ca ) ( resid 105 and name c)  1.0  -110.0 20.0 2
assign ( resid 105 and name n  ) ( resid 105 and name ca)
       ( resid 105 and name c  ) (resid 106 and name n)  1.0   121.6 20.0 2
assign ( resid 105 and name c  ) (resid 106 and name n)
       (resid 106 and name ca ) ( resid 106 and name c)  1.0  -104.5 20.0 2
assign ( resid 106 and name n  ) ( resid 106 and name ca)
       ( resid 106 and name c  ) (resid 107 and name n)  1.0   127.0 20.0 2
assign ( resid 106 and name c  ) (resid 107 and name n)
       (resid 107 and name ca ) ( resid 107 and name c)  1.0  -118.0 20.0 2
assign ( resid 107 and name n  ) ( resid 107 and name ca)
       ( resid 107 and name c  ) (resid 108 and name n)  1.0   131.4 20.0 2
assign ( resid 107 and name c  ) (resid 108 and name n)
       (resid 108 and name ca ) ( resid 108 and name c)  1.0  -122.8 20.0 2
assign ( resid 108 and name n  ) ( resid 108 and name ca)
       ( resid 108 and name c  ) (resid 109 and name n)  1.0   130.5 20.0 2
assign ( resid 108 and name c  ) (resid 109 and name n)
       (resid 109 and name ca ) ( resid 109 and name c)  1.0  -109.3 20.0 2
assign ( resid 109 and name n  ) ( resid 109 and name ca)
       ( resid 109 and name c  ) (resid 110 and name n)  1.0   114.4 20.0 2
# Restraints file 2: noe_restraints.unambig

# List of unambiguous distance restraints.
#
# Created by Aria 2.0a, Fri Feb 20 16:13:59 2015
#
# Author:  
# Date:    
# Project: 2241
# Run:     6
# Path:    /nmr/aria/jberry/2241/run6
#
# Restraints used during calculation: 1462
# Violated: 44
#
#
# Abbreviations:
#
# ref_spec: Spectrum name
# ref_no:   Reference peak number (as in spectrum)
# id:       Internal ARIA restraint-id (unique over all spectra)
# active:   yes(no): restraint has (not) been used in the calculation. A restraint is inactive
#           either if it was violated in the last iteration or if it has been merged with
#           another restraint.
                       
# d:        Restaint distance [A], after calibration.
# upper:    Upper bound [A]
# lower:    Lower bound [A]
#
# Statistical quantities which have been calculated with respect to the structures of
# this iteration:
#
# d_avg:    Average distance [A] found in structure ensemble.
# l_viol:   Average lower-bound violation [A].
# u_viol:   Average upper-bound violation [A].
# %_viol:   Percentage of structures in which a restraint was violated.
# viol:     'yes' if the restraint has been violated. 'no' otherwise. Violated restraints
#           will not be used in the subsequent iteration.
#
# a_type:   Assignment type. Valid types are:
#           M (manual):         Restraint stems from existing (complete) cross-peak assignment.
#           S (semi-automatic): Reference cross-peak is only partially assigned. ARIA has
#                               completed the assignment.
#           A (automatic):      Reference cross-peak has not been assigned. ARIA has generated
#                               a list of probable assignments.
#
# sep:      sequence separation s: I:      s == 0  (intra-residual)
#                                  Q:      s == 1  (sequential)        
#                                  S: 2 <= s <= 3  (short)
#                                  M: 4 <= s <= 5  (medium)
#                                  L:      s >  5  (long)
#                                  i: inter-monomer
# 
# All statistical quantities are calculated with respect to a 'filtered' ensemble of structures
# (e.g. n-lowest energy structures etc). See also  section in project-xml file.
#
# ref_spec  ref_no    id  active     d  lower  upper  d_avg  l_viol  u_viol  %_viol  viol  a_type  sep  


    nnoesy       2  2724     yes  3.02   1.88   4.16   2.23    0.01    0.00     0.0    no       A    L  
    nnoesy       4  2726     yes  3.99   2.00   5.98   4.12    0.00    0.00     0.0    no       A    L  
    nnoesy       5  2727     yes  3.74   1.99   5.49   3.97    0.00    0.00     0.0    no       A    L  
    nnoesy      13  2735     yes  3.07   1.89   4.25   3.02    0.00    0.00     0.0    no       A    I  
    nnoesy      14  2736     yes  3.63   1.98   5.28   4.36    0.00    0.00     0.0    no       A    Q  
    nnoesy      15  2737     yes  3.80   1.99   5.60   2.69    0.03    0.00     0.0    no       A    L  
    nnoesy      16  2738     yes  3.78   1.99   5.56   4.53    0.00    0.00     0.0    no       A    Q  
    nnoesy      20  2742     yes  3.33   1.94   4.71   3.76    0.00    0.00     0.0    no       A    L  
    nnoesy      21  2743     yes  3.06   1.89   4.22   2.94    0.00    0.00     0.0    no       A    I  
    nnoesy      22  2744     yes  2.54   1.73   3.34   2.17    0.00    0.00     0.0    no       A    Q  
    nnoesy      24  2746     yes  2.93   1.86   4.01   2.62    0.00    0.00     0.0    no       A    I  
    nnoesy      25  2747     yes  3.63   1.98   5.28   3.95    0.00    0.00     0.0    no       A    Q  
    nnoesy      27  2749     yes  3.61   1.98   5.23   4.26    0.00    0.00     0.0    no       A    M  
    nnoesy      29  2751     yes  3.33   1.94   4.71   1.95    0.02    0.00     0.0    no       A    L  
    nnoesy      32  2754     yes  3.69   1.99   5.40   4.55    0.00    0.00     0.0    no       A    Q  
    nnoesy      33  2755     yes  3.79   1.99   5.58   4.53    0.00    0.15    14.3    no       A    Q  
    nnoesy      39  2761     yes  3.81   2.00   5.62   3.89    0.00    0.00     0.0    no       A    L  
    nnoesy      40  2762     yes  3.74   1.99   5.50   5.20    0.00    0.00     0.0    no       A    L  
    nnoesy      41  2763     yes  3.42   1.96   4.88   3.49    0.00    0.00     0.0    no       A    L  
    nnoesy      49  2771     yes  2.41   1.68   3.14   2.52    0.00    0.00     0.0    no       A    I  
    nnoesy      52  2774     yes  2.47   1.71   3.24   3.00    0.00    0.00     0.0    no       A    I  
    nnoesy      54  2775     yes  3.63   1.98   5.28   4.32    0.00    0.00     0.0    no       A    Q  
    nnoesy      57  2778     yes  3.77   1.99   5.55   5.55    0.00    0.08    14.3    no       A    Q  
    nnoesy      58  2779     yes  2.28   1.63   2.94   2.32    0.00    0.00     0.0    no       A    Q  
    nnoesy      59  2780     yes  3.30   1.94   4.65   4.20    0.00    0.00     0.0    no       A    Q  
    nnoesy      60  2781     yes  2.57   1.74   3.39   2.87    0.00    0.14    14.3    no       A    I  
    nnoesy      63  2784     yes  3.57   1.98   5.16   4.34    0.00    0.00     0.0    no       A    S  
    nnoesy      66  2787     yes  3.72   1.99   5.45   5.43    0.00    0.10    42.9    no       A    L  
    nnoesy      67  2788     yes  3.69   1.99   5.40   4.36    0.00    0.00     0.0    no       A    Q  
    nnoesy      70  2791     yes  3.06   1.89   4.23   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy      72  2793     yes  2.29   1.63   2.94   2.13    0.00    0.00     0.0    no       A    Q  
    nnoesy      77  2797     yes  3.22   1.92   4.51   2.87    0.00    0.00     0.0    no       A    I  
    nnoesy      78  2798     yes  2.98   1.87   4.09   3.35    0.00    0.00     0.0    no       A    I  
    nnoesy      82  2801     yes  3.47   1.96   4.97   4.66    0.00    0.02     0.0    no       A    Q  
    nnoesy      85  2804     yes  3.59   1.98   5.20   3.85    0.00    0.00     0.0    no       A    L  
    nnoesy      88  2807     yes  2.96   1.86   4.05   2.25    0.00    0.00     0.0    no       A    Q  
    nnoesy      91  2810     yes  3.65   1.98   5.31   3.17    0.00    0.00     0.0    no       A    I  
    nnoesy      92  2811     yes  3.92   2.00   5.83   4.24    0.00    0.00     0.0    no       A    S  
    nnoesy      94  2813     yes  3.16   1.91   4.40   4.38    0.00    0.06     0.0    no       A    L  
    nnoesy      95  2814     yes  4.02   2.00   6.04   4.83    0.00    0.00     0.0    no       A    L  
    nnoesy      97  2816     yes  3.36   1.95   4.77   2.05    0.03    0.00     0.0    no       A    L  
    nnoesy      99  2818     yes  2.62   1.76   3.48   2.35    0.00    0.00     0.0    no       A    I  
    nnoesy     105  2824     yes  3.05   1.89   4.22   2.93    0.00    0.00     0.0    no       A    L  
    nnoesy     110  2829     yes  3.64   1.98   5.29   4.69    0.00    0.00     0.0    no       A    L  
    nnoesy     114  2833     yes  2.95   1.86   4.03   3.51    0.00    0.00     0.0    no       A    I  
    nnoesy     115  2834     yes  3.36   1.95   4.78   3.18    0.00    0.00     0.0    no       A    L  
    nnoesy     117  2836     yes  3.59   1.98   5.20   4.37    0.00    0.00     0.0    no       A    L  
    nnoesy     122  2841     yes  3.70   1.99   5.40   4.68    0.00    0.00     0.0    no       A    L  
    nnoesy     126  2842     yes  3.32   1.94   4.69   4.58    0.00    0.00     0.0    no       A    Q  
    nnoesy     128  2844     yes  3.06   1.89   4.24   4.37    0.00    0.13    71.4   yes       A    Q  
    nnoesy     129  2845     yes  2.88   1.84   3.91   2.81    0.00    0.00     0.0    no       A    I  
    nnoesy     133  2848     yes  3.57   1.98   5.16   4.81    0.00    0.00     0.0    no       A    L  
    nnoesy     134  2849     yes  3.53   1.97   5.09   4.26    0.00    0.00     0.0    no       A    L  
    nnoesy     138  2853     yes  3.51   1.97   5.05   4.95    0.00    0.13    57.1   yes       A    L  
    nnoesy     140  2855     yes  3.63   1.98   5.28   5.06    0.00    0.15    14.3    no       A    S  
    nnoesy     146  2856     yes  3.66   1.99   5.33   4.01    0.00    0.00     0.0    no       A    S  
    nnoesy     148  2858     yes  3.72   1.99   5.45   5.06    0.00    0.00     0.0    no       A    S  
    nnoesy     149  2859     yes  3.22   1.92   4.52   2.57    0.00    0.00     0.0    no       A    I  
    nnoesy     153  2862     yes  3.47   1.96   4.97   3.75    0.00    0.00     0.0    no       A    Q  
    nnoesy     155  2864     yes  3.47   1.97   4.98   3.76    0.00    0.00     0.0    no       A    L  
    nnoesy     157  2866     yes  3.71   1.99   5.44   2.88    0.00    0.00     0.0    no       A    L  
    nnoesy     159  2868     yes  2.78   1.81   3.75   2.78    0.00    0.00     0.0    no       A    I  
    nnoesy     165  2873     yes  2.69   1.79   3.60   2.89    0.00    0.00     0.0    no       A    I  
    nnoesy     172  2879     yes  3.41   1.96   4.86   4.37    0.00    0.00     0.0    no       A    I  
    nnoesy     175  2882     yes  2.99   1.87   4.11   2.49    0.00    0.00     0.0    no       A    Q  
    nnoesy     191  2897     yes  2.74   1.80   3.68   2.24    0.00    0.00     0.0    no       A    Q  
    nnoesy     208  2913     yes  3.94   2.00   5.88   4.17    0.00    0.00     0.0    no       A    S  
    nnoesy     209  2914     yes  2.23   1.61   2.85   2.27    0.00    0.00     0.0    no       A    Q  
    nnoesy     210  2915     yes  3.01   1.88   4.14   2.53    0.01    0.00     0.0    no       A    L  
    nnoesy     214  2919     yes  3.17   1.91   4.42   3.89    0.00    0.00     0.0    no       A    Q  
    nnoesy     215  2920     yes  3.53   1.97   5.10   3.42    0.00    0.00     0.0    no       A    Q  
    nnoesy     221  2926     yes  2.79   1.82   3.76   2.74    0.00    0.00     0.0    no       A    Q  
    nnoesy     223  2927     yes  2.70   1.79   3.61   2.36    0.00    0.00     0.0    no       A    Q  
    nnoesy     225  2929     yes  3.67   1.99   5.35   4.08    0.00    0.00     0.0    no       A    S  
    nnoesy     227  2931     yes  3.45   1.96   4.94   4.48    0.00    0.00     0.0    no       A    Q  
    nnoesy     228  2932     yes  3.57   1.98   5.16   4.00    0.00    0.00     0.0    no       A    L  
    nnoesy     230  2934     yes  3.05   1.89   4.21   4.19    0.00    0.00     0.0    no       A    I  
    nnoesy     231  2935     yes  3.68   1.99   5.38   4.55    0.00    0.00     0.0    no       A    L  
    nnoesy     235  2939     yes  2.77   1.81   3.73   2.67    0.00    0.00     0.0    no       A    Q  
    nnoesy     236  2940     yes  2.94   1.86   4.02   3.62    0.00    0.00     0.0    no       A    Q  
    nnoesy     237  2941     yes  3.68   1.99   5.37   3.73    0.00    0.00     0.0    no       A    L  
    nnoesy     240  2944     yes  2.53   1.73   3.34   2.57    0.00    0.00     0.0    no       A    I  
    nnoesy     241  2945     yes  2.55   1.74   3.36   2.45    0.00    0.00     0.0    no       A    I  
    nnoesy     242  2946     yes  2.89   1.85   3.94   2.35    0.00    0.00     0.0    no       A    I  
    nnoesy     245  2949     yes  3.01   1.88   4.14   2.90    0.00    0.00     0.0    no       A    I  
    nnoesy     248  2952     yes  3.79   1.99   5.58   4.60    0.00    0.00     0.0    no       A    S  
    nnoesy     256  2960     yes  2.88   1.84   3.91   2.57    0.00    0.00     0.0    no       A    I  
    nnoesy     258  2962     yes  2.66   1.77   3.54   2.82    0.00    0.00     0.0    no       A    Q  
    nnoesy     259  2963     yes  2.55   1.74   3.36   2.67    0.00    0.00     0.0    no       A    Q  
    nnoesy     267  2971     yes  2.57   1.74   3.40   2.81    0.00    0.00     0.0    no       A    I  
    nnoesy     275  2979     yes  3.15   1.91   4.38   3.70    0.00    0.00     0.0    no       A    S  
    nnoesy     282  2984     yes  2.72   1.79   3.64   2.85    0.00    0.00     0.0    no       A    I  
    nnoesy     284  2986     yes  2.95   1.86   4.04   3.08    0.00    0.00     0.0    no       A    Q  
    nnoesy     285  2987     yes  3.01   1.88   4.14   3.80    0.00    0.06     0.0    no       A    Q  
    nnoesy     287  2988     yes  3.98   2.00   5.95   5.48    0.00    0.02     0.0    no       A    Q  
    nnoesy     289  2990     yes  2.35   1.66   3.04   2.13    0.00    0.00     0.0    no       A    I  
    nnoesy     294  2992     yes  3.05   1.89   4.21   3.05    0.04    0.00     0.0    no       A    Q  
    nnoesy     296  2993     yes  3.71   1.99   5.44   4.45    0.00    0.00     0.0    no       A    Q  
    nnoesy     297  2994     yes  2.70   1.79   3.61   3.06    0.00    0.00     0.0    no       A    Q  
    nnoesy     300  2997     yes  3.62   1.98   5.26   3.95    0.00    0.00     0.0    no       A    S  
    nnoesy     307  3002     yes  3.42   1.96   4.89   3.89    0.00    0.00     0.0    no       A    Q  
    nnoesy     320  3015     yes  2.84   1.83   3.84   2.60    0.00    0.00     0.0    no       A    I  
    nnoesy     321  3016     yes  2.77   1.81   3.73   2.89    0.00    0.00     0.0    no       A    I  
    nnoesy     323  3018     yes  2.44   1.70   3.19   2.13    0.00    0.00     0.0    no       A    Q  
    nnoesy     324  3019     yes  3.58   1.98   5.18   5.15    0.00    0.04     0.0    no       A    S  
    nnoesy     325  3020     yes  3.02   1.88   4.16   4.01    0.00    0.07     0.0    no       A    Q  
    nnoesy     326  3021     yes  2.45   1.70   3.20   2.33    0.00    0.00     0.0    no       A    I  
    nnoesy     327  3022     yes  3.15   1.91   4.38   4.26    0.00    0.00     0.0    no       A    Q  
    nnoesy     329  3024     yes  3.05   1.89   4.21   3.24    0.00    0.00     0.0    no       A    I  
    nnoesy     338  3032     yes  3.99   2.00   5.98   4.80    0.00    0.00     0.0    no       A    Q  
    nnoesy     339  3033     yes  3.70   1.99   5.41   4.95    0.00    0.00     0.0    no       A    Q  
    nnoesy     345  3039     yes  2.69   1.79   3.60   2.62    0.00    0.00     0.0    no       A    Q  
    nnoesy     346  3040     yes  3.06   1.89   4.23   2.83    0.00    0.00     0.0    no       A    I  
    nnoesy     350  3043     yes  3.88   2.00   5.76   4.22    0.00    0.00     0.0    no       A    Q  
    nnoesy     351  3044     yes  3.75   1.99   5.50   3.36    0.00    0.00     0.0    no       A    Q  
    nnoesy     352  3045     yes  3.61   1.98   5.24   4.11    0.00    0.00     0.0    no       A    S  
    nnoesy     355  3048     yes  3.10   1.90   4.30   3.44    0.00    0.00     0.0    no       A    S  
    nnoesy     356  3049     yes  2.08   1.54   2.62   2.31    0.00    0.00     0.0    no       A    Q  
    nnoesy     363  3055     yes  3.92   2.00   5.83   4.77    0.00    0.00     0.0    no       A    S  
    nnoesy     365  3057     yes  2.66   1.78   3.55   2.62    0.00    0.00     0.0    no       A    I  
    nnoesy     367  3059     yes  2.88   1.84   3.92   4.02    0.00    0.18    57.1   yes       A    I  
    nnoesy     368  3060     yes  2.13   1.56   2.70   2.37    0.00    0.09    14.3    no       A    I  
    nnoesy     369  3061     yes  2.59   1.75   3.43   3.16    0.00    0.09    14.3    no       A    I  
    nnoesy     371  3063     yes  2.57   1.74   3.40   2.13    0.00    0.00     0.0    no       A    Q  
    nnoesy     375  3067     yes  3.93   2.00   5.86   5.05    0.00    0.00     0.0    no       A    Q  
    nnoesy     381  3073     yes  3.68   1.99   5.37   4.14    0.00    0.00     0.0    no       A    S  
    nnoesy     382  3074     yes  2.52   1.73   3.32   2.73    0.00    0.00     0.0    no       A    I  
    nnoesy     385  3076     yes  2.30   1.64   2.96   2.37    0.00    0.00     0.0    no       A    Q  
    nnoesy     386  3077     yes  2.59   1.75   3.42   3.52    0.00    0.09    28.6    no       A    Q  
    nnoesy     387  3078     yes  2.62   1.76   3.48   2.84    0.00    0.00     0.0    no       A    I  
    nnoesy     391  3082     yes  2.63   1.76   3.49   2.12    0.00    0.00     0.0    no       A    I  
    nnoesy     392  3083     yes  2.71   1.79   3.62   2.78    0.00    0.00     0.0    no       A    I  
    nnoesy     393  3084     yes  2.61   1.76   3.47   2.84    0.00    0.00     0.0    no       A    I  
    nnoesy     394  3085     yes  2.68   1.78   3.57   3.23    0.00    0.00     0.0    no       A    I  
    nnoesy     395  3086     yes  3.13   1.91   4.35   3.98    0.00    0.00     0.0    no       A    Q  
    nnoesy     397  3088     yes  2.81   1.82   3.79   3.56    0.00    0.00     0.0    no       A    I  
    nnoesy     398  3089     yes  2.94   1.86   4.03   2.51    0.00    0.00     0.0    no       A    Q  
    nnoesy     400  3091     yes  3.81   2.00   5.62   3.57    0.00    0.00     0.0    no       A    L  
    nnoesy     403  3094     yes  3.80   2.00   5.61   4.89    0.00    0.00     0.0    no       A    I  
    nnoesy     404  3095     yes  3.00   1.87   4.12   2.78    0.00    0.00     0.0    no       A    L  
    nnoesy     406  3096     yes  3.04   1.88   4.19   2.90    0.00    0.00     0.0    no       A    I  
    nnoesy     408  3097     yes  3.16   1.91   4.40   3.14    0.00    0.00     0.0    no       A    I  
    nnoesy     416  3102     yes  3.49   1.97   5.01   4.14    0.00    0.00     0.0    no       A    Q  
    nnoesy     423  3107     yes  3.22   1.92   4.51   2.34    0.00    0.00     0.0    no       A    I  
    nnoesy     424  3108     yes  3.85   2.00   5.69   4.73    0.00    0.00     0.0    no       A    Q  
    nnoesy     429  3112     yes  3.98   2.00   5.95   5.23    0.00    0.00     0.0    no       A    L  
    nnoesy     431  3114     yes  3.15   1.91   4.39   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy     439  3122     yes  3.46   1.96   4.96   4.09    0.00    0.00     0.0    no       A    S  
    nnoesy     442  3125     yes  2.46   1.70   3.22   2.74    0.00    0.07    14.3    no       A    I  
    nnoesy     443  3126     yes  2.69   1.79   3.60   2.56    0.00    0.07    14.3    no       A    I  
    nnoesy     460  3142     yes  2.45   1.70   3.20   2.95    0.00    0.01     0.0    no       A    I  
    nnoesy     463  3145     yes  2.50   1.72   3.28   2.15    0.02    0.00     0.0    no       A    I  
    nnoesy     470  3152     yes  3.73   1.99   5.47   4.05    0.00    0.00     0.0    no       A    M  
    nnoesy     471  3153     yes  2.52   1.73   3.32   2.48    0.00    0.00     0.0    no       A    Q  
    nnoesy     475  3157     yes  2.47   1.71   3.22   2.23    0.00    0.00     0.0    no       A    Q  
    nnoesy     477  3159     yes  2.77   1.81   3.73   2.66    0.00    0.00     0.0    no       A    I  
    nnoesy     478  3160     yes  2.54   1.73   3.35   2.96    0.00    0.02     0.0    no       A    I  
    nnoesy     480  3162     yes  3.36   1.95   4.77   4.44    0.00    0.00     0.0    no       A    I  
    nnoesy     481  3163     yes  2.47   1.71   3.23   2.49    0.00    0.00     0.0    no       A    Q  
    nnoesy     482  3164     yes  2.75   1.80   3.69   2.70    0.00    0.00     0.0    no       A    Q  
    nnoesy     487  3169     yes  3.73   1.99   5.48   5.12    0.00    0.00     0.0    no       A    Q  
    nnoesy     492  3174     yes  3.78   1.99   5.57   5.13    0.00    0.00     0.0    no       A    Q  
    nnoesy     493  3175     yes  2.05   1.52   2.57   2.29    0.00    0.00     0.0    no       A    Q  
    nnoesy     495  3177     yes  2.92   1.85   3.99   3.92    0.00    0.02     0.0    no       A    S  
    nnoesy     497  3179     yes  3.94   2.00   5.87   5.27    0.00    0.00     0.0    no       A    Q  
    nnoesy     500  3182     yes  2.25   1.62   2.89   2.64    0.00    0.00     0.0    no       A    I  
    nnoesy     502  3184     yes  2.59   1.75   3.43   2.62    0.00    0.00     0.0    no       A    Q  
    nnoesy     504  3186     yes  3.22   1.92   4.51   4.27    0.00    0.00     0.0    no       A    Q  
    nnoesy     505  3187     yes  3.15   1.91   4.38   3.14    0.00    0.00     0.0    no       A    Q  
    nnoesy     506  3188     yes  2.89   1.84   3.93   3.89    0.00    0.01     0.0    no       A    Q  
    nnoesy     510  3192     yes  3.80   2.00   5.61   5.55    0.00    0.01     0.0    no       A    S  
    nnoesy     511  3193     yes  3.47   1.96   4.97   4.06    0.00    0.00     0.0    no       A    Q  
    nnoesy     515  3197     yes  3.33   1.94   4.71   4.59    0.00    0.00     0.0    no       A    I  
    nnoesy     517  3199     yes  2.87   1.84   3.89   3.25    0.00    0.00     0.0    no       A    I  
    nnoesy     518  3200     yes  2.67   1.78   3.57   2.37    0.00    0.00     0.0    no       A    I  
    nnoesy     519  3201     yes  3.54   1.97   5.11   3.92    0.00    0.00     0.0    no       A    S  
    nnoesy     521  3203     yes  2.58   1.75   3.40   2.61    0.00    0.00     0.0    no       A    Q  
    nnoesy     523  3204     yes  2.55   1.74   3.36   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy     524  3205     yes  2.86   1.84   3.89   3.37    0.00    0.00     0.0    no       A    Q  
    nnoesy     525  3206     yes  2.82   1.83   3.81   3.10    0.00    0.00     0.0    no       A    Q  
    nnoesy     528  3209     yes  3.65   1.98   5.32   4.10    0.00    0.00     0.0    no       A    Q  
    nnoesy     539  3218     yes  2.26   1.62   2.89   2.56    0.00    0.02     0.0    no       A    I  
    nnoesy     540  3219     yes  2.71   1.79   3.63   3.05    0.00    0.00     0.0    no       A    I  
    nnoesy     544  3223     yes  3.90   2.00   5.80   4.79    0.00    0.00     0.0    no       A    S  
    nnoesy     549  3225     yes  3.48   1.97   4.99   4.62    0.00    0.00     0.0    no       A    L  
    nnoesy     563  3235     yes  3.39   1.95   4.82   2.07    0.05    0.00     0.0    no       A    Q  
    nnoesy     569  3241     yes  3.92   2.00   5.84   4.94    0.00    0.00     0.0    no       A    S  
    nnoesy     570  3242     yes  3.50   1.97   5.04   4.41    0.00    0.00     0.0    no       A    S  
    nnoesy     571  3243     yes  2.56   1.74   3.38   2.68    0.00    0.00     0.0    no       A    Q  
    nnoesy     572  3244     yes  3.27   1.93   4.61   4.58    0.00    0.04     0.0    no       A    S  
    nnoesy     573  3245     yes  2.57   1.74   3.40   2.80    0.00    0.00     0.0    no       A    Q  
    nnoesy     593  3264     yes  2.20   1.60   2.81   2.43    0.00    0.00     0.0    no       A    Q  
    nnoesy     596  3267     yes  3.59   1.98   5.20   3.76    0.00    0.00     0.0    no       A    S  
    nnoesy     599  3269     yes  3.00   1.87   4.12   3.64    0.00    0.00     0.0    no       A    Q  
    nnoesy     602  3272     yes  3.73   1.99   5.46   4.20    0.00    0.00     0.0    no       A    Q  
    nnoesy     606  3276     yes  3.60   1.98   5.22   4.59    0.00    0.00     0.0    no       A    S  
    nnoesy     611  3281     yes  2.83   1.83   3.84   2.82    0.00    0.00     0.0    no       A    I  
    nnoesy     613  3283     yes  3.10   1.90   4.31   3.71    0.00    0.02     0.0    no       A    S  
    nnoesy     614  3284     yes  2.86   1.84   3.88   2.29    0.00    0.00     0.0    no       A    Q  
    nnoesy     619  3289     yes  3.88   2.00   5.76   4.77    0.00    0.00     0.0    no       A    Q  
    nnoesy     621  3291     yes  2.39   1.68   3.11   2.23    0.00    0.00     0.0    no       A    I  
    nnoesy     622  3292     yes  2.43   1.69   3.16   2.61    0.00    0.00     0.0    no       A    I  
    nnoesy     628  3298     yes  2.76   1.81   3.71   3.58    0.00    0.00     0.0    no       A    I  
    nnoesy     629  3299     yes  2.87   1.84   3.91   2.67    0.00    0.00     0.0    no       A    I  
    nnoesy     631  3301     yes  3.71   1.99   5.44   3.45    0.00    0.00     0.0    no       A    L  
    nnoesy     653  3307     yes  2.43   1.69   3.17   2.24    0.00    0.00     0.0    no       A    Q  
    nnoesy     656  3309     yes  2.51   1.72   3.30   2.23    0.00    0.00     0.0    no       A    I  
    nnoesy     661  3312     yes  3.12   1.90   4.34   3.35    0.00    0.00     0.0    no       A    L  
    nnoesy     667  3315     yes  3.52   1.97   5.06   4.68    0.00    0.03     0.0    no       A    L  
    nnoesy     668  3316     yes  3.05   1.89   4.22   2.20    0.07    0.00     0.0    no       A    L  
    nnoesy     669  3317     yes  3.65   1.98   5.31   3.37    0.06    0.00     0.0    no       A    Q  
    nnoesy     670  3318     yes  3.19   1.92   4.47   2.89    0.00    0.00     0.0    no       A    I  
    nnoesy     676  3324     yes  2.53   1.73   3.33   3.09    0.00    0.17    28.6    no       A    I  
    nnoesy     679  3327     yes  3.69   1.99   5.38   5.32    0.00    0.13    42.9    no       A    L  
    nnoesy     681  3329     yes  3.32   1.94   4.70   4.23    0.00    0.00     0.0    no       A    Q  
    nnoesy     683  3331     yes  3.55   1.97   5.12   4.47    0.00    0.00     0.0    no       A    S  
    nnoesy     684  3332     yes  3.59   1.98   5.19   4.61    0.00    0.00     0.0    no       A    S  
    nnoesy     689  3337     yes  3.31   1.94   4.68   3.53    0.00    0.00     0.0    no       A    Q  
    nnoesy     691  3339     yes  3.55   1.97   5.12   3.77    0.00    0.00     0.0    no       A    M  
    nnoesy     693  3341     yes  2.37   1.67   3.06   3.15    0.00    0.13    57.1   yes       A    I  
    nnoesy     694  3342     yes  2.66   1.77   3.54   2.50    0.00    0.00     0.0    no       A    Q  
    nnoesy     702  3350     yes  2.64   1.77   3.51   2.42    0.00    0.00     0.0    no       A    Q  
    nnoesy     703  3351     yes  2.54   1.73   3.35   2.34    0.00    0.00     0.0    no       A    Q  
    nnoesy     704  3352     yes  3.75   1.99   5.51   4.45    0.00    0.01     0.0    no       A    Q  
    nnoesy     705  3353     yes  3.92   2.00   5.84   4.13    0.00    0.00     0.0    no       A    L  
    nnoesy     708  3356     yes  3.05   1.89   4.21   3.50    0.00    0.00     0.0    no       A    Q  
    nnoesy     712  3359     yes  2.71   1.79   3.62   2.59    0.00    0.00     0.0    no       A    I  
    nnoesy     713  3360     yes  3.71   1.99   5.44   4.15    0.00    0.00     0.0    no       A    Q  
    nnoesy     718  3365     yes  3.58   1.98   5.18   3.99    0.00    0.00     0.0    no       A    Q  
    nnoesy     723  3366     yes  3.19   1.92   4.45   3.23    0.00    0.00     0.0    no       A    S  
    nnoesy     725  3368     yes  3.40   1.95   4.84   4.80    0.00    0.06    14.3    no       A    Q  
    nnoesy     726  3369     yes  2.71   1.79   3.63   2.80    0.00    0.00     0.0    no       A    I  
    nnoesy     735  3378     yes  3.31   1.94   4.69   4.16    0.00    0.00     0.0    no       A    Q  
    nnoesy     736  3379     yes  3.08   1.89   4.27   3.22    0.00    0.00     0.0    no       A    Q  
    nnoesy     740  3383     yes  2.69   1.79   3.59   2.91    0.00    0.01     0.0    no       A    I  
    nnoesy     741  3384     yes  2.53   1.73   3.33   3.12    0.00    0.19    14.3    no       A    I  
    nnoesy     746  3389     yes  2.95   1.86   4.04   3.77    0.00    0.00     0.0    no       A    I  
    nnoesy     747  3390     yes  3.94   2.00   5.88   5.77    0.00    0.02     0.0    no       A    S  
    nnoesy     748  3391     yes  2.47   1.71   3.23   2.47    0.00    0.00     0.0    no       A    I  
    nnoesy     749  3392     yes  3.78   1.99   5.56   5.00    0.00    0.00     0.0    no       A    L  
    nnoesy     750  3393     yes  2.60   1.76   3.45   2.79    0.00    0.00     0.0    no       A    Q  
    nnoesy     753  3396     yes  3.03   1.88   4.18   2.50    0.00    0.00     0.0    no       A    S  
    nnoesy     754  3397     yes  2.38   1.67   3.09   2.35    0.00    0.00     0.0    no       A    I  
    nnoesy     769  3410     yes  3.19   1.92   4.46   3.26    0.01    0.00     0.0    no       A    Q  
    nnoesy     776  3413     yes  2.39   1.68   3.11   2.71    0.00    0.00     0.0    no       A    I  
    nnoesy     779  3415     yes  2.22   1.60   2.84   2.74    0.00    0.00     0.0    no       A    Q  
    nnoesy     790  3420     yes  2.67   1.78   3.56   2.56    0.00    0.00     0.0    no       A    Q  
    nnoesy     791  3421     yes  3.12   1.90   4.34   4.40    0.00    0.08    42.9    no       A    Q  
    nnoesy     793  3423     yes  3.64   1.98   5.29   4.00    0.00    0.00     0.0    no       A    S  
    nnoesy     796  3426     yes  2.75   1.81   3.70   3.00    0.00    0.00     0.0    no       A    Q  
    nnoesy     797  3427     yes  3.76   1.99   5.52   4.53    0.00    0.00     0.0    no       A    I  
    nnoesy     799  3429     yes  2.67   1.78   3.57   2.82    0.00    0.00     0.0    no       A    I  
    nnoesy     803  3433     yes  2.48   1.71   3.26   2.17    0.00    0.00     0.0    no       A    I  
    nnoesy     804  3434     yes  2.53   1.73   3.32   3.07    0.00    0.00     0.0    no       A    I  
    nnoesy     805  3435     yes  2.40   1.68   3.12   2.69    0.00    0.13    14.3    no       A    I  
    nnoesy     807  3437     yes  2.96   1.86   4.05   2.55    0.00    0.00     0.0    no       A    Q  
    nnoesy     810  3440     yes  3.17   1.91   4.43   3.82    0.00    0.00     0.0    no       A    Q  
    nnoesy     812  3442     yes  2.89   1.85   3.94   2.60    0.00    0.00     0.0    no       A    M  
    nnoesy     815  3445     yes  3.74   1.99   5.49   4.24    0.00    0.00     0.0    no       A    Q  
    nnoesy     819  3449     yes  3.43   1.96   4.89   2.91    0.00    0.00     0.0    no       A    I  
    nnoesy     820  3450     yes  2.58   1.75   3.41   2.72    0.00    0.00     0.0    no       A    I  
    nnoesy     822  3452     yes  3.56   1.98   5.15   4.33    0.00    0.00     0.0    no       A    Q  
    nnoesy     823  3453     yes  2.77   1.81   3.73   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy     824  3454     yes  2.60   1.75   3.44   2.82    0.00    0.12    28.6    no       A    I  
    nnoesy     825  3455     yes  3.06   1.89   4.22   3.45    0.00    0.00     0.0    no       A    Q  
    nnoesy     827  3457     yes  3.29   1.94   4.64   3.82    0.00    0.00     0.0    no       A    I  
    nnoesy     828  3458     yes  2.89   1.85   3.94   2.38    0.05    0.04     0.0    no       A    Q  
    nnoesy     829  3459     yes  2.98   1.87   4.09   2.79    0.00    0.00     0.0    no       A    I  
    nnoesy     833  3463     yes  3.55   1.97   5.13   3.79    0.00    0.00     0.0    no       A    Q  
    nnoesy     834  3464     yes  2.66   1.77   3.54   2.64    0.00    0.00     0.0    no       A    Q  
    nnoesy     837  3466     yes  3.76   1.99   5.52   4.43    0.00    0.00     0.0    no       A    S  
    nnoesy     838  3467     yes  2.56   1.74   3.38   2.67    0.00    0.00     0.0    no       A    Q  
    nnoesy     842  3471     yes  2.71   1.79   3.63   3.53    0.00    0.00     0.0    no       A    I  
    nnoesy     847  3476     yes  2.57   1.75   3.40   2.09    0.00    0.00     0.0    no       A    Q  
    nnoesy     852  3481     yes  3.60   1.98   5.22   2.94    0.00    0.00     0.0    no       A    L  
    nnoesy     855  3484     yes  3.33   1.94   4.71   2.65    0.00    0.00     0.0    no       A    Q  
    nnoesy     856  3485     yes  2.96   1.87   4.06   2.40    0.00    0.00     0.0    no       A    Q  
    nnoesy     859  3487     yes  2.85   1.84   3.87   3.54    0.00    0.00     0.0    no       A    Q  
    nnoesy     862  3490     yes  2.90   1.85   3.94   2.91    0.00    0.00     0.0    no       A    Q  
    nnoesy     863  3491     yes  2.62   1.76   3.48   2.51    0.00    0.00     0.0    no       A    I  
    nnoesy     866  3492     yes  3.72   1.99   5.45   3.98    0.00    0.00     0.0    no       A    Q  
    nnoesy     870  3495     yes  3.27   1.93   4.61   4.05    0.00    0.00     0.0    no       A    S  
    nnoesy     873  3497     yes  3.24   1.93   4.55   3.67    0.00    0.00     0.0    no       A    M  
    nnoesy     876  3500     yes  2.73   1.80   3.65   2.48    0.00    0.00     0.0    no       A    I  
    nnoesy     878  3502     yes  2.86   1.84   3.87   3.46    0.00    0.00     0.0    no       A    Q  
    nnoesy     879  3503     yes  3.52   1.97   5.07   4.83    0.00    0.00     0.0    no       A    S  
    nnoesy     883  3507     yes  2.53   1.73   3.33   2.52    0.00    0.00     0.0    no       A    I  
    nnoesy     884  3508     yes  3.56   1.98   5.14   4.72    0.00    0.00     0.0    no       A    S  
    nnoesy     890  3514     yes  3.51   1.97   5.06   4.92    0.00    0.00     0.0    no       A    Q  
    nnoesy     891  3515     yes  2.45   1.70   3.20   3.27    0.00    0.07    14.3    no       A    I  
    nnoesy     893  3517     yes  2.85   1.83   3.86   2.88    0.00    0.00     0.0    no       A    Q  
    nnoesy     895  3519     yes  2.65   1.77   3.53   2.54    0.00    0.00     0.0    no       A    I  
    nnoesy     896  3520     yes  2.99   1.87   4.10   3.83    0.00    0.00     0.0    no       A    Q  
    nnoesy     897  3521     yes  2.45   1.70   3.21   2.33    0.00    0.00     0.0    no       A    I  
    nnoesy     900  3524     yes  2.69   1.78   3.59   2.85    0.00    0.00     0.0    no       A    Q  
    nnoesy     901  3525     yes  3.41   1.96   4.87   2.77    0.08    0.00    14.3    no       A    Q  
    nnoesy     909  3533     yes  3.47   1.96   4.97   3.55    0.00    0.00     0.0    no       A    Q  
    nnoesy     910  3534     yes  2.55   1.74   3.36   3.10    0.00    0.00     0.0    no       A    I  
    nnoesy     912  3536     yes  2.69   1.79   3.59   2.52    0.00    0.00     0.0    no       A    I  
    nnoesy     917  3541     yes  3.82   2.00   5.65   4.17    0.00    0.00     0.0    no       A    Q  
    nnoesy     918  3542     yes  3.51   1.97   5.05   3.57    0.00    0.00     0.0    no       A    M  
    nnoesy     919  3543     yes  2.78   1.81   3.74   2.50    0.00    0.00     0.0    no       A    Q  
    nnoesy     921  3545     yes  2.86   1.84   3.88   2.84    0.00    0.00     0.0    no       A    I  
    nnoesy     923  3547     yes  2.84   1.83   3.86   3.45    0.00    0.00     0.0    no       A    Q  
    nnoesy     927  3551     yes  3.30   1.94   4.67   3.33    0.00    0.00     0.0    no       A    Q  
    nnoesy     931  3555     yes  3.56   1.98   5.14   3.93    0.00    0.00     0.0    no       A    S  
    nnoesy     932  3556     yes  3.68   1.99   5.37   2.84    0.00    0.00     0.0    no       A    Q  
    nnoesy     935  3558     yes  2.89   1.85   3.94   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy     936  3559     yes  2.58   1.75   3.41   2.69    0.00    0.00     0.0    no       A    I  
    nnoesy     937  3560     yes  2.37   1.67   3.08   2.51    0.00    0.00     0.0    no       A    Q  
    nnoesy     938  3561     yes  3.98   2.00   5.96   4.99    0.00    0.00     0.0    no       A    Q  
    nnoesy     940  3563     yes  3.99   2.00   5.99   5.71    0.00    0.01     0.0    no       A    S  
    nnoesy     942  3565     yes  2.86   1.84   3.88   3.35    0.00    0.09     0.0    no       A    I  
    nnoesy     943  3566     yes  3.11   1.90   4.31   3.30    0.00    0.00     0.0    no       A    I  
    nnoesy     944  3567     yes  2.59   1.75   3.43   2.84    0.00    0.00     0.0    no       A    I  
    nnoesy     946  3569     yes  2.67   1.78   3.56   3.51    0.00    0.02     0.0    no       A    Q  
    nnoesy     947  3570     yes  3.99   2.00   5.99   4.83    0.00    0.00     0.0    no       A    L  
    nnoesy     948  3571     yes  3.42   1.96   4.89   4.47    0.00    0.00     0.0    no       A    Q  
    nnoesy     949  3572     yes  3.29   1.94   4.64   4.11    0.00    0.00     0.0    no       A    Q  
    nnoesy     955  3575     yes  2.82   1.83   3.82   2.92    0.00    0.00     0.0    no       A    I  
    nnoesy     957  3577     yes  2.19   1.59   2.79   2.25    0.00    0.00     0.0    no       A    Q  
    nnoesy     964  3584     yes  3.74   1.99   5.48   3.86    0.00    0.00     0.0    no       A    Q  
    nnoesy     968  3587     yes  3.54   1.97   5.10   4.15    0.00    0.00     0.0    no       A    L  
    nnoesy     969  3588     yes  3.18   1.92   4.45   3.32    0.00    0.00     0.0    no       A    Q  
    nnoesy     971  3590     yes  2.57   1.75   3.40   2.90    0.00    0.04     0.0    no       A    I  
    nnoesy     972  3591     yes  3.74   1.99   5.49   5.36    0.00    0.01     0.0    no       A    Q  
    nnoesy     981  3599     yes  2.41   1.68   3.14   2.53    0.00    0.00     0.0    no       A    Q  
    nnoesy     984  3602     yes  2.93   1.86   3.99   2.44    0.00    0.00     0.0    no       A    I  
    nnoesy     986  3604     yes  2.28   1.63   2.92   2.49    0.00    0.00     0.0    no       A    I  
    nnoesy     987  3605     yes  2.93   1.86   4.00   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy     989  3607     yes  3.37   1.95   4.79   3.93    0.00    0.00     0.0    no       A    Q  
    nnoesy     990  3608     yes  3.62   1.98   5.26   3.97    0.00    0.00     0.0    no       A    Q  
    nnoesy     992  3610     yes  3.87   2.00   5.74   3.95    0.01    0.00     0.0    no       A    S  
    nnoesy     993  3611     yes  2.49   1.71   3.26   2.58    0.00    0.00     0.0    no       A    Q  
    nnoesy     994  3612     yes  2.48   1.71   3.25   2.90    0.00    0.00     0.0    no       A    Q  
    nnoesy     996  3614     yes  2.21   1.60   2.82   2.85    0.00    0.04     0.0    no       A    I  
    nnoesy     997  3615     yes  3.78   1.99   5.57   3.95    0.00    0.00     0.0    no       A    S  
    nnoesy    1007  3624     yes  2.98   1.87   4.08   3.17    0.05    0.13    14.3    no       A    Q  
    nnoesy    1011  3628     yes  2.92   1.86   3.99   3.71    0.00    0.22    71.4   yes       A    Q  
    nnoesy    1013  3630     yes  2.37   1.67   3.07   2.79    0.00    0.11    14.3    no       A    Q  
    nnoesy    1015  3632     yes  2.43   1.69   3.17   2.76    0.00    0.00     0.0    no       A    I  
    nnoesy    1017  3633     yes  3.79   1.99   5.59   3.74    0.00    0.00     0.0    no       A    S  
    nnoesy    1023  3637     yes  3.93   2.00   5.85   4.46    0.00    0.00     0.0    no       A    Q  
    nnoesy    1024  3638     yes  4.01   2.00   6.01   5.13    0.00    0.00     0.0    no       A    M  
    nnoesy    1030  3644     yes  3.65   1.98   5.32   3.96    0.00    0.00     0.0    no       A    S  
    nnoesy    1031  3645     yes  3.53   1.97   5.10   4.38    0.00    0.00     0.0    no       A    I  
    nnoesy    1034  3648     yes  3.46   1.96   4.96   4.32    0.00    0.00     0.0    no       A    S  
    nnoesy    1036  3650     yes  2.72   1.79   3.64   2.79    0.00    0.00     0.0    no       A    I  
    nnoesy    1040  3651     yes  3.13   1.90   4.35   2.93    0.00    0.00     0.0    no       A    Q  
    nnoesy    1042  3653     yes  2.67   1.78   3.56   2.35    0.00    0.00     0.0    no       A    Q  
    nnoesy    1063  3660     yes  3.21   1.92   4.49   3.08    0.00    0.00     0.0    no       A    Q  
    nnoesy    1067  3663     yes  3.56   1.98   5.14   3.61    0.00    0.00     0.0    no       A    L  
    nnoesy    1070  3666     yes  3.58   1.98   5.18   4.08    0.00    0.00     0.0    no       A    S  
    nnoesy    1073  3669     yes  3.47   1.96   4.97   3.19    0.00    0.00     0.0    no       A    Q  
    nnoesy    1074  3670     yes  3.67   1.99   5.36   4.68    0.00    0.12    14.3    no       A    L  
    nnoesy    1076  3671     yes  2.81   1.82   3.80   2.94    0.00    0.00     0.0    no       A    I  
    nnoesy    1082  3677     yes  2.68   1.78   3.57   3.03    0.00    0.00     0.0    no       A    Q  
    nnoesy    1084  3679     yes  2.56   1.74   3.38   2.64    0.00    0.00     0.0    no       A    I  
    nnoesy    1085  3680     yes  2.74   1.80   3.68   3.55    0.00    0.20    14.3    no       A    I  
    nnoesy    1087  3682     yes  2.37   1.67   3.07   2.80    0.00    0.00     0.0    no       A    I  
    nnoesy    1098  3693     yes  2.55   1.74   3.37   2.90    0.00    0.00     0.0    no       A    I  
    nnoesy    1101  3694     yes  3.78   1.99   5.56   4.20    0.00    0.00     0.0    no       A    M  
    nnoesy    1102  3695     yes  2.73   1.80   3.66   3.44    0.00    0.00     0.0    no       A    Q  
    nnoesy    1104  3697     yes  3.27   1.93   4.60   4.59    0.00    0.01     0.0    no       A    Q  
    nnoesy    1105  3698     yes  3.14   1.91   4.38   4.13    0.00    0.00     0.0    no       A    Q  
    nnoesy    1106  3699     yes  2.49   1.71   3.26   3.06    0.00    0.06     0.0    no       A    I  
    nnoesy    1109  3702     yes  2.60   1.75   3.44   2.26    0.00    0.00     0.0    no       A    S  
    nnoesy    1110  3703     yes  2.86   1.84   3.88   3.45    0.00    0.00     0.0    no       A    S  
    nnoesy    1112  3705     yes  3.98   2.00   5.95   4.32    0.00    0.00     0.0    no       A    S  
    nnoesy    1114  3707     yes  3.28   1.93   4.62   3.55    0.00    0.00     0.0    no       A    S  
    nnoesy    1115  3708     yes  2.60   1.75   3.44   2.55    0.00    0.00     0.0    no       A    Q  
    nnoesy    1116  3709     yes  2.60   1.76   3.45   1.86    0.00    0.00     0.0    no       A    Q  
    nnoesy    1117  3710     yes  4.01   2.00   6.03   4.52    0.00    0.00     0.0    no       A    S  
    nnoesy    1118  3711     yes  2.86   1.84   3.89   2.93    0.00    0.00     0.0    no       A    I  
    nnoesy    1123  3716     yes  3.62   1.98   5.26   4.36    0.00    0.00     0.0    no       A    S  
    nnoesy    1124  3717     yes  2.31   1.64   2.98   2.26    0.00    0.00     0.0    no       A    I  
    nnoesy    1125  3718     yes  3.41   1.96   4.86   4.08    0.00    0.00     0.0    no       A    Q  
    nnoesy    1129  3722     yes  2.77   1.81   3.74   2.91    0.00    0.00     0.0    no       A    I  
    nnoesy    1130  3723     yes  3.39   1.95   4.82   3.52    0.00    0.00     0.0    no       A    Q  
    nnoesy    1133  3726     yes  3.83   2.00   5.66   5.69    0.00    0.07    14.3    no       A    Q  
    nnoesy    1134  3727     yes  3.10   1.90   4.30   3.52    0.00    0.00     0.0    no       A    Q  
    nnoesy    1145  3729     yes  3.73   1.99   5.47   4.50    0.00    0.00     0.0    no       A    Q  
    nnoesy    1146  3730     yes  2.98   1.87   4.09   3.61    0.00    0.10    14.3    no       A    L  
    nnoesy    1147  3731     yes  3.26   1.93   4.59   3.82    0.00    0.00     0.0    no       A    S  
    nnoesy    1149  3733     yes  2.55   1.74   3.37   2.11    0.00    0.00     0.0    no       A    Q  
    nnoesy    1150  3734     yes  2.52   1.73   3.32   2.89    0.00    0.14    42.9    no       A    Q  
    nnoesy    1151  3735     yes  2.95   1.86   4.04   3.35    0.00    0.00     0.0    no       A    Q  
    nnoesy    1152  3736     yes  2.80   1.82   3.78   2.87    0.00    0.00     0.0    no       A    I  
    nnoesy    1156  3740     yes  3.02   1.88   4.15   3.73    0.00    0.00     0.0    no       A    S  
    nnoesy    1160  3744     yes  3.02   1.88   4.17   2.44    0.00    0.00     0.0    no       A    I  
    nnoesy    1161  3745     yes  3.01   1.88   4.14   3.59    0.00    0.00     0.0    no       A    I  
    nnoesy    1164  3748     yes  2.58   1.75   3.42   3.00    0.00    0.10    14.3    no       A    Q  
    nnoesy    1168  3752     yes  3.10   1.90   4.31   2.77    0.00    0.00     0.0    no       A    L  
    nnoesy    1169  3753     yes  3.49   1.97   5.00   4.29    0.00    0.00     0.0    no       A    S  
    nnoesy    1174  3756     yes  3.96   2.00   5.93   4.77    0.00    0.00     0.0    no       A    Q  
    nnoesy    1175  3757     yes  3.39   1.95   4.82   3.83    0.00    0.00     0.0    no       A    S  
    nnoesy    1179  3761     yes  3.99   2.00   5.99   4.73    0.00    0.00     0.0    no       A    S  
    nnoesy    1185  3763     yes  3.63   1.98   5.27   4.13    0.00    0.00     0.0    no       A    S  
    nnoesy    1187  3765     yes  2.60   1.75   3.44   2.79    0.00    0.00     0.0    no       A    I  
    nnoesy    1189  3767     yes  3.74   1.99   5.49   3.95    0.00    0.00     0.0    no       A    M  
    nnoesy    1190  3768     yes  3.65   1.98   5.32   4.69    0.00    0.00     0.0    no       A    Q  
    nnoesy    1197  3774     yes  3.04   1.89   4.20   3.33    0.00    0.00     0.0    no       A    S  
    nnoesy    1198  3775     yes  3.75   1.99   5.50   4.34    0.00    0.00     0.0    no       A    S  
    nnoesy    1199  3776     yes  3.72   1.99   5.45   4.50    0.00    0.00     0.0    no       A    S  
    nnoesy    1200  3777     yes  2.77   1.81   3.73   3.70    0.00    0.03     0.0    no       A    I  
    nnoesy    1201  3778     yes  2.61   1.76   3.46   2.60    0.00    0.00     0.0    no       A    I  
    nnoesy    1203  3780     yes  3.35   1.95   4.75   3.50    0.00    0.00     0.0    no       A    Q  
    nnoesy    1208  3785     yes  2.75   1.80   3.69   2.77    0.00    0.00     0.0    no       A    I  
    nnoesy    1226  3793     yes  3.68   1.99   5.38   4.84    0.00    0.00     0.0    no       A    Q  
    nnoesy    1227  3794     yes  3.57   1.98   5.16   4.35    0.00    0.00     0.0    no       A    Q  
    nnoesy    1231  3796     yes  2.99   1.87   4.10   3.66    0.00    0.00     0.0    no       A    S  
    nnoesy    1233  3797     yes  3.55   1.98   5.13   3.48    0.00    0.00     0.0    no       A    L  
    nnoesy    1238  3801     yes  3.94   2.00   5.88   5.28    0.00    0.00     0.0    no       A    Q  
    nnoesy    1240  3803     yes  3.46   1.96   4.95   3.75    0.00    0.00     0.0    no       A    S  
    nnoesy    1244  3807     yes  3.62   1.98   5.25   3.62    0.00    0.00     0.0    no       A    M  
    nnoesy    1245  3808     yes  3.24   1.93   4.54   4.20    0.00    0.00     0.0    no       A    Q  
    nnoesy    1294  3810     yes  3.46   1.96   4.95   4.11    0.00    0.00     0.0    no       A    Q  
    nnoesy    1297  3813     yes  3.54   1.97   5.10   3.95    0.00    0.00     0.0    no       A    S  
    nnoesy    1299  3814     yes  2.63   1.76   3.49   2.56    0.00    0.00     0.0    no       A    Q  
    nnoesy    1301  3816     yes  2.54   1.73   3.34   2.46    0.00    0.00     0.0    no       A    Q  
    nnoesy    1309  3821     yes  3.14   1.91   4.36   3.49    0.00    0.00     0.0    no       A    Q  
    nnoesy    1312  3824     yes  3.85   2.00   5.70   5.65    0.00    0.04     0.0    no       A    S  
    nnoesy    1325  3832     yes  3.20   1.92   4.48   4.30    0.00    0.10    14.3    no       A    Q  
    nnoesy    1330  3836     yes  2.91   1.85   3.97   3.69    0.00    0.03     0.0    no       A    Q  
    nnoesy    1333  3838     yes  4.01   2.00   6.01   7.50    0.00    2.27    57.1   yes       A    L  
    nnoesy    1340  3843     yes  2.23   1.61   2.85   2.19    0.00    0.00     0.0    no       A    Q  
    nnoesy    1350  3850     yes  3.08   1.89   4.26   4.19    0.00    0.02     0.0    no       A    Q  
    nnoesy    1355  3854     yes  2.49   1.72   3.27   2.60    0.00    0.00     0.0    no       A    I  
    nnoesy    1361  3859     yes  3.91   2.00   5.82   5.12    0.00    0.00     0.0    no       A    L  
    nnoesy    1406  3862     yes  3.52   1.97   5.07   4.76    0.00    0.01     0.0    no       A    Q  
    nnoesy    1408  3864     yes  3.20   1.92   4.48   3.55    0.00    0.00     0.0    no       A    M  
    nnoesy    1413  3867     yes  3.09   1.90   4.29   2.95    0.00    0.00     0.0    no       A    I  
    nnoesy    1415  3869     yes  3.70   1.99   5.41   3.52    0.00    0.00     0.0    no       A    M  
    nnoesy    1419  3871     yes  3.60   1.98   5.23   4.34    0.00    0.00     0.0    no       A    Q  
    nnoesy    1422  3874     yes  2.97   1.87   4.07   2.31    0.00    0.00     0.0    no       A    I  
    nnoesy    1423  3875     yes  2.86   1.84   3.89   3.44    0.00    0.00     0.0    no       A    I  
    nnoesy    1463  3879     yes  3.86   2.00   5.72   4.88    0.00    0.03     0.0    no       A    S  
    nnoesy    1466  3882     yes  2.53   1.73   3.33   2.73    0.00    0.00     0.0    no       A    I  
    nnoesy    1470  3886     yes  3.40   1.96   4.85   4.54    0.00    1.03    14.3    no       A    S  
    nnoesy    1502  3894     yes  2.71   1.79   3.63   3.10    0.00    0.00     0.0    no       A    Q  
    nnoesy    1508  3897     yes  3.47   1.96   4.97   3.82    0.00    0.00     0.0    no       A    Q  
    nnoesy    1509  3898     yes  3.40   1.96   4.85   3.57    0.03    0.00     0.0    no       A    Q  
    nnoesy    1510  3899     yes  3.78   1.99   5.57   3.80    0.00    0.00     0.0    no       A    S  
    nnoesy    1518  3906     yes  3.71   1.99   5.44   4.12    0.00    0.00     0.0    no       A    S  
    nnoesy    1520  3908     yes  3.48   1.97   5.00   3.70    0.00    0.00     0.0    no       A    Q  
    nnoesy    1524  3911     yes  3.50   1.97   5.04   4.22    0.00    0.00     0.0    no       A    S  
    nnoesy    1525  3912     yes  2.45   1.70   3.19   2.55    0.00    0.00     0.0    no       A    Q  
    nnoesy    1529  3914     yes  2.58   1.75   3.40   3.39    0.00    0.07     0.0    no       A    Q  
    nnoesy    1532  3917     yes  3.34   1.95   4.74   3.17    0.00    0.00     0.0    no       A    S  
    nnoesy    1533  3918     yes  3.02   1.88   4.16   2.89    0.00    0.00     0.0    no       A    Q  
    nnoesy    1535  3920     yes  3.87   2.00   5.74   4.54    0.00    0.00     0.0    no       A    S  
    nnoesy    1538  3923     yes  3.63   1.98   5.28   3.08    0.00    0.00     0.0    no       A    Q  
    nnoesy    1540  3924     yes  2.96   1.87   4.06   2.30    0.00    0.00     0.0    no       A    Q  
    nnoesy    1541  3925     yes  2.76   1.81   3.70   3.30    0.00    0.00     0.0    no       A    Q  
    nnoesy    1542  3926     yes  2.47   1.71   3.22   2.48    0.00    0.00     0.0    no       A    I  
    nnoesy    1544  3928     yes  2.35   1.66   3.03   2.72    0.00    0.00     0.0    no       A    I  
    nnoesy    1546  3930     yes  3.72   1.99   5.45   4.66    0.00    0.00     0.0    no       A    S  
    nnoesy    1551  3934     yes  3.62   1.98   5.25   4.27    0.00    0.00     0.0    no       A    Q  
    nnoesy    1552  3935     yes  3.55   1.98   5.13   3.56    0.00    0.00     0.0    no       A    S  
    nnoesy    1559  3940     yes  2.55   1.74   3.36   3.14    0.00    0.00     0.0    no       A    Q  
    nnoesy    1562  3943     yes  2.55   1.74   3.36   3.31    0.00    0.02     0.0    no       A    Q  
    nnoesy    1563  3944     yes  3.70   1.99   5.42   4.09    0.00    0.00     0.0    no       A    M  
    nnoesy    1564  3945     yes  3.90   2.00   5.80   2.86    0.00    0.00     0.0    no       A    S  
    nnoesy    1565  3946     yes  4.01   2.00   6.03   4.06    0.00    0.00     0.0    no       A    S  
    nnoesy    1566  3947     yes  3.58   1.98   5.18   4.54    0.00    0.00     0.0    no       A    M  
    nnoesy    1567  3948     yes  3.05   1.89   4.22   3.06    0.00    0.00     0.0    no       A    M  
    nnoesy    1568  3949     yes  3.19   1.92   4.46   3.71    0.00    0.00     0.0    no       A    M  
    nnoesy    1569  3950     yes  2.84   1.83   3.85   2.67    0.00    0.04     0.0    no       A    M  
    nnoesy    1570  3951     yes  3.67   1.99   5.35   5.19    0.00    0.10    28.6    no       A    M  
    nnoesy    1571  3952     yes  2.78   1.81   3.74   2.80    0.00    0.00     0.0    no       A    Q  
    nnoesy    1574  3955     yes  3.98   2.00   5.96   5.18    0.00    0.00     0.0    no       A    S  
    nnoesy    1580  3961     yes  2.75   1.80   3.69   2.47    0.00    0.00     0.0    no       A    Q  
    nnoesy    1583  3964     yes  3.95   2.00   5.91   5.18    0.00    0.00     0.0    no       A    Q  
    nnoesy    1585  3966     yes  4.01   2.00   6.03   4.88    0.00    0.00     0.0    no       A    S  
    nnoesy    1586  3967     yes  3.62   1.98   5.26   4.62    0.00    0.00     0.0    no       A    Q  
    nnoesy    1587  3968     yes  4.20   2.00   6.40   5.01    0.00    0.00     0.0    no       A    Q  
    nnoesy    1590  3971     yes  3.81   2.00   5.62   3.80    0.00    0.00     0.0    no       A    S  
    nnoesy    1596  3975     yes  2.60   1.76   3.45   2.81    0.00    0.00     0.0    no       A    Q  
    nnoesy    1600  3978     yes  2.66   1.77   3.54   2.56    0.00    0.00     0.0    no       A    Q  
    nnoesy    1601  3979     yes  2.29   1.64   2.95   2.17    0.00    0.00     0.0    no       A    Q  
    nnoesy    1605  3982     yes  2.80   1.82   3.78   2.72    0.00    0.00     0.0    no       A    Q  
    nnoesy    1606  3983     yes  2.56   1.74   3.38   2.41    0.07    0.02    14.3    no       A    Q  
    nnoesy    1614  3985     yes  2.69   1.78   3.59   2.73    0.00    0.00     0.0    no       A    Q  
    nnoesy    1618  3987     yes  3.97   2.00   5.94   5.90    0.00    0.15    28.6    no       A    M  
    cnoesy       9     1     yes  2.16   1.58   2.74   2.53    0.00    0.03     0.0    no       A    I  
    cnoesy      11     2     yes  2.32   1.65   2.99   3.25    0.00    0.27   100.0   yes       A    I  
    cnoesy      18     4     yes  2.33   1.65   3.00   2.80    0.00    0.00     0.0    no       A    I  
    cnoesy      20     6     yes  2.80   1.82   3.78   3.69    0.00    0.00     0.0    no       A    I  
    cnoesy      23     9     yes  3.12   1.90   4.33   4.40    0.00    0.07    14.3    no       A    L  
    cnoesy      24    10     yes  1.88   1.44   2.32   2.05    0.00    0.00     0.0    no       A    Q  
    cnoesy      28    14     yes  3.15   1.91   4.39   3.24    0.00    0.00     0.0    no       A    L  
    cnoesy      33    19     yes  2.19   1.59   2.79   2.52    0.00    0.00     0.0    no       A    L  
    cnoesy      35    21     yes  2.45   1.70   3.20   2.68    0.00    0.00     0.0    no       A    L  
    cnoesy      38    24     yes  2.63   1.77   3.50   3.03    0.00    0.00     0.0    no       A    L  
    cnoesy      46    32     yes  2.24   1.61   2.87   1.77    0.00    0.00     0.0    no       A    I  
    cnoesy      47    33     yes  3.15   1.91   4.39   2.60    0.00    0.00     0.0    no       A    L  
    cnoesy      53    39     yes  2.35   1.66   3.04   2.44    0.00    0.00     0.0    no       A    I  
    cnoesy      54    40     yes  2.98   1.87   4.08   3.50    0.00    0.07    14.3    no       A    I  
    cnoesy      57    42     yes  2.25   1.62   2.88   2.57    0.00    0.08     0.0    no       A    I  
    cnoesy      58    43     yes  2.39   1.68   3.11   2.81    0.00    0.00     0.0    no       A    I  
    cnoesy      73    49     yes  2.70   1.79   3.61   2.75    0.00    0.01     0.0    no       A    I  
    cnoesy      76    52     yes  2.23   1.61   2.86   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy      78    54     yes  2.39   1.68   3.11   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy      80    55     yes  3.15   1.91   4.39   4.00    0.00    0.01     0.0    no       A    M  
    cnoesy      81    56     yes  2.86   1.84   3.89   3.86    0.00    0.06     0.0    no       A    S  
    cnoesy      83    57     yes  2.58   1.75   3.41   2.89    0.00    0.91    28.6    no       A    I  
    cnoesy      85    58     yes  3.00   1.88   4.13   3.76    0.00    0.08    14.3    no       A    Q  
    cnoesy      95    67     yes  1.90   1.45   2.35   2.32    0.00    0.03     0.0    no       A    I  
    cnoesy     102    73     yes  3.09   1.90   4.28   4.85    0.00    0.57    85.7   yes       A    S  
    cnoesy     103    74     yes  2.55   1.74   3.36   3.49    0.00    0.35    85.7   yes       A    I  
    cnoesy     112    83     yes  2.06   1.53   2.58   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy     115    86     yes  1.79   1.39   2.19   2.07    0.00    0.00     0.0    no       A    I  
    cnoesy     116    87     yes  3.19   1.92   4.46   3.41    0.00    0.00     0.0    no       A    Q  
    cnoesy     118    88     yes  2.88   1.84   3.92   2.98    0.00    0.00     0.0    no       A    I  
    cnoesy     120    90     yes  2.42   1.69   3.15   2.86    0.00    0.00     0.0    no       A    I  
    cnoesy     124    92     yes  2.95   1.86   4.04   2.74    0.00    0.00     0.0    no       A    I  
    cnoesy     125    93     yes  2.48   1.71   3.25   3.02    0.00    0.00     0.0    no       A    S  
    cnoesy     126    94     yes  2.77   1.81   3.73   3.57    0.00    0.00     0.0    no       A    S  
    cnoesy     127    95     yes  2.63   1.76   3.49   2.32    0.00    0.00     0.0    no       A    L  
    cnoesy     130    97     yes  2.73   1.80   3.65   2.43    0.00    0.00     0.0    no       A    L  
    cnoesy     138   104     yes  3.07   1.89   4.26   4.13    0.00    0.00     0.0    no       A    I  
    cnoesy     139   105     yes  2.94   1.86   4.03   3.47    0.00    0.00     0.0    no       A    I  
    cnoesy     141   107     yes  2.72   1.79   3.64   2.99    0.00    0.00     0.0    no       A    I  
    cnoesy     143   109     yes  2.20   1.59   2.80   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy     145   111     yes  2.94   1.86   4.03   3.93    0.00    0.00     0.0    no       A    S  
    cnoesy     146   112     yes  2.44   1.70   3.19   2.74    0.00    0.00     0.0    no       A    I  
    cnoesy     147   113     yes  2.98   1.87   4.10   4.19    0.00    0.09    42.9    no       A    M  
    cnoesy     149   115     yes  2.80   1.82   3.78   3.67    0.00    0.01     0.0    no       A    I  
    cnoesy     152   118     yes  2.34   1.66   3.02   2.57    0.00    0.00     0.0    no       A    I  
    cnoesy     153   119     yes  2.48   1.71   3.25   3.00    0.00    0.00     0.0    no       A    I  
    cnoesy     156   122     yes  2.19   1.59   2.80   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy     159   125     yes  2.93   1.86   4.00   3.55    0.00    0.00     0.0    no       A    S  
    cnoesy     160   126     yes  2.65   1.77   3.52   2.87    0.00    0.00     0.0    no       A    I  
    cnoesy     161   127     yes  2.49   1.72   3.27   1.99    0.00    0.00     0.0    no       A    S  
    cnoesy     164   129     yes  2.86   1.84   3.88   2.45    0.00    0.00     0.0    no       A    I  
    cnoesy     167   132     yes  3.18   1.91   4.44   3.77    0.00    0.25    28.6    no       A    S  
    cnoesy     171   135     yes  2.72   1.80   3.65   2.44    0.00    0.00     0.0    no       A    I  
    cnoesy     175   138     yes  2.62   1.76   3.48   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy     176   139     yes  2.46   1.70   3.21   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy     177   140     yes  2.81   1.82   3.80   3.09    0.00    0.00     0.0    no       A    I  
    cnoesy     179   142     yes  2.84   1.83   3.85   2.99    0.00    0.00     0.0    no       A    I  
    cnoesy     186   149     yes  3.13   1.91   4.36   2.29    0.00    0.00     0.0    no       A    I  
    cnoesy     187   150     yes  2.62   1.76   3.48   2.60    0.00    0.00     0.0    no       A    I  
    cnoesy     189   151     yes  2.52   1.72   3.31   2.62    0.00    0.00     0.0    no       A    Q  
    cnoesy     192   153     yes  2.93   1.86   4.00   2.87    0.00    0.00     0.0    no       A    I  
    cnoesy     198   159     yes  2.52   1.73   3.31   2.31    0.00    0.02     0.0    no       A    L  
    cnoesy     207   168     yes  2.01   1.51   2.52   2.04    0.00    0.00     0.0    no       A    I  
    cnoesy     210   171     yes  2.04   1.52   2.56   2.44    0.00    0.05    14.3    no       A    I  
    cnoesy     213   173     yes  2.64   1.77   3.51   2.70    0.04    0.00     0.0    no       A    I  
    cnoesy     232   192     yes  2.91   1.85   3.97   3.96    0.00    0.12    28.6    no       A    Q  
    cnoesy     233   193     yes  2.03   1.51   2.54   1.69    0.00    0.00     0.0    no       A    I  
    cnoesy     234   194     yes  2.55   1.74   3.36   3.06    0.00    0.00     0.0    no       A    Q  
    cnoesy     235   195     yes  2.35   1.66   3.03   2.92    0.00    0.03     0.0    no       A    L  
    cnoesy     240   200     yes  2.34   1.65   3.02   2.66    0.00    0.04     0.0    no       A    S  
    cnoesy     241   201     yes  2.26   1.62   2.90   2.53    0.00    0.00     0.0    no       A    L  
    cnoesy     243   203     yes  2.89   1.85   3.94   3.53    0.00    0.00     0.0    no       A    L  
    cnoesy     244   204     yes  1.97   1.49   2.46   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy     246   206     yes  2.12   1.56   2.68   2.45    0.00    0.00     0.0    no       A    L  
    cnoesy     247   207     yes  1.77   1.38   2.16   2.07    0.00    0.00     0.0    no       A    I  
    cnoesy     287   246     yes  2.10   1.55   2.65   1.74    0.00    0.00     0.0    no       A    I  
    cnoesy     293   252     yes  2.03   1.51   2.54   2.54    0.00    0.04     0.0    no       A    I  
    cnoesy     294   253     yes  3.03   1.88   4.17   4.05    0.00    0.66    28.6    no       A    L  
    cnoesy     299   258     yes  1.94   1.47   2.42   2.07    0.00    0.00     0.0    no       A    I  
    cnoesy     302   261     yes  2.40   1.68   3.12   2.65    0.00    0.03     0.0    no       A    L  
    cnoesy     306   265     yes  1.97   1.49   2.46   2.10    0.00    0.11    14.3    no       A    Q  
    cnoesy     312   271     yes  1.98   1.49   2.48   2.13    0.00    0.00     0.0    no       A    I  
    cnoesy     313   272     yes  2.19   1.59   2.79   2.58    0.00    0.00     0.0    no       A    I  
    cnoesy     315   274     yes  2.98   1.87   4.09   4.09    0.00    0.02     0.0    no       A    S  
    cnoesy     320   279     yes  2.09   1.54   2.63   2.09    0.00    0.06     0.0    no       A    S  
    cnoesy     322   281     yes  2.42   1.69   3.15   1.67    0.02    0.00     0.0    no       A    I  
    cnoesy     323   282     yes  2.11   1.55   2.67   2.22    0.00    0.00     0.0    no       A    Q  
    cnoesy     324   283     yes  2.49   1.71   3.26   3.22    0.00    0.17    57.1   yes       A    Q  
    cnoesy     325   284     yes  2.69   1.79   3.60   3.67    0.00    0.09    42.9    no       A    S  
    cnoesy     326   285     yes  2.81   1.82   3.79   3.51    0.00    0.00     0.0    no       A    Q  
    cnoesy     330   289     yes  2.29   1.64   2.95   3.01    0.00    0.11    42.9    no       A    S  
    cnoesy     339   298     yes  2.20   1.59   2.80   2.18    0.00    0.00     0.0    no       A    Q  
    cnoesy     340   299     yes  2.50   1.72   3.29   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy     341   300     yes  2.48   1.71   3.25   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy     342   301     yes  1.84   1.42   2.26   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy     347   304     yes  2.41   1.68   3.14   2.00    0.00    0.00     0.0    no       A    Q  
    cnoesy     348   305     yes  3.11   1.90   4.32   3.25    0.00    0.00     0.0    no       A    L  
    cnoesy     349   306     yes  2.57   1.74   3.39   2.45    0.03    0.00     0.0    no       A    I  
    cnoesy     350   307     yes  2.78   1.81   3.75   3.84    0.00    0.09    42.9    no       A    I  
    cnoesy     351   308     yes  2.20   1.60   2.81   1.89    0.00    0.00     0.0    no       A    I  
    cnoesy     352   309     yes  2.78   1.81   3.75   3.51    0.00    0.00     0.0    no       A    Q  
    cnoesy     353   310     yes  2.23   1.61   2.85   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy     354   311     yes  2.89   1.85   3.94   3.88    0.00    0.09    28.6    no       A    L  
    cnoesy     359   316     yes  1.84   1.42   2.27   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy     363   320     yes  2.75   1.80   3.69   2.63    0.00    0.00     0.0    no       A    Q  
    cnoesy     366   323     yes  3.06   1.89   4.24   4.28    0.00    0.04     0.0    no       A    S  
    cnoesy     370   327     yes  2.89   1.85   3.93   3.23    0.00    0.00     0.0    no       A    S  
    cnoesy     372   329     yes  2.80   1.82   3.77   3.86    0.00    0.09    42.9    no       A    Q  
    cnoesy     379   336     yes  2.42   1.69   3.15   2.20    0.00    0.00     0.0    no       A    Q  
    cnoesy     385   342     yes  1.97   1.48   2.45   2.54    0.00    0.11    42.9    no       A    S  
    cnoesy     390   347     yes  2.05   1.52   2.57   2.24    0.00    0.00     0.0    no       A    L  
    cnoesy     391   348     yes  1.95   1.48   2.43   2.27    0.00    0.06    14.3    no       A    L  
    cnoesy     392   349     yes  2.85   1.83   3.86   3.45    0.00    0.00     0.0    no       A    I  
    cnoesy     393   350     yes  2.50   1.72   3.29   3.34    0.00    0.07    14.3    no       A    Q  
    cnoesy     394   351     yes  2.37   1.67   3.07   2.82    0.00    0.04     0.0    no       A    Q  
    cnoesy     401   357     yes  2.49   1.71   3.26   2.89    0.00    0.00     0.0    no       A    I  
    cnoesy     409   365     yes  1.92   1.46   2.38   2.13    0.00    0.00     0.0    no       A    I  
    cnoesy     412   368     yes  2.09   1.54   2.64   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     417   373     yes  2.61   1.76   3.46   2.21    0.00    0.00     0.0    no       A    S  
    cnoesy     427   383     yes  1.81   1.40   2.21   2.13    0.00    0.04     0.0    no       A    L  
    cnoesy     428   384     yes  2.53   1.73   3.34   2.74    0.00    0.00     0.0    no       A    L  
    cnoesy     430   386     yes  1.82   1.41   2.24   1.80    0.00    0.00     0.0    no       A    M  
    cnoesy     433   389     yes  2.98   1.87   4.09   2.17    0.04    0.00     0.0    no       A    L  
    cnoesy     434   390     yes  2.31   1.64   2.97   2.43    0.00    0.00     0.0    no       A    Q  
    cnoesy     435   391     yes  2.72   1.80   3.65   3.73    0.00    0.08    14.3    no       A    I  
    cnoesy     436   392     yes  2.96   1.86   4.05   2.63    0.00    0.00     0.0    no       A    L  
    cnoesy     441   397     yes  1.90   1.45   2.35   2.13    0.00    0.00     0.0    no       A    I  
    cnoesy     442   398     yes  2.86   1.84   3.89   2.36    0.00    0.00     0.0    no       A    L  
    cnoesy     467   421     yes  3.01   1.88   4.15   3.02    0.00    0.00     0.0    no       A    L  
    cnoesy     472   425     yes  2.87   1.84   3.90   3.31    0.00    0.00     0.0    no       A    L  
    cnoesy     474   426     yes  2.44   1.70   3.19   2.26    0.00    0.00     0.0    no       A    L  
    cnoesy     475   427     yes  2.52   1.73   3.32   2.51    0.00    0.00     0.0    no       A    L  
    cnoesy     480   432     yes  2.32   1.65   2.99   2.63    0.00    0.00     0.0    no       A    Q  
    cnoesy     481   433     yes  2.30   1.64   2.97   1.73    0.00    0.00     0.0    no       A    Q  
    cnoesy     493   441     yes  2.09   1.55   2.64   1.78    0.00    0.00     0.0    no       A    I  
    cnoesy     503   448     yes  3.06   1.89   4.22   4.15    0.00    0.19    28.6    no       A    L  
    cnoesy     512   455     yes  2.52   1.73   3.31   2.87    0.00    0.00     0.0    no       A    I  
    cnoesy     515   457     yes  2.44   1.70   3.19   2.81    0.00    0.10     0.0    no       A    L  
    cnoesy     519   460     yes  2.67   1.78   3.55   3.63    0.00    0.07    28.6    no       A    L  
    cnoesy     521   462     yes  2.47   1.71   3.24   3.08    0.00    0.15    28.6    no       A    Q  
    cnoesy     527   467     yes  2.15   1.57   2.73   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy     532   472     yes  1.86   1.43   2.29   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy     537   476     yes  2.71   1.79   3.64   3.34    0.00    0.00     0.0    no       A    L  
    cnoesy     542   481     yes  2.87   1.84   3.90   3.78    0.00    0.06    14.3    no       A    L  
    cnoesy     543   482     yes  2.54   1.74   3.35   2.52    0.00    0.00     0.0    no       A    Q  
    cnoesy     545   484     yes  1.94   1.47   2.42   2.04    0.00    0.00     0.0    no       A    Q  
    cnoesy     546   485     yes  1.95   1.47   2.42   2.34    0.00    0.00     0.0    no       A    Q  
    cnoesy     549   488     yes  2.70   1.79   3.61   3.65    0.00    0.04    14.3    no       A    I  
    cnoesy     552   491     yes  1.68   1.33   2.04   1.77    0.00    0.00     0.0    no       A    I  
    cnoesy     553   492     yes  3.04   1.88   4.19   3.40    0.00    0.00     0.0    no       A    Q  
    cnoesy     558   497     yes  2.16   1.58   2.74   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy     559   498     yes  2.15   1.57   2.73   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy     561   500     yes  2.68   1.78   3.58   3.05    0.00    0.03     0.0    no       A    I  
    cnoesy     568   507     yes  2.01   1.50   2.51   2.05    0.00    0.00     0.0    no       A    I  
    cnoesy     569   508     yes  2.22   1.60   2.84   2.08    0.00    0.10     0.0    no       A    L  
    cnoesy     572   511     yes  3.03   1.88   4.18   2.09    0.09    0.00    28.6    no       A    L  
    cnoesy     582   521     yes  3.02   1.88   4.16   3.52    0.00    0.00     0.0    no       A    Q  
    cnoesy     584   523     yes  2.49   1.71   3.26   2.68    0.00    0.00     0.0    no       A    Q  
    cnoesy     585   524     yes  2.58   1.75   3.41   3.13    0.00    0.00     0.0    no       A    Q  
    cnoesy     587   526     yes  2.27   1.63   2.92   2.05    0.00    0.00     0.0    no       A    Q  
    cnoesy     594   533     yes  1.88   1.44   2.33   1.77    0.00    0.00     0.0    no       A    I  
    cnoesy     599   538     yes  2.19   1.59   2.78   2.81    0.00    0.03     0.0    no       A    I  
    cnoesy     622   549     yes  2.17   1.58   2.75   2.67    0.00    0.20    28.6    no       A    Q  
    cnoesy     632   555     yes  2.00   1.50   2.50   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     651   568     yes  2.86   1.84   3.88   3.35    0.00    0.00     0.0    no       A    L  
    cnoesy     652   569     yes  2.28   1.63   2.92   2.32    0.00    0.00     0.0    no       A    I  
    cnoesy     654   571     yes  2.68   1.78   3.59   3.39    0.00    0.00     0.0    no       A    Q  
    cnoesy     655   572     yes  2.63   1.77   3.50   2.60    0.00    0.00     0.0    no       A    Q  
    cnoesy     656   573     yes  2.90   1.85   3.95   3.57    0.00    0.15    28.6    no       A    Q  
    cnoesy     657   574     yes  3.16   1.91   4.40   4.31    0.00    0.18    42.9    no       A    L  
    cnoesy     658   575     yes  1.95   1.48   2.43   1.98    0.00    0.00     0.0    no       A    Q  
    cnoesy     660   577     yes  3.02   1.88   4.16   3.33    0.00    0.00     0.0    no       A    I  
    cnoesy     661   578     yes  3.06   1.89   4.22   3.97    0.00    0.00     0.0    no       A    I  
    cnoesy     664   581     yes  2.17   1.58   2.76   2.08    0.00    0.00     0.0    no       A    I  
    cnoesy     667   584     yes  2.36   1.66   3.05   2.42    0.00    0.04     0.0    no       A    L  
    cnoesy     672   589     yes  2.48   1.71   3.25   3.20    0.00    0.14    28.6    no       A    L  
    cnoesy     673   590     yes  2.21   1.60   2.82   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy     674   591     yes  2.23   1.61   2.85   2.89    0.00    0.08    28.6    no       A    I  
    cnoesy     680   597     yes  2.88   1.84   3.92   3.15    0.03    0.00     0.0    no       A    L  
    cnoesy     685   602     yes  1.75   1.37   2.14   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy     687   604     yes  3.08   1.89   4.27   4.35    0.00    0.09    42.9    no       A    Q  
    cnoesy     691   608     yes  2.19   1.59   2.79   2.51    0.00    0.00     0.0    no       A    Q  
    cnoesy     692   609     yes  1.95   1.47   2.42   2.21    0.00    0.00     0.0    no       A    I  
    cnoesy     693   610     yes  1.98   1.49   2.46   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     701   618     yes  2.00   1.50   2.50   1.96    0.00    0.00     0.0    no       A    L  
    cnoesy     705   622     yes  3.08   1.89   4.27   4.33    0.00    0.09    14.3    no       A    L  
    cnoesy     713   630     yes  2.49   1.72   3.27   2.63    0.00    0.00     0.0    no       A    Q  
    cnoesy     714   631     yes  2.62   1.76   3.47   3.17    0.00    0.00     0.0    no       A    L  
    cnoesy     716   632     yes  2.28   1.63   2.93   2.81    0.00    0.00     0.0    no       A    L  
    cnoesy     717   633     yes  2.78   1.81   3.75   2.93    0.00    0.00     0.0    no       A    Q  
    cnoesy     719   635     yes  2.65   1.77   3.53   3.59    0.00    0.06     0.0    no       A    S  
    cnoesy     720   636     yes  3.07   1.89   4.24   3.84    0.00    0.00     0.0    no       A    L  
    cnoesy     723   639     yes  2.80   1.82   3.77   2.82    0.00    0.00     0.0    no       A    M  
    cnoesy     724   640     yes  3.17   1.91   4.42   4.43    0.00    0.04     0.0    no       A    M  
    cnoesy     726   642     yes  1.98   1.49   2.48   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy     729   645     yes  3.05   1.89   4.22   3.79    0.00    0.00     0.0    no       A    S  
    cnoesy     735   647     yes  2.40   1.68   3.12   2.83    0.00    0.00     0.0    no       A    Q  
    cnoesy     736   648     yes  2.39   1.68   3.10   2.76    0.00    0.00     0.0    no       A    Q  
    cnoesy     737   649     yes  2.00   1.50   2.49   2.20    0.00    0.00     0.0    no       A    I  
    cnoesy     738   650     yes  2.14   1.57   2.71   2.20    0.00    0.00     0.0    no       A    I  
    cnoesy     739   651     yes  2.95   1.86   4.04   3.17    0.00    0.00     0.0    no       A    L  
    cnoesy     740   652     yes  3.05   1.89   4.21   4.22    0.00    0.02     0.0    no       A    Q  
    cnoesy     741   653     yes  2.97   1.87   4.07   2.63    0.00    0.00     0.0    no       A    L  
    cnoesy     743   655     yes  1.93   1.47   2.40   2.34    0.00    0.00     0.0    no       A    I  
    cnoesy     744   656     yes  2.70   1.79   3.62   3.08    0.00    0.00     0.0    no       A    L  
    cnoesy     747   659     yes  2.69   1.78   3.59   2.10    0.03    0.00     0.0    no       A    L  
    cnoesy     750   662     yes  1.81   1.40   2.23   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy     751   663     yes  2.62   1.76   3.48   2.68    0.00    0.00     0.0    no       A    L  
    cnoesy     752   664     yes  1.84   1.42   2.26   2.10    0.00    0.00     0.0    no       A    I  
    cnoesy     753   665     yes  1.92   1.46   2.38   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy     757   669     yes  2.43   1.69   3.16   3.09    0.00    0.04     0.0    no       A    L  
    cnoesy     758   670     yes  2.34   1.66   3.03   2.79    0.00    0.00     0.0    no       A    S  
    cnoesy     759   671     yes  2.84   1.83   3.85   3.91    0.00    0.06    14.3    no       A    Q  
    cnoesy     760   672     yes  2.32   1.65   3.00   1.83    0.00    0.00     0.0    no       A    L  
    cnoesy     765   677     yes  2.75   1.80   3.69   3.78    0.00    0.21    71.4   yes       A    L  
    cnoesy     775   687     yes  2.75   1.81   3.70   3.77    0.00    0.07    14.3    no       A    Q  
    cnoesy     781   693     yes  2.49   1.71   3.26   3.55    0.00    0.29    85.7   yes       A    L  
    cnoesy     793   705     yes  2.40   1.68   3.12   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy     795   707     yes  2.09   1.54   2.63   2.36    0.00    0.07     0.0    no       A    I  
    cnoesy     796   708     yes  2.64   1.77   3.51   3.14    0.00    0.00     0.0    no       A    S  
    cnoesy     798   710     yes  2.01   1.50   2.51   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     800   712     yes  2.24   1.61   2.86   1.78    0.04    0.00     0.0    no       A    S  
    cnoesy     802   714     yes  2.54   1.73   3.34   2.94    0.00    0.10    14.3    no       A    Q  
    cnoesy     803   715     yes  2.68   1.78   3.58   3.32    0.00    0.05    14.3    no       A    Q  
    cnoesy     811   723     yes  2.28   1.63   2.93   2.42    0.00    1.99    14.3    no       A    L  
    cnoesy     814   726     yes  2.29   1.63   2.94   3.07    0.00    0.61    14.3    no       A    L  
    cnoesy     815   727     yes  2.04   1.52   2.56   1.93    0.00    0.68    14.3    no       A    L  
    cnoesy     819   731     yes  2.43   1.69   3.17   2.50    0.00    0.00     0.0    no       A    Q  
    cnoesy     820   732     yes  2.75   1.80   3.69   3.55    0.00    0.00     0.0    no       A    I  
    cnoesy     822   734     yes  2.51   1.72   3.29   3.44    0.00    0.14   100.0   yes       A    Q  
    cnoesy     823   735     yes  2.16   1.58   2.74   2.65    0.00    0.00     0.0    no       A    I  
    cnoesy     824   736     yes  2.68   1.78   3.58   3.77    0.00    0.20   100.0   yes       A    L  
    cnoesy     825   737     yes  2.93   1.86   4.01   3.40    0.00    0.00     0.0    no       A    L  
    cnoesy     827   739     yes  2.00   1.50   2.50   2.08    0.00    0.00     0.0    no       A    I  
    cnoesy     828   740     yes  2.24   1.61   2.87   2.67    0.00    0.00     0.0    no       A    I  
    cnoesy     829   741     yes  2.05   1.53   2.58   2.21    0.00    0.00     0.0    no       A    I  
    cnoesy     831   743     yes  3.10   1.90   4.30   4.13    0.00    0.00     0.0    no       A    Q  
    cnoesy     832   744     yes  1.90   1.45   2.35   2.03    0.00    0.00     0.0    no       A    I  
    cnoesy     833   745     yes  2.25   1.62   2.89   2.85    0.00    0.03     0.0    no       A    Q  
    cnoesy     836   748     yes  1.81   1.40   2.23   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     838   750     yes  3.09   1.90   4.28   4.26    0.00    0.06     0.0    no       A    Q  
    cnoesy     851   763     yes  3.11   1.90   4.32   4.42    0.00    0.10    42.9    no       A    S  
    cnoesy     853   765     yes  3.19   1.92   4.46   3.24    0.00    0.00     0.0    no       A    L  
    cnoesy     854   766     yes  2.88   1.84   3.91   4.21    0.00    0.30   100.0   yes       A    S  
    cnoesy     855   767     yes  2.36   1.66   3.05   1.81    0.00    0.00     0.0    no       A    S  
    cnoesy     856   768     yes  1.82   1.40   2.23   2.10    0.00    0.00     0.0    no       A    I  
    cnoesy     861   773     yes  2.77   1.81   3.73   2.85    0.00    0.20    14.3    no       A    S  
    cnoesy     862   774     yes  2.69   1.79   3.60   3.70    0.00    0.10    28.6    no       A    S  
    cnoesy     864   776     yes  2.56   1.74   3.38   3.34    0.00    0.12    71.4   yes       A    M  
    cnoesy     867   779     yes  2.44   1.70   3.19   2.04    0.00    0.00     0.0    no       A    Q  
    cnoesy     868   780     yes  2.67   1.78   3.55   3.66    0.00    0.11    71.4   yes       A    I  
    cnoesy     869   781     yes  2.92   1.86   3.99   2.78    0.00    0.00     0.0    no       A    S  
    cnoesy     875   787     yes  2.94   1.86   4.02   2.70    0.00    0.00     0.0    no       A    L  
    cnoesy     876   788     yes  3.00   1.88   4.13   3.53    0.00    0.00     0.0    no       A    Q  
    cnoesy     877   789     yes  2.28   1.63   2.93   2.47    0.00    0.00     0.0    no       A    I  
    cnoesy     885   797     yes  2.46   1.70   3.22   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy     886   798     yes  2.03   1.51   2.54   2.10    0.00    0.00     0.0    no       A    I  
    cnoesy     887   799     yes  2.87   1.84   3.91   3.99    0.00    0.09    28.6    no       A    L  
    cnoesy     890   802     yes  2.01   1.50   2.51   2.59    0.00    0.44    42.9    no       A    I  
    cnoesy     892   804     yes  3.16   1.91   4.40   3.99    0.00    0.00     0.0    no       A    L  
    cnoesy     895   807     yes  2.14   1.57   2.71   1.55    0.02    0.00     0.0    no       A    Q  
    cnoesy     902   814     yes  1.92   1.46   2.38   2.06    0.00    0.00     0.0    no       A    I  
    cnoesy     904   816     yes  2.00   1.50   2.51   2.36    0.00    0.00     0.0    no       A    I  
    cnoesy     905   817     yes  1.96   1.48   2.44   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy     906   818     yes  2.03   1.52   2.55   1.85    0.00    0.00     0.0    no       A    Q  
    cnoesy     909   821     yes  2.70   1.79   3.62   3.66    0.00    0.04     0.0    no       A    I  
    cnoesy     910   822     yes  2.78   1.81   3.75   2.63    0.00    0.00     0.0    no       A    Q  
    cnoesy     914   826     yes  2.33   1.65   3.01   2.68    0.00    0.00     0.0    no       A    L  
    cnoesy     915   827     yes  2.86   1.84   3.88   2.93    0.00    0.00     0.0    no       A    L  
    cnoesy     916   828     yes  3.07   1.89   4.26   3.63    0.00    0.02     0.0    no       A    L  
    cnoesy     917   829     yes  2.34   1.65   3.02   3.00    0.00    0.03     0.0    no       A    Q  
    cnoesy     922   834     yes  2.86   1.84   3.89   2.84    0.00    0.00     0.0    no       A    Q  
    cnoesy     923   835     yes  2.67   1.78   3.56   3.65    0.00    0.09    28.6    no       A    L  
    cnoesy     924   836     yes  2.22   1.60   2.84   2.54    0.00    0.00     0.0    no       A    I  
    cnoesy     925   837     yes  2.38   1.67   3.08   2.68    0.00    0.00     0.0    no       A    I  
    cnoesy     926   838     yes  3.08   1.89   4.27   3.39    0.00    0.00     0.0    no       A    L  
    cnoesy     927   839     yes  2.63   1.76   3.49   2.90    0.00    0.02     0.0    no       A    L  
    cnoesy     928   840     yes  2.75   1.81   3.70   3.45    0.00    0.00     0.0    no       A    S  
    cnoesy     931   843     yes  3.08   1.90   4.27   3.48    0.00    0.00     0.0    no       A    Q  
    cnoesy     932   844     yes  3.19   1.92   4.46   3.27    0.00    0.00     0.0    no       A    Q  
    cnoesy     933   845     yes  2.14   1.57   2.71   2.13    0.00    0.00     0.0    no       A    I  
    cnoesy     936   848     yes  2.01   1.50   2.51   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy     937   849     yes  2.35   1.66   3.04   3.13    0.00    0.09    28.6    no       A    I  
    cnoesy     942   854     yes  2.16   1.58   2.75   2.68    0.00    0.03     0.0    no       A    I  
    cnoesy     944   856     yes  1.97   1.49   2.46   1.88    0.00    0.00     0.0    no       A    I  
    cnoesy     947   858     yes  2.60   1.76   3.45   3.35    0.00    0.00     0.0    no       A    Q  
    cnoesy     949   860     yes  2.36   1.66   3.05   2.10    0.00    0.00     0.0    no       A    L  
    cnoesy     952   863     yes  2.16   1.58   2.75   2.33    0.00    0.00     0.0    no       A    I  
    cnoesy     955   866     yes  2.28   1.63   2.93   2.55    0.00    0.02     0.0    no       A    L  
    cnoesy     958   869     yes  2.35   1.66   3.03   2.43    0.00    0.00     0.0    no       A    L  
    cnoesy     959   870     yes  1.94   1.47   2.42   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     961   872     yes  1.87   1.43   2.31   1.90    0.00    0.00     0.0    no       A    I  
    cnoesy     968   879     yes  3.00   1.87   4.12   4.02    0.00    0.10    28.6    no       A    L  
    cnoesy     973   884     yes  2.29   1.63   2.95   2.23    0.00    0.00     0.0    no       A    I  
    cnoesy     975   886     yes  2.96   1.86   4.05   2.33    0.01    0.00     0.0    no       A    M  
    cnoesy     979   890     yes  2.00   1.50   2.50   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy     981   892     yes  2.54   1.73   3.34   2.97    0.00    0.08    14.3    no       A    L  
    cnoesy     982   893     yes  1.99   1.49   2.48   2.05    0.00    0.00     0.0    no       A    I  
    cnoesy     985   896     yes  2.56   1.74   3.39   2.79    0.00    0.00     0.0    no       A    L  
    cnoesy     990   901     yes  2.73   1.80   3.67   3.86    0.00    0.22    57.1   yes       A    I  
    cnoesy    1009   920     yes  1.69   1.33   2.04   1.92    0.00    0.13    14.3    no       A    I  
    cnoesy    1015   926     yes  1.94   1.47   2.41   2.35    0.00    0.19    42.9    no       A    L  
    cnoesy    1016   927     yes  1.71   1.35   2.08   1.73    0.00    0.09     0.0    no       A    L  
    cnoesy    1017   928     yes  2.30   1.64   2.96   3.45    0.00    0.49   100.0   yes       A    L  
    cnoesy    1031   930     yes  3.14   1.91   4.37   4.22    0.00    0.03     0.0    no       A    S  
    cnoesy    1032   931     yes  1.91   1.45   2.36   2.20    0.00    0.00     0.0    no       A    I  
    cnoesy    1035   934     yes  1.92   1.46   2.38   1.93    0.00    0.25    28.6    no       A    Q  
    cnoesy    1047   943     yes  2.91   1.85   3.97   2.96    0.00    0.00     0.0    no       A    L  
    cnoesy    1050   946     yes  2.34   1.65   3.02   2.83    0.00    0.00     0.0    no       A    I  
    cnoesy    1051   947     yes  2.31   1.64   2.98   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy    1055   951     yes  1.96   1.48   2.44   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1061   956     yes  2.36   1.67   3.06   2.58    0.00    0.00     0.0    no       A    I  
    cnoesy    1062   957     yes  2.39   1.68   3.11   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    1063   958     yes  3.12   1.90   4.33   4.33    0.00    0.06    14.3    no       A    Q  
    cnoesy    1064   959     yes  3.13   1.91   4.35   4.14    0.00    0.06     0.0    no       A    S  
    cnoesy    1073   968     yes  2.76   1.81   3.72   3.83    0.00    0.12    71.4   yes       A    I  
    cnoesy    1077   972     yes  2.96   1.86   4.05   3.25    0.00    0.00     0.0    no       A    M  
    cnoesy    1078   973     yes  2.06   1.53   2.58   2.29    0.00    0.00     0.0    no       A    I  
    cnoesy    1081   976     yes  2.12   1.56   2.68   2.34    0.00    0.00     0.0    no       A    L  
    cnoesy    1085   980     yes  2.44   1.69   3.18   2.38    0.00    0.00     0.0    no       A    Q  
    cnoesy    1086   981     yes  2.52   1.73   3.32   3.12    0.00    0.00     0.0    no       A    Q  
    cnoesy    1087   982     yes  2.33   1.65   3.01   2.92    0.00    0.00     0.0    no       A    I  
    cnoesy    1088   983     yes  2.32   1.65   2.99   2.46    0.00    0.00     0.0    no       A    I  
    cnoesy    1089   984     yes  2.46   1.70   3.21   2.70    0.00    0.00     0.0    no       A    Q  
    cnoesy    1097   992     yes  1.73   1.36   2.11   1.73    0.00    0.00     0.0    no       A    I  
    cnoesy    1098   993     yes  2.51   1.72   3.30   2.46    0.00    0.00     0.0    no       A    I  
    cnoesy    1101   996     yes  2.52   1.73   3.32   2.68    0.00    0.00     0.0    no       A    I  
    cnoesy    1102   997     yes  2.52   1.72   3.31   2.26    0.06    0.00     0.0    no       A    I  
    cnoesy    1103   998     yes  3.05   1.89   4.21   3.95    0.00    0.06     0.0    no       A    S  
    cnoesy    1104   999     yes  2.18   1.59   2.77   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1118  1013     yes  2.53   1.73   3.33   3.11    0.00    0.00     0.0    no       A    L  
    cnoesy    1119  1014     yes  2.44   1.70   3.19   3.26    0.00    0.07    28.6    no       A    L  
    cnoesy    1120  1015     yes  3.17   1.91   4.43   3.16    0.00    0.00     0.0    no       A    L  
    cnoesy    1124  1019     yes  2.70   1.79   3.61   3.70    0.00    0.08    14.3    no       A    I  
    cnoesy    1125  1020     yes  2.39   1.68   3.11   2.15    0.00    0.00     0.0    no       A    S  
    cnoesy    1126  1021     yes  2.62   1.76   3.48   3.11    0.00    0.00     0.0    no       A    L  
    cnoesy    1127  1022     yes  2.08   1.54   2.61   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    1128  1023     yes  2.47   1.71   3.24   2.19    0.00    0.22    14.3    no       A    L  
    cnoesy    1129  1024     yes  2.86   1.84   3.89   3.12    0.00    0.00     0.0    no       A    L  
    cnoesy    1130  1025     yes  1.91   1.46   2.37   1.99    0.00    0.00     0.0    no       A    I  
    cnoesy    1131  1026     yes  2.17   1.58   2.76   1.86    0.00    0.00     0.0    no       A    I  
    cnoesy    1132  1027     yes  2.35   1.66   3.04   2.39    0.00    0.00     0.0    no       A    L  
    cnoesy    1134  1029     yes  2.54   1.73   3.34   2.78    0.00    0.00     0.0    no       A    I  
    cnoesy    1135  1030     yes  3.12   1.90   4.34   3.37    0.00    0.00     0.0    no       A    S  
    cnoesy    1136  1031     yes  3.08   1.89   4.26   3.62    0.00    0.00     0.0    no       A    L  
    cnoesy    1138  1033     yes  3.07   1.89   4.24   3.80    0.00    0.00     0.0    no       A    L  
    cnoesy    1139  1034     yes  3.07   1.89   4.25   3.12    0.00    0.00     0.0    no       A    L  
    cnoesy    1140  1035     yes  2.39   1.68   3.11   2.29    0.00    0.00     0.0    no       A    L  
    cnoesy    1141  1036     yes  2.38   1.67   3.09   1.97    0.00    0.00     0.0    no       A    L  
    cnoesy    1144  1039     yes  2.06   1.53   2.60   2.18    0.00    0.00     0.0    no       A    I  
    cnoesy    1146  1041     yes  2.21   1.60   2.82   1.82    0.00    0.00     0.0    no       A    S  
    cnoesy    1147  1042     yes  1.75   1.37   2.14   2.08    0.00    0.00     0.0    no       A    I  
    cnoesy    1158  1051     yes  2.91   1.85   3.96   2.45    0.00    0.00     0.0    no       A    I  
    cnoesy    1164  1056     yes  2.47   1.71   3.22   1.74    0.00    0.00     0.0    no       A    I  
    cnoesy    1177  1067     yes  2.06   1.53   2.60   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1181  1070     yes  2.50   1.72   3.28   2.73    0.00    0.00     0.0    no       A    I  
    cnoesy    1182  1071     yes  2.60   1.75   3.44   2.65    0.00    0.00     0.0    no       A    I  
    cnoesy    1184  1072     yes  2.62   1.76   3.47   2.47    0.00    0.00     0.0    no       A    I  
    cnoesy    1185  1073     yes  2.62   1.76   3.47   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    1191  1078     yes  2.26   1.62   2.90   2.43    0.00    0.00     0.0    no       A    Q  
    cnoesy    1192  1079     yes  2.41   1.69   3.14   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy    1193  1080     yes  2.45   1.70   3.20   2.84    0.00    0.00     0.0    no       A    I  
    cnoesy    1197  1084     yes  3.17   1.91   4.42   3.34    0.00    0.00     0.0    no       A    M  
    cnoesy    1198  1085     yes  3.00   1.87   4.12   3.32    0.00    0.07     0.0    no       A    Q  
    cnoesy    1201  1087     yes  2.38   1.67   3.09   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1202  1088     yes  3.16   1.91   4.41   3.18    0.00    0.00     0.0    no       A    I  
    cnoesy    1207  1092     yes  2.72   1.79   3.64   3.45    0.00    0.01     0.0    no       A    I  
    cnoesy    1208  1093     yes  2.60   1.75   3.44   2.82    0.00    0.00     0.0    no       A    L  
    cnoesy    1215  1098     yes  2.56   1.74   3.38   3.24    0.00    0.27    71.4   yes       A    I  
    cnoesy    1218  1101     yes  3.18   1.92   4.44   4.11    0.00    0.00     0.0    no       A    Q  
    cnoesy    1222  1105     yes  3.01   1.88   4.15   4.13    0.00    0.03     0.0    no       A    L  
    cnoesy    1225  1108     yes  3.16   1.91   4.40   4.23    0.00    0.01     0.0    no       A    L  
    cnoesy    1232  1114     yes  2.15   1.57   2.73   2.03    0.00    0.00     0.0    no       A    I  
    cnoesy    1233  1115     yes  2.84   1.83   3.85   3.82    0.00    0.06     0.0    no       A    I  
    cnoesy    1245  1125     yes  2.21   1.60   2.82   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy    1252  1131     yes  2.04   1.52   2.56   2.10    0.00    0.00     0.0    no       A    I  
    cnoesy    1256  1134     yes  2.81   1.82   3.79   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy    1257  1135     yes  2.86   1.84   3.89   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    1258  1136     yes  3.11   1.90   4.32   2.65    0.00    0.00     0.0    no       A    Q  
    cnoesy    1263  1141     yes  2.80   1.82   3.78   2.69    0.00    0.00     0.0    no       A    I  
    cnoesy    1264  1142     yes  2.33   1.65   3.01   1.74    0.00    0.00     0.0    no       A    I  
    cnoesy    1266  1144     yes  2.60   1.75   3.44   2.40    0.00    0.00     0.0    no       A    I  
    cnoesy    1267  1145     yes  2.54   1.74   3.35   2.73    0.00    0.00     0.0    no       A    I  
    cnoesy    1282  1160     yes  3.00   1.87   4.12   2.61    0.00    0.00     0.0    no       A    I  
    cnoesy    1284  1162     yes  3.04   1.89   4.20   4.23    0.00    0.21    71.4   yes       A    Q  
    cnoesy    1285  1163     yes  2.49   1.72   3.27   2.61    0.00    0.32    28.6    no       A    I  
    cnoesy    1286  1164     yes  2.53   1.73   3.33   2.25    0.00    0.00     0.0    no       A    I  
    cnoesy    1288  1166     yes  3.06   1.89   4.23   4.32    0.00    0.09    42.9    no       A    L  
    cnoesy    1289  1167     yes  2.71   1.79   3.63   2.85    0.00    0.00     0.0    no       A    L  
    cnoesy    1290  1168     yes  2.74   1.80   3.67   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    1291  1169     yes  2.50   1.72   3.28   2.75    0.00    0.30    28.6    no       A    I  
    cnoesy    1294  1172     yes  2.33   1.65   3.00   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1295  1173     yes  2.96   1.86   4.05   2.37    0.00    0.00     0.0    no       A    L  
    cnoesy    1297  1175     yes  3.00   1.88   4.13   3.34    0.00    0.00     0.0    no       A    M  
    cnoesy    1298  1176     yes  2.27   1.63   2.92   2.55    0.00    0.15    28.6    no       A    I  
    cnoesy    1301  1179     yes  2.04   1.52   2.56   1.96    0.00    0.00     0.0    no       A    I  
    cnoesy    1302  1180     yes  2.58   1.75   3.42   2.69    0.00    0.00     0.0    no       A    S  
    cnoesy    1303  1181     yes  2.10   1.55   2.66   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy    1306  1184     yes  1.97   1.49   2.46   2.17    0.00    0.00     0.0    no       A    L  
    cnoesy    1311  1189     yes  2.73   1.80   3.65   2.73    0.00    0.00     0.0    no       A    L  
    cnoesy    1312  1190     yes  2.02   1.51   2.53   2.17    0.00    0.04     0.0    no       A    L  
    cnoesy    1313  1191     yes  2.80   1.82   3.77   3.50    0.00    0.05     0.0    no       A    L  
    cnoesy    1315  1193     yes  2.68   1.78   3.59   3.13    0.00    0.00     0.0    no       A    I  
    cnoesy    1317  1194     yes  2.51   1.72   3.30   3.44    0.00    0.14    71.4   yes       A    I  
    cnoesy    1320  1197     yes  2.03   1.52   2.55   1.70    0.00    0.00     0.0    no       A    I  
    cnoesy    1323  1200     yes  2.66   1.78   3.55   2.96    0.00    0.02     0.0    no       A    L  
    cnoesy    1327  1203     yes  2.45   1.70   3.20   2.38    0.00    0.00     0.0    no       A    L  
    cnoesy    1328  1204     yes  2.60   1.76   3.45   3.50    0.00    0.05     0.0    no       A    L  
    cnoesy    1333  1208     yes  2.49   1.72   3.27   3.37    0.00    0.10    57.1   yes       A    S  
    cnoesy    1334  1209     yes  2.70   1.79   3.61   3.49    0.00    0.00     0.0    no       A    I  
    cnoesy    1337  1212     yes  2.96   1.87   4.06   2.74    0.00    0.00     0.0    no       A    L  
    cnoesy    1339  1214     yes  2.27   1.63   2.92   2.62    0.00    0.00     0.0    no       A    I  
    cnoesy    1340  1215     yes  2.20   1.60   2.81   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy    1345  1220     yes  2.23   1.61   2.86   2.40    0.00    0.00     0.0    no       A    L  
    cnoesy    1346  1221     yes  2.16   1.58   2.74   1.96    0.00    0.00     0.0    no       A    I  
    cnoesy    1354  1226     yes  2.91   1.85   3.97   3.95    0.00    0.04     0.0    no       A    I  
    cnoesy    1355  1227     yes  3.07   1.89   4.25   4.27    0.00    0.04     0.0    no       A    I  
    cnoesy    1359  1230     yes  2.52   1.73   3.32   3.20    0.00    0.02     0.0    no       A    I  
    cnoesy    1360  1231     yes  3.18   1.92   4.45   4.15    0.00    0.06     0.0    no       A    I  
    cnoesy    1361  1232     yes  2.63   1.76   3.49   2.79    0.00    0.13    14.3    no       A    I  
    cnoesy    1362  1233     yes  2.92   1.85   3.99   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    1365  1234     yes  2.73   1.80   3.67   3.60    0.00    0.04     0.0    no       A    L  
    cnoesy    1366  1235     yes  2.93   1.86   4.01   2.74    0.00    0.00     0.0    no       A    I  
    cnoesy    1382  1246     yes  2.23   1.61   2.86   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1389  1252     yes  2.69   1.79   3.60   3.01    0.00    0.00     0.0    no       A    I  
    cnoesy    1391  1253     yes  2.41   1.68   3.14   2.39    0.00    0.00     0.0    no       A    I  
    cnoesy    1394  1256     yes  2.82   1.83   3.82   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    1396  1257     yes  2.99   1.87   4.10   3.50    0.00    0.06    14.3    no       A    S  
    cnoesy    1400  1260     yes  1.95   1.48   2.43   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1401  1261     yes  2.74   1.80   3.68   2.42    0.00    0.00     0.0    no       A    L  
    cnoesy    1404  1264     yes  2.21   1.60   2.82   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1405  1265     yes  3.10   1.90   4.30   3.01    0.00    0.00     0.0    no       A    L  
    cnoesy    1414  1273     yes  2.51   1.72   3.30   2.84    0.00    0.00     0.0    no       A    I  
    cnoesy    1419  1277     yes  2.52   1.73   3.32   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    1420  1278     yes  2.84   1.83   3.84   3.63    0.00    0.02     0.0    no       A    Q  
    cnoesy    1422  1280     yes  2.45   1.70   3.20   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy    1423  1281     yes  2.57   1.74   3.39   2.99    0.00    0.00     0.0    no       A    I  
    cnoesy    1427  1285     yes  3.00   1.87   4.12   3.97    0.00    0.03     0.0    no       A    M  
    cnoesy    1428  1286     yes  3.14   1.91   4.36   4.41    0.00    0.04     0.0    no       A    M  
    cnoesy    1429  1287     yes  2.04   1.52   2.56   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy    1431  1289     yes  2.80   1.82   3.77   2.82    0.00    0.00     0.0    no       A    I  
    cnoesy    1433  1291     yes  3.08   1.89   4.27   3.73    0.00    0.00     0.0    no       A    L  
    cnoesy    1434  1292     yes  3.12   1.90   4.33   3.24    0.00    0.00     0.0    no       A    M  
    cnoesy    1439  1297     yes  2.78   1.81   3.75   2.82    0.00    0.00     0.0    no       A    I  
    cnoesy    1440  1298     yes  2.67   1.78   3.56   3.49    0.00    0.03     0.0    no       A    S  
    cnoesy    1445  1303     yes  2.47   1.71   3.23   2.71    0.00    0.00     0.0    no       A    I  
    cnoesy    1448  1306     yes  2.31   1.64   2.97   3.00    0.00    0.03     0.0    no       A    I  
    cnoesy    1449  1307     yes  2.35   1.66   3.04   2.57    0.00    0.00     0.0    no       A    I  
    cnoesy    1452  1309     yes  2.91   1.85   3.97   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    1459  1314     yes  2.37   1.67   3.07   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy    1470  1323     yes  2.43   1.69   3.17   2.43    0.00    0.00     0.0    no       A    I  
    cnoesy    1473  1326     yes  2.73   1.80   3.67   2.80    0.00    0.00     0.0    no       A    Q  
    cnoesy    1474  1327     yes  2.31   1.64   2.98   2.53    0.00    0.00     0.0    no       A    I  
    cnoesy    1475  1328     yes  2.37   1.67   3.07   3.03    0.00    0.00     0.0    no       A    I  
    cnoesy    1476  1329     yes  3.19   1.92   4.46   4.49    0.00    0.02     0.0    no       A    Q  
    cnoesy    1488  1330     yes  3.16   1.91   4.40   4.23    0.00    0.06     0.0    no       A    S  
    cnoesy    1490  1331     yes  2.44   1.70   3.19   3.31    0.00    0.12    28.6    no       A    I  
    cnoesy    1491  1332     yes  2.40   1.68   3.13   2.90    0.00    0.00     0.0    no       A    I  
    cnoesy    1497  1338     yes  3.15   1.91   4.40   4.60    0.00    0.21   100.0   yes       A    Q  
    cnoesy    1499  1340     yes  1.73   1.36   2.11   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1500  1341     yes  3.19   1.92   4.46   3.13    0.00    0.00     0.0    no       A    I  
    cnoesy    1502  1343     yes  2.74   1.80   3.68   3.55    0.00    0.00     0.0    no       A    I  
    cnoesy    1505  1346     yes  2.62   1.76   3.48   2.65    0.00    0.00     0.0    no       A    I  
    cnoesy    1506  1347     yes  2.78   1.81   3.75   2.90    0.00    0.00     0.0    no       A    I  
    cnoesy    1513  1354     yes  1.97   1.49   2.46   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy    1516  1356     yes  2.59   1.75   3.43   2.80    0.00    0.00     0.0    no       A    I  
    cnoesy    1518  1358     yes  3.11   1.90   4.31   3.31    0.00    0.00     0.0    no       A    I  
    cnoesy    1533  1371     yes  2.41   1.68   3.13   2.60    0.00    0.00     0.0    no       A    I  
    cnoesy    1537  1374     yes  3.13   1.91   4.36   3.96    0.00    0.00     0.0    no       A    L  
    cnoesy    1538  1375     yes  1.72   1.35   2.09   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1540  1377     yes  2.95   1.86   4.04   3.69    0.00    0.12    14.3    no       A    Q  
    cnoesy    1547  1384     yes  2.49   1.72   3.27   2.51    0.00    0.00     0.0    no       A    I  
    cnoesy    1553  1390     yes  2.99   1.87   4.12   3.30    0.00    0.00     0.0    no       A    L  
    cnoesy    1556  1393     yes  2.11   1.55   2.67   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1563  1400     yes  2.55   1.74   3.36   2.32    0.00    0.00     0.0    no       A    I  
    cnoesy    1566  1401     yes  2.49   1.71   3.26   2.63    0.00    0.00     0.0    no       A    I  
    cnoesy    1567  1402     yes  2.74   1.80   3.68   2.88    0.00    0.00     0.0    no       A    I  
    cnoesy    1570  1405     yes  2.15   1.57   2.73   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1575  1410     yes  2.43   1.69   3.17   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    1576  1411     yes  2.54   1.73   3.34   2.65    0.00    0.00     0.0    no       A    Q  
    cnoesy    1577  1412     yes  2.87   1.84   3.91   3.39    0.00    0.00     0.0    no       A    I  
    cnoesy    1579  1413     yes  2.68   1.78   3.58   2.61    0.00    0.00     0.0    no       A    I  
    cnoesy    1580  1414     yes  2.64   1.77   3.51   2.45    0.00    0.00     0.0    no       A    I  
    cnoesy    1581  1415     yes  2.95   1.86   4.03   2.99    0.00    0.00     0.0    no       A    I  
    cnoesy    1582  1416     yes  3.09   1.90   4.29   4.43    0.00    0.14    71.4   yes       A    Q  
    cnoesy    1584  1418     yes  2.36   1.66   3.05   1.72    0.00    0.00     0.0    no       A    I  
    cnoesy    1589  1423     yes  2.66   1.77   3.54   2.48    0.00    0.00     0.0    no       A    I  
    cnoesy    1594  1428     yes  3.03   1.88   4.17   4.00    0.00    0.00     0.0    no       A    Q  
    cnoesy    1598  1431     yes  2.54   1.73   3.35   2.35    0.00    0.00     0.0    no       A    I  
    cnoesy    1599  1432     yes  2.45   1.70   3.19   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy    1600  1433     yes  3.04   1.88   4.19   3.20    0.00    0.00     0.0    no       A    Q  
    cnoesy    1604  1437     yes  2.38   1.67   3.09   2.56    0.00    0.00     0.0    no       A    I  
    cnoesy    1605  1438     yes  2.58   1.75   3.41   3.01    0.00    0.00     0.0    no       A    I  
    cnoesy    1607  1440     yes  1.80   1.40   2.21   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1608  1441     yes  2.61   1.76   3.46   2.55    0.00    0.00     0.0    no       A    I  
    cnoesy    1609  1442     yes  2.88   1.84   3.91   3.41    0.00    0.00     0.0    no       A    Q  
    cnoesy    1617  1449     yes  3.13   1.91   4.36   2.56    0.00    0.00     0.0    no       A    I  
    cnoesy    1619  1451     yes  2.74   1.80   3.68   3.54    0.00    0.10     0.0    no       A    Q  
    cnoesy    1623  1455     yes  2.34   1.65   3.02   3.02    0.00    0.00     0.0    no       A    I  
    cnoesy    1624  1456     yes  2.36   1.67   3.06   2.50    0.00    0.00     0.0    no       A    I  
    cnoesy    1627  1459     yes  1.79   1.39   2.19   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1631  1463     yes  2.78   1.81   3.75   3.44    0.00    0.02     0.0    no       A    I  
    cnoesy    1634  1466     yes  2.81   1.82   3.80   3.28    0.00    0.00     0.0    no       A    I  
    cnoesy    1639  1471     yes  3.16   1.91   4.41   4.10    0.00    0.01     0.0    no       A    S  
    cnoesy    1640  1472     yes  2.43   1.69   3.18   3.02    0.00    0.00     0.0    no       A    I  
    cnoesy    1642  1474     yes  2.53   1.73   3.33   2.54    0.00    0.00     0.0    no       A    I  
    cnoesy    1643  1475     yes  3.19   1.92   4.46   3.92    0.00    0.00     0.0    no       A    Q  
    cnoesy    1644  1476     yes  2.84   1.83   3.84   3.00    0.00    0.00     0.0    no       A    I  
    cnoesy    1650  1482     yes  2.21   1.60   2.83   2.11    0.00    0.00     0.0    no       A    I  
    cnoesy    1658  1490     yes  2.82   1.83   3.82   3.64    0.00    0.05     0.0    no       A    I  
    cnoesy    1661  1493     yes  2.36   1.66   3.05   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1662  1494     yes  2.83   1.83   3.83   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    1663  1495     yes  2.79   1.82   3.77   2.43    0.00    0.00     0.0    no       A    I  
    cnoesy    1667  1499     yes  2.57   1.74   3.40   2.74    0.00    0.00     0.0    no       A    I  
    cnoesy    1669  1501     yes  3.05   1.89   4.21   4.14    0.00    0.00     0.0    no       A    Q  
    cnoesy    1670  1502     yes  3.19   1.92   4.45   2.98    0.00    0.00     0.0    no       A    Q  
    cnoesy    1673  1505     yes  2.73   1.80   3.67   2.94    0.00    0.00     0.0    no       A    I  
    cnoesy    1678  1510     yes  2.06   1.53   2.60   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1681  1513     yes  2.54   1.73   3.35   2.47    0.00    0.00     0.0    no       A    I  
    cnoesy    1682  1514     yes  2.92   1.85   3.99   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    1683  1515     yes  3.09   1.90   4.29   4.28    0.00    0.02     0.0    no       A    Q  
    cnoesy    1684  1516     yes  2.97   1.87   4.07   3.00    0.00    0.00     0.0    no       A    I  
    cnoesy    1686  1518     yes  2.86   1.84   3.88   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    1691  1523     yes  2.92   1.85   3.98   2.70    0.00    0.00     0.0    no       A    S  
    cnoesy    1692  1524     yes  2.51   1.72   3.29   2.81    0.00    0.00     0.0    no       A    I  
    cnoesy    1694  1526     yes  3.03   1.88   4.19   3.49    0.00    0.00     0.0    no       A    Q  
    cnoesy    1695  1527     yes  3.16   1.91   4.40   3.94    0.00    0.00     0.0    no       A    L  
    cnoesy    1698  1530     yes  2.49   1.72   3.27   2.00    0.00    0.00     0.0    no       A    S  
    cnoesy    1699  1531     yes  2.62   1.76   3.47   2.18    0.00    0.00     0.0    no       A    I  
    cnoesy    1702  1534     yes  2.15   1.57   2.73   2.84    0.00    0.11    42.9    no       A    I  
    cnoesy    1703  1535     yes  2.25   1.62   2.89   2.95    0.00    0.06     0.0    no       A    I  
    cnoesy    1704  1536     yes  2.70   1.79   3.62   2.85    0.00    0.00     0.0    no       A    I  
    cnoesy    1705  1537     yes  2.89   1.85   3.94   3.32    0.00    0.00     0.0    no       A    S  
    cnoesy    1706  1538     yes  2.41   1.69   3.14   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    1712  1544     yes  3.16   1.91   4.42   3.29    0.00    0.00     0.0    no       A    S  
    cnoesy    1714  1546     yes  2.59   1.75   3.42   2.74    0.00    0.00     0.0    no       A    I  
    cnoesy    1723  1555     yes  2.49   1.71   3.26   2.57    0.00    0.13    42.9    no       A    I  
    cnoesy    1724  1556     yes  2.64   1.77   3.51   2.68    0.00    0.00     0.0    no       A    I  
    cnoesy    1726  1558     yes  1.77   1.38   2.15   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1732  1564     yes  2.56   1.74   3.39   3.44    0.00    0.09    14.3    no       A    Q  
    cnoesy    1733  1565     yes  2.66   1.78   3.55   3.04    0.08    0.03     0.0    no       A    I  
    cnoesy    1734  1566     yes  2.87   1.84   3.90   2.60    0.00    0.00     0.0    no       A    Q  
    cnoesy    1737  1569     yes  2.97   1.87   4.07   3.38    0.00    0.15    14.3    no       A    Q  
    cnoesy    1745  1577     yes  3.07   1.89   4.25   3.12    0.00    0.00     0.0    no       A    S  
    cnoesy    1747  1579     yes  2.91   1.85   3.97   3.10    0.00    0.00     0.0    no       A    Q  
    cnoesy    1748  1580     yes  3.09   1.90   4.29   3.55    0.00    0.00     0.0    no       A    Q  
    cnoesy    1749  1581     yes  3.17   1.91   4.43   3.89    0.00    0.00     0.0    no       A    S  
    cnoesy    1752  1584     yes  2.66   1.77   3.54   2.38    0.00    0.00     0.0    no       A    S  
    cnoesy    1753  1585     yes  2.87   1.84   3.90   3.03    0.00    0.00     0.0    no       A    S  
    cnoesy    1754  1586     yes  1.91   1.45   2.37   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1755  1587     yes  2.04   1.52   2.56   2.29    0.00    0.00     0.0    no       A    I  
    cnoesy    1757  1589     yes  2.49   1.71   3.26   2.94    0.00    0.00     0.0    no       A    I  
    cnoesy    1762  1594     yes  2.61   1.76   3.46   3.32    0.00    0.04     0.0    no       A    S  
    cnoesy    1768  1600     yes  2.54   1.73   3.35   2.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1770  1602     yes  2.96   1.86   4.06   3.51    0.00    0.00     0.0    no       A    Q  
    cnoesy    1773  1605     yes  2.18   1.59   2.78   2.39    0.00    0.00     0.0    no       A    I  
    cnoesy    1774  1606     yes  2.65   1.77   3.52   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    1775  1607     yes  2.66   1.77   3.54   2.80    0.00    0.00     0.0    no       A    I  
    cnoesy    1776  1608     yes  3.03   1.88   4.17   3.41    0.00    0.00     0.0    no       A    Q  
    cnoesy    1777  1609     yes  3.13   1.91   4.36   3.54    0.00    0.00     0.0    no       A    Q  
    cnoesy    1779  1610     yes  3.00   1.87   4.12   3.16    0.00    0.00     0.0    no       A    S  
    cnoesy    1780  1611     yes  2.84   1.83   3.84   2.56    0.00    0.00     0.0    no       A    S  
    cnoesy    1781  1612     yes  2.61   1.76   3.46   2.45    0.00    0.00     0.0    no       A    S  
    cnoesy    1782  1613     yes  2.74   1.80   3.68   3.46    0.00    0.06    14.3    no       A    Q  
    cnoesy    1783  1614     yes  3.10   1.90   4.30   4.48    0.00    0.17   100.0   yes       A    Q  
    cnoesy    1784  1615     yes  2.32   1.65   2.99   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy    1785  1616     yes  2.96   1.86   4.06   2.11    0.00    0.00     0.0    no       A    S  
    cnoesy    1786  1617     yes  2.52   1.72   3.31   2.11    0.01    0.00     0.0    no       A    S  
    cnoesy    1787  1618     yes  2.60   1.76   3.45   3.00    0.00    0.00     0.0    no       A    S  
    cnoesy    1790  1621     yes  2.58   1.75   3.41   2.93    0.00    0.00     0.0    no       A    S  
    cnoesy    1793  1624     yes  2.98   1.87   4.09   3.89    0.00    0.00     0.0    no       A    I  
    cnoesy    1794  1625     yes  3.03   1.88   4.18   3.81    0.00    0.00     0.0    no       A    I  
    cnoesy    1798  1629     yes  2.28   1.63   2.93   2.37    0.00    0.00     0.0    no       A    I  
    cnoesy    1799  1630     yes  2.98   1.87   4.09   3.42    0.00    0.00     0.0    no       A    Q  
    cnoesy    1800  1631     yes  3.06   1.89   4.23   4.21    0.00    0.06     0.0    no       A    S  
    cnoesy    1803  1634     yes  2.68   1.78   3.59   2.29    0.00    0.00     0.0    no       A    I  
    cnoesy    1804  1635     yes  2.76   1.81   3.72   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy    1805  1636     yes  2.81   1.82   3.79   3.31    0.00    0.02     0.0    no       A    I  
    cnoesy    1808  1639     yes  3.01   1.88   4.14   3.09    0.13    0.00    14.3    no       A    Q  
    cnoesy    1809  1640     yes  3.07   1.89   4.25   2.83    0.00    0.00     0.0    no       A    I  
    cnoesy    1810  1641     yes  2.93   1.86   4.01   2.56    0.00    0.00     0.0    no       A    I  
    cnoesy    1818  1649     yes  2.70   1.79   3.62   2.42    0.00    0.00     0.0    no       A    I  
    cnoesy    1821  1652     yes  2.21   1.60   2.82   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1827  1658     yes  2.75   1.80   3.69   2.21    0.00    0.00     0.0    no       A    I  
    cnoesy    1835  1661     yes  3.04   1.88   4.19   3.85    0.00    0.00     0.0    no       A    L  
    cnoesy    1844  1667     yes  2.00   1.50   2.50   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1845  1668     yes  2.41   1.68   3.13   2.90    0.00    0.00     0.0    no       A    I  
    cnoesy    1846  1669     yes  2.60   1.75   3.44   2.54    0.00    0.00     0.0    no       A    I  
    cnoesy    1847  1670     yes  2.46   1.70   3.22   2.95    0.00    0.00     0.0    no       A    I  
    cnoesy    1850  1672     yes  2.87   1.84   3.90   3.72    0.00    0.03     0.0    no       A    M  
    cnoesy    1855  1677     yes  3.02   1.88   4.16   3.85    0.00    0.00     0.0    no       A    S  
    cnoesy    1858  1679     yes  2.92   1.85   3.99   2.96    0.00    0.00     0.0    no       A    I  
    cnoesy    1859  1680     yes  2.95   1.86   4.03   4.18    0.00    0.15   100.0   yes       A    Q  
    cnoesy    1861  1682     yes  2.09   1.54   2.64   2.65    0.00    0.01     0.0    no       A    I  
    cnoesy    1863  1684     yes  2.30   1.64   2.96   2.33    0.00    0.00     0.0    no       A    I  
    cnoesy    1873  1694     yes  2.96   1.86   4.05   4.09    0.00    0.06    28.6    no       A    S  
    cnoesy    1885  1706     yes  3.05   1.89   4.21   3.60    0.00    0.00     0.0    no       A    Q  
    cnoesy    1886  1707     yes  2.28   1.63   2.93   2.69    0.00    0.39    14.3    no       A    I  
    cnoesy    1888  1709     yes  3.18   1.92   4.45   3.61    0.00    0.01     0.0    no       A    L  
    cnoesy    1891  1712     yes  2.66   1.77   3.54   3.03    0.00    0.03     0.0    no       A    I  
    cnoesy    1894  1715     yes  2.82   1.83   3.81   3.72    0.00    0.05     0.0    no       A    Q  
    cnoesy    1895  1716     yes  2.97   1.87   4.08   3.94    0.00    0.07    14.3    no       A    Q  
    cnoesy    1898  1719     yes  1.98   1.49   2.47   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    1899  1720     yes  2.23   1.61   2.85   2.79    0.00    0.08    14.3    no       A    I  
    cnoesy    1900  1721     yes  2.29   1.63   2.95   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    1904  1725     yes  1.80   1.39   2.20   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1914  1734     yes  2.49   1.71   3.26   2.95    0.00    0.02     0.0    no       A    M  
    cnoesy    1915  1735     yes  2.69   1.79   3.60   2.11    0.00    0.00     0.0    no       A    M  
    cnoesy    1924  1744     yes  2.04   1.52   2.57   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1927  1747     yes  2.41   1.68   3.13   2.23    0.00    0.00     0.0    no       A    I  
    cnoesy    1928  1748     yes  2.30   1.64   2.95   2.67    0.00    0.00     0.0    no       A    I  
    cnoesy    1932  1752     yes  2.59   1.75   3.42   2.66    0.00    0.05     0.0    no       A    I  
    cnoesy    1934  1754     yes  2.62   1.76   3.48   3.30    0.00    0.02     0.0    no       A    I  
    cnoesy    1936  1756     yes  2.70   1.79   3.61   2.84    0.00    0.00     0.0    no       A    I  
    cnoesy    1937  1757     yes  2.81   1.82   3.80   2.37    0.00    0.00     0.0    no       A    I  
    cnoesy    1938  1758     yes  1.93   1.46   2.39   2.46    0.00    0.09    28.6    no       A    I  
    cnoesy    1939  1759     yes  2.64   1.77   3.51   4.62    0.00    1.40    42.9    no       A    L  
    cnoesy    1941  1761     yes  2.16   1.58   2.75   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1944  1764     yes  3.05   1.89   4.22   3.15    0.02    0.08    14.3    no       A    Q  
    cnoesy    1949  1769     yes  2.20   1.60   2.81   2.70    0.00    0.12    42.9    no       A    I  
    cnoesy    1950  1770     yes  1.75   1.37   2.13   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    1954  1773     yes  2.64   1.77   3.51   3.48    0.00    0.05     0.0    no       A    I  
    cnoesy    1955  1774     yes  3.04   1.88   4.19   3.33    0.00    0.00     0.0    no       A    L  
    cnoesy    1956  1775     yes  2.12   1.56   2.69   2.12    0.00    0.00     0.0    no       A    Q  
    cnoesy    1957  1776     yes  2.99   1.87   4.12   2.04    0.01    0.00     0.0    no       A    S  
    cnoesy    1958  1777     yes  2.88   1.84   3.92   3.15    0.00    0.00     0.0    no       A    S  
    cnoesy    1959  1778     yes  2.55   1.74   3.36   2.88    0.00    0.00     0.0    no       A    I  
    cnoesy    1963  1781     yes  3.17   1.91   4.42   3.50    0.00    0.00     0.0    no       A    I  
    cnoesy    1968  1786     yes  2.06   1.53   2.59   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1970  1788     yes  2.71   1.79   3.63   3.22    0.00    0.00     0.0    no       A    I  
    cnoesy    1978  1792     yes  2.61   1.76   3.46   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy    1981  1795     yes  2.60   1.75   3.44   2.47    0.00    0.00     0.0    no       A    I  
    cnoesy    1984  1798     yes  2.98   1.87   4.09   2.87    0.00    0.00     0.0    no       A    L  
    cnoesy    1985  1799     yes  2.82   1.83   3.82   3.17    0.00    0.00     0.0    no       A    L  
    cnoesy    1987  1801     yes  2.01   1.51   2.52   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    1988  1802     yes  2.92   1.85   3.99   1.94    0.04    0.00     0.0    no       A    L  
    cnoesy    1989  1803     yes  2.92   1.86   3.99   2.68    0.00    0.00     0.0    no       A    L  
    cnoesy    1994  1808     yes  2.68   1.78   3.58   2.78    0.00    0.00     0.0    no       A    I  
    cnoesy    2006  1817     yes  2.49   1.71   3.26   2.85    0.00    0.00     0.0    no       A    I  
    cnoesy    2008  1819     yes  2.63   1.77   3.50   3.46    0.00    0.00     0.0    no       A    Q  
    cnoesy    2012  1823     yes  2.07   1.53   2.60   2.59    0.00    0.03     0.0    no       A    I  
    cnoesy    2024  1834     yes  2.27   1.62   2.91   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy    2033  1843     yes  2.72   1.79   3.64   2.83    0.00    0.00     0.0    no       A    I  
    cnoesy    2034  1844     yes  3.07   1.89   4.24   3.88    0.00    0.00     0.0    no       A    S  
    cnoesy    2036  1846     yes  1.83   1.41   2.25   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2042  1852     yes  2.12   1.56   2.68   1.83    0.00    0.00     0.0    no       A    I  
    cnoesy    2045  1855     yes  2.60   1.75   3.44   3.44    0.00    0.02     0.0    no       A    Q  
    cnoesy    2063  1872     yes  2.95   1.86   4.03   2.65    0.00    0.00     0.0    no       A    S  
    cnoesy    2064  1873     yes  2.19   1.59   2.80   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    2067  1876     yes  2.27   1.63   2.92   2.16    0.00    0.00     0.0    no       A    I  
    cnoesy    2070  1879     yes  2.67   1.78   3.56   3.41    0.00    0.25    14.3    no       A    I  
    cnoesy    2072  1881     yes  2.31   1.64   2.98   3.12    0.00    0.14   100.0   yes       A    I  
    cnoesy    2079  1888     yes  2.64   1.77   3.51   3.12    0.00    0.05     0.0    no       A    I  
    cnoesy    2081  1890     yes  2.67   1.78   3.56   2.83    0.00    0.00     0.0    no       A    I  
    cnoesy    2083  1892     yes  3.11   1.90   4.32   2.99    0.00    0.00     0.0    no       A    I  
    cnoesy    2092  1901     yes  2.40   1.68   3.13   2.37    0.00    0.00     0.0    no       A    I  
    cnoesy    2095  1903     yes  2.46   1.70   3.22   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2096  1904     yes  3.16   1.91   4.42   3.27    0.00    0.00     0.0    no       A    I  
    cnoesy    2097  1905     yes  2.26   1.62   2.89   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2098  1906     yes  2.54   1.73   3.34   2.78    0.00    0.00     0.0    no       A    I  
    cnoesy    2099  1907     yes  2.23   1.61   2.86   2.19    0.00    0.00     0.0    no       A    I  
    cnoesy    2107  1915     yes  2.59   1.75   3.42   2.40    0.00    0.00     0.0    no       A    Q  
    cnoesy    2108  1916     yes  3.17   1.91   4.43   2.36    0.00    0.00     0.0    no       A    S  
    cnoesy    2109  1917     yes  3.18   1.92   4.45   3.12    0.00    0.00     0.0    no       A    S  
    cnoesy    2111  1919     yes  2.65   1.77   3.53   2.99    0.00    0.00     0.0    no       A    S  
    cnoesy    2112  1920     yes  2.90   1.85   3.95   3.89    0.00    0.03     0.0    no       A    S  
    cnoesy    2117  1925     yes  2.34   1.65   3.02   2.25    0.00    0.00     0.0    no       A    I  
    cnoesy    2118  1926     yes  2.51   1.72   3.30   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy    2120  1928     yes  2.89   1.85   3.93   3.21    0.00    0.00     0.0    no       A    I  
    cnoesy    2121  1929     yes  3.01   1.88   4.15   3.93    0.00    0.00     0.0    no       A    I  
    cnoesy    2122  1930     yes  2.96   1.86   4.05   3.94    0.00    0.00     0.0    no       A    I  
    cnoesy    2123  1931     yes  2.90   1.85   3.95   3.90    0.00    0.05     0.0    no       A    I  
    cnoesy    2127  1935     yes  1.95   1.47   2.42   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2128  1936     yes  2.97   1.87   4.07   3.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2129  1937     yes  3.13   1.91   4.35   3.81    0.00    0.00     0.0    no       A    I  
    cnoesy    2130  1938     yes  2.51   1.72   3.29   2.85    0.00    0.00     0.0    no       A    I  
    cnoesy    2134  1942     yes  3.03   1.88   4.17   3.54    0.00    0.00     0.0    no       A    L  
    cnoesy    2141  1944     yes  3.08   1.89   4.27   2.80    0.00    0.00     0.0    no       A    I  
    cnoesy    2144  1945     yes  2.46   1.70   3.22   2.92    0.00    0.00     0.0    no       A    I  
    cnoesy    2145  1946     yes  2.41   1.68   3.14   2.59    0.00    0.00     0.0    no       A    I  
    cnoesy    2149  1948     yes  1.85   1.42   2.28   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2152  1951     yes  3.05   1.89   4.22   2.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2153  1952     yes  3.12   1.90   4.34   3.51    0.00    0.00     0.0    no       A    Q  
    cnoesy    2154  1953     yes  2.52   1.73   3.32   2.89    0.00    0.00     0.0    no       A    I  
    cnoesy    2155  1954     yes  3.01   1.88   4.14   3.70    0.00    0.00     0.0    no       A    S  
    cnoesy    2160  1959     yes  3.03   1.88   4.17   3.61    0.00    0.00     0.0    no       A    S  
    cnoesy    2162  1961     yes  3.16   1.91   4.40   3.53    0.00    0.00     0.0    no       A    Q  
    cnoesy    2163  1962     yes  2.58   1.75   3.41   2.81    0.00    0.00     0.0    no       A    I  
    cnoesy    2165  1964     yes  2.50   1.72   3.28   2.82    0.00    0.00     0.0    no       A    I  
    cnoesy    2166  1965     yes  2.50   1.72   3.28   2.70    0.00    0.00     0.0    no       A    I  
    cnoesy    2167  1966     yes  2.32   1.65   3.00   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2168  1967     yes  2.58   1.75   3.41   2.48    0.00    0.00     0.0    no       A    I  
    cnoesy    2171  1970     yes  2.09   1.54   2.64   2.39    0.00    0.00     0.0    no       A    I  
    cnoesy    2172  1971     yes  2.74   1.80   3.68   3.29    0.00    0.15    42.9    no       A    I  
    cnoesy    2173  1972     yes  2.77   1.81   3.74   3.70    0.00    0.11    28.6    no       A    I  
    cnoesy    2175  1974     yes  2.56   1.74   3.38   3.03    0.00    0.00     0.0    no       A    I  
    cnoesy    2176  1975     yes  2.44   1.70   3.18   2.50    0.00    0.00     0.0    no       A    I  
    cnoesy    2178  1977     yes  2.68   1.78   3.58   3.58    0.00    0.05     0.0    no       A    S  
    cnoesy    2186  1985     yes  2.57   1.75   3.40   2.89    0.00    0.00     0.0    no       A    I  
    cnoesy    2189  1987     yes  2.80   1.82   3.77   2.20    0.00    0.00     0.0    no       A    I  
    cnoesy    2192  1989     yes  2.34   1.66   3.03   2.36    0.00    0.00     0.0    no       A    I  
    cnoesy    2197  1994     yes  2.48   1.71   3.25   2.26    0.00    0.00     0.0    no       A    I  
    cnoesy    2200  1997     yes  2.98   1.87   4.09   1.92    0.04    0.00     0.0    no       A    L  
    cnoesy    2204  2001     yes  2.77   1.81   3.74   3.61    0.00    0.14    28.6    no       A    S  
    cnoesy    2205  2002     yes  3.03   1.88   4.19   3.79    0.00    0.00     0.0    no       A    Q  
    cnoesy    2206  2003     yes  3.07   1.89   4.25   3.98    0.00    0.02     0.0    no       A    S  
    cnoesy    2210  2007     yes  2.53   1.73   3.32   3.30    0.00    0.07    28.6    no       A    S  
    cnoesy    2211  2008     yes  2.54   1.73   3.35   2.59    0.00    0.01     0.0    no       A    S  
    cnoesy    2213  2010     yes  2.61   1.76   3.46   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    2214  2011     yes  3.05   1.89   4.22   3.23    0.00    0.00     0.0    no       A    S  
    cnoesy    2215  2012     yes  2.29   1.64   2.95   2.82    0.00    0.01     0.0    no       A    I  
    cnoesy    2216  2013     yes  2.62   1.76   3.48   2.52    0.00    0.00     0.0    no       A    Q  
    cnoesy    2217  2014     yes  2.78   1.81   3.74   2.71    0.00    0.00     0.0    no       A    I  
    cnoesy    2219  2016     yes  2.90   1.85   3.95   2.96    0.00    0.06     0.0    no       A    Q  
    cnoesy    2221  2018     yes  3.06   1.89   4.23   3.55    0.00    0.00     0.0    no       A    Q  
    cnoesy    2222  2019     yes  3.04   1.88   4.19   3.50    0.00    0.01     0.0    no       A    S  
    cnoesy    2224  2021     yes  2.59   1.75   3.43   2.88    0.00    0.00     0.0    no       A    I  
    cnoesy    2225  2022     yes  2.54   1.73   3.34   2.26    0.00    0.00     0.0    no       A    I  
    cnoesy    2226  2023     yes  2.86   1.84   3.89   2.93    0.00    0.00     0.0    no       A    I  
    cnoesy    2228  2025     yes  2.69   1.79   3.60   2.45    0.00    0.00     0.0    no       A    S  
    cnoesy    2230  2027     yes  2.32   1.65   3.00   1.71    0.00    0.00     0.0    no       A    I  
    cnoesy    2232  2029     yes  2.84   1.83   3.86   2.53    0.00    0.00     0.0    no       A    I  
    cnoesy    2236  2033     yes  2.89   1.85   3.93   2.35    0.00    0.00     0.0    no       A    I  
    cnoesy    2237  2034     yes  2.90   1.85   3.95   2.52    0.00    0.00     0.0    no       A    I  
    cnoesy    2240  2037     yes  3.13   1.91   4.36   3.52    0.00    0.00     0.0    no       A    I  
    cnoesy    2242  2038     yes  2.98   1.87   4.10   2.45    0.00    0.00     0.0    no       A    I  
    cnoesy    2243  2039     yes  2.47   1.71   3.23   2.98    0.00    0.00     0.0    no       A    I  
    cnoesy    2246  2040     yes  2.38   1.67   3.09   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2247  2041     yes  2.96   1.86   4.06   2.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2249  2043     yes  2.45   1.70   3.20   3.34    0.00    0.15   100.0   yes       A    I  
    cnoesy    2250  2044     yes  3.18   1.92   4.44   3.45    0.00    0.00     0.0    no       A    Q  
    cnoesy    2251  2045     yes  2.69   1.78   3.59   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy    2264  2055     yes  2.60   1.75   3.44   3.57    0.00    0.15    57.1   yes       A    S  
    cnoesy    2268  2058     yes  2.69   1.78   3.59   2.73    0.00    0.00     0.0    no       A    I  
    cnoesy    2273  2063     yes  2.60   1.76   3.45   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy    2276  2066     yes  3.12   1.90   4.34   4.19    0.00    0.04     0.0    no       A    Q  
    cnoesy    2277  2067     yes  2.12   1.56   2.68   2.72    0.00    0.21    71.4   yes       A    I  
    cnoesy    2280  2070     yes  3.01   1.88   4.15   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    2281  2071     yes  1.95   1.47   2.42   2.28    0.00    0.00     0.0    no       A    I  
    cnoesy    2282  2072     yes  2.88   1.84   3.92   4.03    0.00    0.12   100.0   yes       A    I  
    cnoesy    2283  2073     yes  2.80   1.82   3.78   3.82    0.00    0.04     0.0    no       A    I  
    cnoesy    2285  2075     yes  3.04   1.89   4.20   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    2286  2076     yes  2.62   1.76   3.48   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2294  2084     yes  1.85   1.42   2.28   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2297  2087     yes  3.08   1.89   4.26   3.42    0.00    0.00     0.0    no       A    Q  
    cnoesy    2299  2089     yes  2.27   1.62   2.91   2.77    0.00    0.06     0.0    no       A    I  
    cnoesy    2300  2090     yes  2.36   1.67   3.06   2.61    0.00    0.00     0.0    no       A    I  
    cnoesy    2304  2094     yes  2.72   1.80   3.65   3.58    0.00    0.05     0.0    no       A    Q  
    cnoesy    2305  2095     yes  2.88   1.84   3.91   4.02    0.00    0.17    42.9    no       A    Q  
    cnoesy    2308  2098     yes  1.82   1.41   2.24   2.32    0.00    0.12    57.1   yes       A    I  
    cnoesy    2309  2099     yes  2.70   1.79   3.61   3.70    0.00    0.13    57.1   yes       A    S  
    cnoesy    2312  2102     yes  2.73   1.80   3.66   2.37    0.00    0.00     0.0    no       A    I  
    cnoesy    2313  2103     yes  2.37   1.67   3.07   2.61    0.00    0.00     0.0    no       A    I  
    cnoesy    2320  2108     yes  3.02   1.88   4.16   3.94    0.00    0.01     0.0    no       A    Q  
    cnoesy    2321  2109     yes  2.52   1.72   3.31   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    2322  2110     yes  3.19   1.92   4.47   4.06    0.00    0.00     0.0    no       A    M  
    cnoesy    2330  2116     yes  2.27   1.63   2.92   2.88    0.00    0.02     0.0    no       A    I  
    cnoesy    2341  2124     yes  2.81   1.82   3.79   2.57    0.00    0.08     0.0    no       A    Q  
    cnoesy    2342  2125     yes  2.78   1.81   3.75   3.57    0.00    0.00     0.0    no       A    Q  
    cnoesy    2343  2126     yes  2.74   1.80   3.68   3.34    0.00    0.00     0.0    no       A    Q  
    cnoesy    2359  2135     yes  2.34   1.65   3.02   2.65    0.00    0.00     0.0    no       A    I  
    cnoesy    2365  2141     yes  1.85   1.42   2.27   2.27    0.00    0.03     0.0    no       A    I  
    cnoesy    2366  2142     yes  2.10   1.55   2.65   2.35    0.00    0.00     0.0    no       A    I  
    cnoesy    2367  2143     yes  1.77   1.38   2.16   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2368  2144     yes  2.44   1.70   3.19   3.28    0.00    0.09    57.1   yes       A    Q  
    cnoesy    2369  2145     yes  2.02   1.51   2.53   2.38    0.00    0.00     0.0    no       A    I  
    cnoesy    2371  2147     yes  2.96   1.87   4.06   3.55    0.00    0.00     0.0    no       A    Q  
    cnoesy    2372  2148     yes  2.43   1.69   3.18   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2373  2149     yes  2.98   1.87   4.10   4.06    0.00    0.02     0.0    no       A    M  
    cnoesy    2375  2151     yes  2.09   1.54   2.64   2.35    0.00    0.00     0.0    no       A    I  
    cnoesy    2378  2154     yes  2.46   1.70   3.21   2.54    0.00    0.00     0.0    no       A    I  
    cnoesy    2380  2156     yes  2.13   1.56   2.69   2.62    0.00    0.02     0.0    no       A    I  
    cnoesy    2383  2159     yes  3.07   1.89   4.24   3.91    0.00    0.01     0.0    no       A    S  
    cnoesy    2384  2160     yes  2.99   1.87   4.11   3.47    0.00    0.00     0.0    no       A    Q  
    cnoesy    2385  2161     yes  2.56   1.74   3.39   2.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2386  2162     yes  2.40   1.68   3.12   2.81    0.00    0.00     0.0    no       A    I  
    cnoesy    2393  2169     yes  2.54   1.73   3.34   2.65    0.00    0.03     0.0    no       A    I  
    cnoesy    2394  2170     yes  2.57   1.74   3.40   3.55    0.00    0.20    71.4   yes       A    I  
    cnoesy    2395  2171     yes  2.43   1.69   3.17   3.00    0.00    0.02     0.0    no       A    I  
    cnoesy    2397  2173     yes  2.54   1.73   3.34   3.03    0.00    0.00     0.0    no       A    I  
    cnoesy    2398  2174     yes  2.41   1.68   3.13   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    2399  2175     yes  2.62   1.76   3.48   3.19    0.00    0.00     0.0    no       A    S  
    cnoesy    2404  2180     yes  2.81   1.82   3.80   3.73    0.00    0.00     0.0    no       A    S  
    cnoesy    2406  2182     yes  2.96   1.86   4.05   3.52    0.00    0.00     0.0    no       A    Q  
    cnoesy    2407  2183     yes  3.04   1.88   4.19   3.52    0.00    0.00     0.0    no       A    Q  
    cnoesy    2408  2184     yes  2.97   1.87   4.07   4.09    0.00    0.08    14.3    no       A    S  
    cnoesy    2409  2185     yes  2.47   1.71   3.23   2.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2410  2186     yes  3.14   1.91   4.37   4.27    0.00    0.00     0.0    no       A    M  
    cnoesy    2411  2187     yes  2.80   1.82   3.78   3.57    0.00    0.02     0.0    no       A    S  
    cnoesy    2419  2195     yes  2.56   1.74   3.38   3.00    0.00    0.00     0.0    no       A    I  
    cnoesy    2420  2196     yes  3.07   1.89   4.24   2.92    0.00    0.00     0.0    no       A    I  
    cnoesy    2422  2198     yes  2.61   1.76   3.46   2.87    0.00    0.00     0.0    no       A    I  
    cnoesy    2424  2200     yes  2.54   1.73   3.34   3.20    0.00    0.09    14.3    no       A    L  
    cnoesy    2434  2210     yes  2.49   1.71   3.26   3.17    0.00    0.04     0.0    no       A    L  
    cnoesy    2435  2211     yes  2.26   1.62   2.90   2.03    0.00    0.00     0.0    no       A    I  
    cnoesy    2436  2212     yes  2.34   1.66   3.02   2.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2438  2214     yes  2.42   1.69   3.16   3.26    0.00    0.11    57.1   yes       A    Q  
    cnoesy    2441  2217     yes  3.19   1.92   4.46   2.97    0.00    0.00     0.0    no       A    L  
    cnoesy    2443  2219     yes  1.98   1.49   2.47   2.28    0.00    0.00     0.0    no       A    I  
    cnoesy    2449  2225     yes  2.76   1.81   3.72   3.54    0.00    0.00     0.0    no       A    I  
    cnoesy    2451  2227     yes  2.83   1.83   3.83   3.01    0.00    0.00     0.0    no       A    S  
    cnoesy    2455  2231     yes  2.09   1.55   2.64   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2475  2250     yes  3.13   1.90   4.35   3.55    0.00    0.00     0.0    no       A    Q  
    cnoesy    2477  2252     yes  2.76   1.81   3.70   3.02    0.00    0.00     0.0    no       A    S  
    cnoesy    2484  2259     yes  2.63   1.77   3.50   2.96    0.00    0.06     0.0    no       A    I  
    cnoesy    2485  2260     yes  2.14   1.57   2.71   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy    2486  2261     yes  2.06   1.53   2.58   2.38    0.00    0.00     0.0    no       A    I  
    cnoesy    2488  2263     yes  1.76   1.37   2.15   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2491  2265     yes  2.62   1.76   3.48   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    2493  2267     yes  3.01   1.88   4.14   3.89    0.00    0.06     0.0    no       A    S  
    cnoesy    2496  2270     yes  2.92   1.85   3.99   2.78    0.00    0.00     0.0    no       A    I  
    cnoesy    2503  2277     yes  3.12   1.90   4.35   4.08    0.00    0.00     0.0    no       A    L  
    cnoesy    2504  2278     yes  2.86   1.84   3.88   3.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2505  2279     yes  3.19   1.92   4.46   4.38    0.00    0.06     0.0    no       A    Q  
    cnoesy    2507  2281     yes  3.03   1.88   4.17   3.52    0.00    0.00     0.0    no       A    L  
    cnoesy    2509  2283     yes  2.62   1.76   3.47   2.72    0.00    0.00     0.0    no       A    L  
    cnoesy    2510  2284     yes  2.36   1.67   3.06   2.54    0.00    0.00     0.0    no       A    I  
    cnoesy    2511  2285     yes  2.21   1.60   2.83   2.70    0.00    0.13    42.9    no       A    I  
    cnoesy    2514  2288     yes  2.28   1.63   2.93   2.47    0.00    0.07     0.0    no       A    I  
    cnoesy    2515  2289     yes  2.03   1.51   2.54   2.38    0.00    0.00     0.0    no       A    L  
    cnoesy    2523  2295     yes  3.00   1.87   4.12   4.01    0.00    0.03     0.0    no       A    L  
    cnoesy    2524  2296     yes  2.61   1.76   3.47   2.81    0.00    0.00     0.0    no       A    I  
    cnoesy    2527  2299     yes  3.06   1.89   4.24   3.48    0.00    0.00     0.0    no       A    Q  
    cnoesy    2529  2301     yes  3.09   1.90   4.28   4.09    0.00    0.00     0.0    no       A    Q  
    cnoesy    2531  2303     yes  3.15   1.91   4.39   2.91    0.00    0.00     0.0    no       A    I  
    cnoesy    2535  2306     yes  2.39   1.68   3.10   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2541  2310     yes  2.28   1.63   2.93   2.29    0.00    0.00     0.0    no       A    I  
    cnoesy    2548  2317     yes  2.54   1.73   3.35   3.58    0.00    0.28    85.7   yes       A    I  
    cnoesy    2555  2323     yes  2.38   1.67   3.08   2.40    0.00    0.00     0.0    no       A    I  
    cnoesy    2557  2325     yes  2.29   1.64   2.95   2.99    0.00    0.04     0.0    no       A    I  
    cnoesy    2561  2328     yes  1.93   1.47   2.40   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2563  2330     yes  2.18   1.59   2.78   2.09    0.00    0.00     0.0    no       A    I  
    cnoesy    2567  2334     yes  2.83   1.83   3.83   3.59    0.00    0.04    14.3    no       A    I  
    cnoesy    2569  2336     yes  2.77   1.81   3.73   3.00    0.00    0.00     0.0    no       A    Q  
    cnoesy    2570  2337     yes  2.73   1.80   3.67   3.46    0.00    0.00     0.0    no       A    Q  
    cnoesy    2572  2339     yes  2.50   1.72   3.29   2.04    0.00    0.00     0.0    no       A    I  
    cnoesy    2573  2340     yes  2.90   1.85   3.95   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy    2574  2341     yes  2.90   1.85   3.95   3.35    0.00    0.00     0.0    no       A    I  
    cnoesy    2579  2346     yes  2.50   1.72   3.28   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    2580  2347     yes  1.90   1.45   2.35   1.75    0.00    0.00     0.0    no       A    I  
    cnoesy    2581  2348     yes  2.57   1.75   3.40   2.86    0.00    0.00     0.0    no       A    I  
    cnoesy    2584  2351     yes  1.96   1.48   2.45   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2589  2356     yes  3.09   1.90   4.29   3.66    0.00    0.00     0.0    no       A    L  
    cnoesy    2590  2357     yes  2.62   1.76   3.48   3.14    0.00    0.00     0.0    no       A    I  
    cnoesy    2591  2358     yes  2.97   1.87   4.07   3.68    0.00    0.00     0.0    no       A    I  
    cnoesy    2592  2359     yes  3.07   1.89   4.25   3.01    0.00    0.00     0.0    no       A    L  
    cnoesy    2593  2360     yes  3.01   1.88   4.14   4.00    0.00    0.03     0.0    no       A    L  
    cnoesy    2594  2361     yes  2.86   1.84   3.88   2.67    0.00    0.00     0.0    no       A    L  
    cnoesy    2597  2364     yes  2.40   1.68   3.12   2.27    0.00    0.00     0.0    no       A    I  
    cnoesy    2599  2366     yes  2.09   1.54   2.64   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2606  2373     yes  2.85   1.83   3.86   3.95    0.00    0.09    28.6    no       A    I  
    cnoesy    2607  2374     yes  2.59   1.75   3.43   2.73    0.00    0.00     0.0    no       A    I  
    cnoesy    2612  2379     yes  3.16   1.91   4.41   4.22    0.00    0.00     0.0    no       A    Q  
    cnoesy    2622  2388     yes  2.25   1.62   2.89   2.63    0.00    0.00     0.0    no       A    I  
    cnoesy    2623  2389     yes  2.34   1.65   3.02   2.30    0.00    0.00     0.0    no       A    I  
    cnoesy    2625  2391     yes  2.53   1.73   3.33   2.97    0.00    0.00     0.0    no       A    I  
    cnoesy    2629  2395     yes  2.03   1.51   2.54   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2630  2396     yes  2.15   1.57   2.73   2.57    0.00    0.00     0.0    no       A    I  
    cnoesy    2631  2397     yes  2.73   1.80   3.65   3.53    0.00    0.00     0.0    no       A    S  
    cnoesy    2634  2400     yes  2.17   1.58   2.77   2.10    0.00    0.00     0.0    no       A    I  
    cnoesy    2641  2407     yes  2.88   1.84   3.91   2.47    0.00    0.00     0.0    no       A    S  
    cnoesy    2642  2408     yes  2.72   1.80   3.65   2.08    0.00    0.00     0.0    no       A    I  
    cnoesy    2643  2409     yes  2.76   1.81   3.71   3.39    0.00    0.00     0.0    no       A    I  
    cnoesy    2648  2414     yes  2.73   1.80   3.65   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy    2649  2415     yes  2.99   1.87   4.10   4.25    0.00    0.15    71.4   yes       A    S  
    cnoesy    2652  2418     yes  2.67   1.78   3.56   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    2655  2421     yes  3.14   1.91   4.37   3.58    0.00    0.00     0.0    no       A    Q  
    cnoesy    2657  2423     yes  2.86   1.84   3.89   3.56    0.00    0.00     0.0    no       A    I  
    cnoesy    2658  2424     yes  2.77   1.81   3.72   3.69    0.00    0.03     0.0    no       A    S  
    cnoesy    2660  2426     yes  3.16   1.91   4.41   3.12    0.00    0.00     0.0    no       A    I  
    cnoesy    2661  2427     yes  2.96   1.87   4.06   3.80    0.00    0.00     0.0    no       A    S  
    cnoesy    2669  2435     yes  2.33   1.65   3.01   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2672  2438     yes  2.51   1.72   3.30   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    2675  2441     yes  2.16   1.58   2.74   1.76    0.00    0.00     0.0    no       A    I  
    cnoesy    2677  2443     yes  2.27   1.62   2.91   2.87    0.00    0.01     0.0    no       A    S  
    cnoesy    2678  2444     yes  2.56   1.74   3.39   2.72    0.00    0.00     0.0    no       A    I  
    cnoesy    2679  2445     yes  2.13   1.56   2.70   2.06    0.00    0.00     0.0    no       A    I  
    cnoesy    2681  2447     yes  2.75   1.81   3.70   3.15    0.00    0.00     0.0    no       A    I  
    cnoesy    2682  2448     yes  2.55   1.74   3.37   2.26    0.00    0.00     0.0    no       A    I  
    cnoesy    2683  2449     yes  2.82   1.83   3.82   2.25    0.00    0.00     0.0    no       A    I  
    cnoesy    2684  2450     yes  2.59   1.75   3.43   2.95    0.00    0.08     0.0    no       A    I  
    cnoesy    2688  2454     yes  2.22   1.60   2.83   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    2690  2456     yes  1.90   1.45   2.36   1.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2697  2463     yes  2.34   1.66   3.03   2.88    0.00    0.00     0.0    no       A    I  
    cnoesy    2698  2464     yes  2.51   1.72   3.29   2.35    0.00    0.00     0.0    no       A    I  
    cnoesy    2699  2465     yes  2.39   1.68   3.10   2.40    0.00    0.00     0.0    no       A    I  
    cnoesy    2700  2466     yes  2.50   1.72   3.29   2.64    0.00    0.00     0.0    no       A    I  
    cnoesy    2702  2468     yes  2.32   1.65   2.99   2.79    0.00    0.01     0.0    no       A    I  
    cnoesy    2703  2469     yes  2.37   1.67   3.07   2.45    0.00    0.00     0.0    no       A    I  
    cnoesy    2704  2470     yes  2.27   1.62   2.91   2.43    0.00    0.00     0.0    no       A    I  
    cnoesy    2705  2471     yes  2.38   1.67   3.08   2.92    0.00    0.00     0.0    no       A    I  
    cnoesy    2707  2473     yes  2.63   1.77   3.50   2.65    0.06    0.00     0.0    no       A    I  
    cnoesy    2710  2476     yes  3.15   1.91   4.39   4.30    0.00    0.05     0.0    no       A    S  
    cnoesy    2716  2482     yes  2.59   1.75   3.43   2.03    0.02    0.00     0.0    no       A    S  
    cnoesy    2717  2483     yes  2.48   1.71   3.25   2.37    0.00    0.00     0.0    no       A    I  
    cnoesy    2719  2485     yes  2.51   1.72   3.29   2.63    0.00    0.00     0.0    no       A    I  
    cnoesy    2720  2486     yes  2.41   1.68   3.14   2.36    0.00    0.00     0.0    no       A    I  
    cnoesy    2721  2487     yes  2.63   1.76   3.49   2.36    0.00    0.00     0.0    no       A    I  
    cnoesy    2724  2490     yes  2.54   1.73   3.34   2.16    0.00    0.00     0.0    no       A    I  
    cnoesy    2725  2491     yes  1.95   1.48   2.43   1.77    0.00    0.00     0.0    no       A    I  
    cnoesy    2731  2496     yes  2.91   1.85   3.96   3.51    0.00    0.03     0.0    no       A    I  
    cnoesy    2736  2500     yes  3.00   1.88   4.13   3.70    0.00    0.00     0.0    no       A    S  
    cnoesy    2737  2501     yes  2.47   1.71   3.23   2.69    0.00    0.00     0.0    no       A    I  
    cnoesy    2740  2504     yes  2.94   1.86   4.03   3.86    0.00    0.00     0.0    no       A    I  
    cnoesy    2742  2506     yes  2.46   1.70   3.21   2.28    0.00    0.00     0.0    no       A    I  
    cnoesy    2746  2510     yes  3.09   1.90   4.29   4.03    0.00    0.12    28.6    no       A    S  
    cnoesy    2748  2512     yes  2.06   1.53   2.59   2.12    0.00    0.00     0.0    no       A    I  
    cnoesy    2751  2515     yes  2.51   1.72   3.30   3.34    0.00    0.14    57.1   yes       A    L  
    cnoesy    2753  2517     yes  3.07   1.89   4.25   2.23    0.01    0.00     0.0    no       A    L  
    cnoesy    2754  2518     yes  2.94   1.86   4.03   2.90    0.00    0.00     0.0    no       A    L  
    cnoesy    2755  2519     yes  1.98   1.49   2.48   2.09    0.00    0.00     0.0    no       A    Q  
    cnoesy    2757  2521     yes  3.04   1.89   4.20   2.59    0.00    0.00     0.0    no       A    Q  
    cnoesy    2760  2524     yes  2.35   1.66   3.05   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    2764  2528     yes  2.29   1.64   2.95   2.60    0.00    0.00     0.0    no       A    I  
    cnoesy    2765  2529     yes  2.35   1.66   3.04   2.33    0.00    0.00     0.0    no       A    I  
    cnoesy    2766  2530     yes  2.53   1.73   3.33   3.06    0.00    0.04     0.0    no       A    I  
    cnoesy    2767  2531     yes  2.66   1.78   3.54   2.86    0.00    0.07    14.3    no       A    I  
    cnoesy    2768  2532     yes  2.16   1.58   2.75   2.34    0.00    0.00     0.0    no       A    I  
    cnoesy    2770  2534     yes  2.96   1.86   4.05   4.12    0.00    0.07     0.0    no       A    Q  
    cnoesy    2810  2556     yes  3.10   1.90   4.30   3.74    0.00    0.00     0.0    no       A    L  
    cnoesy    2811  2557     yes  2.23   1.61   2.85   2.07    0.00    0.00     0.0    no       A    Q  
    cnoesy    2814  2560     yes  2.54   1.73   3.35   2.62    0.00    0.00     0.0    no       A    L  
    cnoesy    2835  2574     yes  3.16   1.91   4.41   3.26    0.00    0.00     0.0    no       A    L  
    cnoesy    2846  2582     yes  2.96   1.87   4.06   3.14    0.00    0.00     0.0    no       A    L  
    cnoesy    2849  2585     yes  3.01   1.88   4.15   2.80    0.00    0.02     0.0    no       A    L  
    cnoesy    2850  2586     yes  2.53   1.73   3.32   2.02    0.06    0.00    14.3    no       A    L  
    cnoesy    2852  2588     yes  2.92   1.86   3.99   2.67    0.00    0.00     0.0    no       A    I  
    cnoesy    2853  2589     yes  3.02   1.88   4.16   2.51    0.00    0.00     0.0    no       A    I  
    cnoesy    2861  2594     yes  3.30   1.94   4.65   3.23    0.00    0.00     0.0    no       A    I  
    cnoesy    2881  2607     yes  2.26   1.62   2.89   2.11    0.00    0.00     0.0    no       A    Q  
    cnoesy    2882  2608     yes  2.28   1.63   2.93   2.30    0.00    0.00     0.0    no       A    Q  
    cnoesy    2883  2609     yes  2.35   1.66   3.04   2.04    0.00    0.00     0.0    no       A    Q  
    cnoesy    2884  2610     yes  2.72   1.79   3.64   2.83    0.00    0.00     0.0    no       A    I  
    cnoesy    2885  2611     yes  2.60   1.75   3.44   2.71    0.00    0.00     0.0    no       A    I  
    cnoesy    2896  2621     yes  2.31   1.64   2.97   2.20    0.00    0.00     0.0    no       A    Q  
    cnoesy    2898  2623     yes  2.20   1.59   2.80   2.26    0.00    0.00     0.0    no       A    Q  
    cnoesy    2900  2625     yes  2.61   1.76   3.46   2.95    0.00    0.00     0.0    no       A    I  
    cnoesy    2901  2626     yes  2.63   1.76   3.49   2.55    0.09    0.00    14.3    no       A    I  
    cnoesy    2902  2627     yes  2.86   1.84   3.89   2.93    0.00    0.00     0.0    no       A    I  
    cnoesy    2903  2628     yes  2.90   1.85   3.95   4.13    0.00    0.18    85.7   yes       A    L  
    cnoesy    2904  2629     yes  2.83   1.83   3.83   2.65    0.00    0.02     0.0    no       A    L  
    cnoesy    2905  2630     yes  2.63   1.77   3.50   2.50    0.00    0.00     0.0    no       A    I  
    cnoesy    2906  2631     yes  2.32   1.65   2.99   2.49    0.00    0.00     0.0    no       A    I  
    cnoesy    2907  2632     yes  2.22   1.60   2.83   2.97    0.00    0.13   100.0   yes       A    I  
    cnoesy    2909  2634     yes  2.20   1.60   2.81   2.99    0.00    0.18   100.0   yes       A    Q  
    cnoesy    2910  2635     yes  2.45   1.70   3.20   2.87    0.00    0.00     0.0    no       A    I  
    cnoesy    2911  2636     yes  1.65   1.31   1.98   1.96    0.00    0.02     0.0    no       A    I  
    cnoesy    2917  2642     yes  3.59   1.98   5.20   4.64    0.00    0.00     0.0    no       A    Q  
    cnoesy    2918  2643     yes  3.25   1.93   4.57   3.87    0.00    0.06     0.0    no       A    Q  
    cnoesy    2955  2674     yes  2.78   1.81   3.74   2.96    0.00    0.00     0.0    no       A    I  
    cnoesy    2962  2680     yes  3.29   1.94   4.65   2.91    0.35    0.00    14.3    no       A    Q  
    cnoesy    2964  2682     yes  2.99   1.87   4.11   2.93    0.00    0.02     0.0    no       A    L  
    cnoesy    2966  2684     yes  2.65   1.77   3.53   3.46    0.00    0.04     0.0    no       A    Q  
    cnoesy    2970  2688     yes  2.01   1.51   2.52   2.31    0.00    0.00     0.0    no       A    Q  
    cnoesy    2971  2689     yes  2.71   1.79   3.63   2.90    0.00    0.00     0.0    no       A    I  
    cnoesy    2972  2690     yes  1.98   1.49   2.47   2.17    0.00    0.00     0.0    no       A    Q  
    cnoesy    2973  2691     yes  2.64   1.77   3.51   2.50    0.01    0.00     0.0    no       A    S  
    cnoesy    2974  2692     yes  2.80   1.82   3.79   2.78    0.00    0.00     0.0    no       A    I  
    cnoesy    2976  2694     yes  2.38   1.67   3.08   2.31    0.00    0.00     0.0    no       A    Q  
    cnoesy    2977  2695     yes  2.80   1.82   3.79   2.71    0.00    0.00     0.0    no       A    I  
    cnoesy    2980  2698     yes  2.55   1.74   3.36   2.70    0.00    0.00     0.0    no       A    I  
    cnoesy    2986  2704     yes  2.02   1.51   2.53   2.34    0.00    0.00     0.0    no       A    I  
    cnoesy    2987  2705     yes  2.47   1.71   3.24   2.94    0.00    0.00     0.0    no       A    I  
    cnoesy    2988  2706     yes  2.63   1.77   3.50   3.38    0.00    0.00     0.0    no       A    Q  
    cnoesy    2990  2708     yes  2.66   1.78   3.55   2.95    0.00    0.00     0.0    no       A    Q  
    cnoesy    2991  2709     yes  2.60   1.76   3.45   2.93    0.00    0.00     0.0    no       A    I  
    cnoesy    2992  2710     yes  2.77   1.81   3.73   3.39    0.00    0.00     0.0    no       A    Q  
    cnoesy    2993  2711     yes  2.22   1.61   2.84   2.43    0.00    0.00     0.0    no       A    Q  
    cnoesy    2995  2713     yes  2.35   1.66   3.04   2.70    0.00    0.00     0.0    no       A    I  
    cnoesy    2996  2714     yes  2.32   1.65   2.99   2.42    0.00    0.00     0.0    no       A    I  
    cnoesy    2997  2715     yes  2.50   1.72   3.28   3.02    0.00    0.00     0.0    no       A    I  
    cnoesy    2998  2716     yes  2.16   1.58   2.75   2.28    0.00    0.00     0.0    no       A    I  
    cnoesy    3000  2718     yes  2.44   1.69   3.18   2.31    0.00    0.00     0.0    no       A    I  
    cnoesy    3001  2719     yes  2.39   1.68   3.11   2.98    0.00    0.00     0.0    no       A    I  
    cnoesy    3002  2720     yes  2.73   1.80   3.67   2.66    0.00    0.00     0.0    no       A    I  
    cnoesy    3003  2721     yes  2.33   1.65   3.00   2.41    0.00    0.00     0.0    no       A    Q  
    cnoesy    3004  2722     yes  2.98   1.87   4.08   3.83    0.00    0.02     0.0    no       A    Q  
    cnoesy    3005  2723     yes  2.34   1.66   3.03   2.48    0.00    0.00     0.0    no       A    I  
    nnoesy      34  2756      no  2.90   1.85   3.95   3.71    0.28    1.46    57.1   yes       A    L  
    nnoesy      55  2776      no  3.85   2.00   5.69   5.95    0.00    0.42    57.1   yes       A    S  
    nnoesy      56  2777      no  2.95   1.86   4.03   4.70    0.00    0.67   100.0   yes       A    Q  
    nnoesy      74  2794      no  3.67   1.99   5.35   5.80    0.00    0.45   100.0   yes       A    L  
    nnoesy      87  2806      no  3.73   1.99   5.48   9.85    0.00    4.38   100.0   yes       A    L  
    nnoesy     108  2827      no  2.90   1.85   3.95   6.72    0.00    2.77   100.0   yes       A    L  
    nnoesy     158  2867      no  2.69   1.78   3.59   6.06    0.00    2.47   100.0   yes       A    L  
    nnoesy     164  2872      no  3.05   1.89   4.21   5.00    0.00    0.79   100.0   yes       A    Q  
    nnoesy     174  2881      no  3.46   1.96   4.95   7.22    0.00    2.26   100.0   yes       A    L  
    nnoesy     184  2891      no  3.63   1.98   5.28  11.54    0.00    6.26   100.0   yes       A    L  
    nnoesy     196  2902      no  3.85   2.00   5.69  12.55    0.00    6.85   100.0   yes       A    L  
    nnoesy     266  2970      no  3.62   1.98   5.25   9.18    0.00    3.92   100.0   yes       A    L  
    nnoesy     277  2981      no  2.40   1.68   3.12   3.33    0.00    0.21    85.7   yes       A    Q  
    nnoesy     318  3013      no  2.36   1.66   3.05   3.50    0.00    0.45   100.0   yes       A    L  
    nnoesy     366  3058      no  3.14   1.91   4.37   4.62    0.00    0.25    71.4   yes       A    I  
    nnoesy     411  3099      no  4.00   2.00   6.00   9.51    0.00    3.51   100.0   yes       A    L  
    nnoesy     437  3120      no  2.66   1.78   3.55   2.98    0.00    0.18    42.9    no       A    Q  
    nnoesy     462  3144      no  3.05   1.89   4.22   4.49    0.00    0.33    42.9    no       A    I  
    nnoesy     468  3150      no  3.94   2.00   5.88  25.97    0.00   20.08   100.0   yes       A    L  
    nnoesy     484  3166      no  3.07   1.89   4.25   4.60    0.00    0.35   100.0   yes       A    Q  
    nnoesy     485  3167      no  3.48   1.97   5.00   7.87    0.00    2.87   100.0   yes       A    L  
    nnoesy     486  3168      no  3.90   2.00   5.81   6.16    0.00    0.35   100.0   yes       A    M  
    nnoesy     507  3189      no  2.39   1.68   3.10   3.35    0.00    0.25   100.0   yes       A    I  
    nnoesy     601  3271      no  3.87   2.00   5.75  13.47    0.00    7.72   100.0   yes       A    L  
    nnoesy     626  3296      no  2.91   1.85   3.97   3.66    0.00    0.00     0.0    no       A    I  
    nnoesy     682  3330      no  3.58   1.98   5.18  14.98    0.00    9.80   100.0   yes       A    L  
    nnoesy     687  3335      no  3.28   1.94   4.63   5.36    0.00    0.72   100.0   yes       A    Q  
    nnoesy     707  3355      no  3.80   2.00   5.61   9.78    0.00    4.17   100.0   yes       A    L  
    nnoesy     724  3367      no  3.39   1.95   4.82   7.05    0.00    2.23   100.0   yes       A    S  
    nnoesy     742  3385      no  2.45   1.70   3.20   3.30    0.00    0.28    71.4   yes       A    I  
    nnoesy     757  3400      no  2.86   1.84   3.89   4.11    0.00    0.28    71.4   yes       A    Q  
    nnoesy     792  3422      no  2.94   1.86   4.02   4.37    0.00    0.35   100.0   yes       A    Q  
    nnoesy     798  3428      no  3.32   1.94   4.71   5.52    0.00    0.82   100.0   yes       A    Q  
    nnoesy     874  3498      no  3.60   1.98   5.23  29.98    0.00   24.75   100.0   yes       A    L  
    nnoesy     904  3528      no  3.69   1.99   5.39   6.55    0.00    1.88    71.4   yes       A    L  
    nnoesy     933  3557      no  3.96   2.00   5.93  13.88    0.00    7.95   100.0   yes       A    L  
    nnoesy     950  3573      no  3.76   1.99   5.52   6.27    0.00    0.75   100.0   yes       A    S  
    nnoesy     963  3583      no  2.90   1.85   3.96   4.10    0.00    0.14    57.1   yes       A    Q  
    nnoesy     976  3595      no  3.84   2.00   5.68  29.44    0.00   23.76   100.0   yes       A    L  
    nnoesy     979  3597      no  3.90   2.00   5.80  28.02    0.00   22.22   100.0   yes       A    L  
    nnoesy     983  3601      no  3.76   1.99   5.52   9.38    0.00    3.86   100.0   yes       A    L  
    nnoesy    1072  3668      no  2.88   1.84   3.92   4.10    0.00    0.39    71.4   yes       A    I  
    nnoesy    1188  3766      no  3.40   1.95   4.84   4.50    0.00    0.00     0.0    no       A    I  
    nnoesy    1319  3829      no  2.52   1.73   3.31   4.22    0.00    0.91   100.0   yes       A    Q  
    nnoesy    1326  3833      no  3.43   1.96   4.91   5.00    0.00    0.27    71.4   yes       A    Q  
    nnoesy    1336  3840      no  3.25   1.93   4.57   6.09    0.00    1.78    85.7   yes       A    M  
    nnoesy    1337  3841      no  1.99   1.50   2.49   8.46    0.00    5.98   100.0   yes       A    S  
    nnoesy    1363  3861      no  3.49   1.97   5.02   6.31    0.00    1.29   100.0   yes       A    M  
    nnoesy    1461  3877      no  3.83   2.00   5.67   8.29    0.00    2.62   100.0   yes       A    L  
    nnoesy    1464  3880      no  3.76   1.99   5.54   8.15    0.00    2.62   100.0   yes       A    L  
    nnoesy    1465  3881      no  3.74   1.99   5.48   8.36    0.00    2.88   100.0   yes       A    L  
    nnoesy    1495  3891      no  4.03   2.00   6.05  14.45    0.00    8.40   100.0   yes       A    L  
    nnoesy    1496  3892      no  3.77   1.99   5.55  20.55    0.00   15.00   100.0   yes       A    L  
    nnoesy    1511  3900      no  3.96   2.00   5.93  18.44    0.00   12.51   100.0   yes       A    L  
    nnoesy    1548  3932      no  3.60   1.98   5.23   4.58    0.00    0.00     0.0    no       A    M  
    nnoesy    1557  3938      no  3.55   1.97   5.12  10.30    0.00    5.18   100.0   yes       A    L  
    nnoesy    1599  3977      no  2.86   1.84   3.89   3.70    0.00    0.31    71.4   yes       A    Q  
    cnoesy      48    34      no  2.48   1.71   3.25   3.90    0.00    0.65   100.0   yes       A    Q  
    cnoesy      89    61      no  2.43   1.69   3.17   3.57    0.00    0.40   100.0   yes       A    I  
    cnoesy      92    64      no  2.82   1.83   3.82   5.20    0.00    2.03    71.4   yes       A    L  
    cnoesy      97    69      no  2.10   1.55   2.65   2.76    0.00    0.23    57.1   yes       A    I  
    cnoesy     104    75      no  2.92   1.85   3.98   4.74    0.00    0.76   100.0   yes       A    Q  
    cnoesy     105    76      no  2.93   1.86   4.01   3.57    0.03    1.45    28.6    no       A    L  
    cnoesy     108    79      no  2.45   1.70   3.19   4.60    0.00    1.41   100.0   yes       A    L  
    cnoesy     113    84      no  1.99   1.50   2.49   2.68    0.00    0.42    57.1   yes       A    I  
    cnoesy     122    91      no  3.15   1.91   4.40   5.72    0.00    1.32   100.0   yes       A    L  
    cnoesy     162   128      no  3.14   1.91   4.38  30.45    0.00   26.07   100.0   yes       A    L  
    cnoesy     202   163      no  2.51   1.72   3.30   3.29    0.00    0.32    57.1   yes       A    L  
    cnoesy     209   170      no  2.94   1.86   4.01   5.24    0.00    1.84    71.4   yes       A    L  
    cnoesy     231   191      no  3.11   1.90   4.32   4.71    0.00    0.39   100.0   yes       A    L  
    cnoesy     310   269      no  2.83   1.83   3.83  14.92    0.00   11.09   100.0   yes       A    L  
    cnoesy     311   270      no  2.92   1.85   3.98   4.76    0.00    0.79   100.0   yes       A    S  
    cnoesy     317   276      no  3.03   1.88   4.18   5.99    0.00    1.82   100.0   yes       A    S  
    cnoesy     335   294      no  1.93   1.47   2.40   7.41    0.00    5.00   100.0   yes       A    M  
    cnoesy     338   297      no  2.89   1.85   3.93  15.33    0.00   11.41   100.0   yes       A    L  
    cnoesy     346   303      no  3.16   1.91   4.41   4.74    0.00    0.42    85.7   yes       A    L  
    cnoesy     368   325      no  3.06   1.89   4.23   5.08    0.00    0.85   100.0   yes       A    Q  
    cnoesy     402   358      no  2.71   1.79   3.64   5.18    0.00    1.54   100.0   yes       A    Q  
    cnoesy     405   361      no  2.16   1.58   2.74   4.02    0.00    1.28   100.0   yes       A    L  
    cnoesy     420   376      no  2.44   1.70   3.19   3.62    0.00    0.43   100.0   yes       A    S  
    cnoesy     468   422      no  3.19   1.92   4.47   4.15    0.00    0.11    14.3    no       A    L  
    cnoesy     470   423      no  2.45   1.70   3.20   3.58    0.00    0.39   100.0   yes       A    I  
    cnoesy     476   428      no  2.60   1.75   3.44   4.16    0.00    0.85    85.7   yes       A    L  
    cnoesy     520   461      no  2.65   1.77   3.52   4.24    0.00    0.72   100.0   yes       A    Q  
    cnoesy     523   463      no  2.63   1.77   3.50   3.58    0.00    0.13    57.1   yes       A    Q  
    cnoesy     524   464      no  2.27   1.63   2.91   3.03    0.00    0.11    42.9    no       A    I  
    cnoesy     538   477      no  1.96   1.48   2.44   3.29    0.00    0.85   100.0   yes       A    S  
    cnoesy     555   494      no  2.74   1.80   3.67   4.05    0.00    0.38   100.0   yes       A    I  
    cnoesy     556   495      no  2.66   1.78   3.54   3.83    0.00    0.29   100.0   yes       A    I  
    cnoesy     562   501      no  2.32   1.65   2.99   2.59    0.00    0.14    14.3    no       A    Q  
    cnoesy     567   506      no  2.11   1.55   2.66   2.93    0.00    0.33    71.4   yes       A    I  
    cnoesy     579   518      no  3.02   1.88   4.16   6.78    0.00    2.62   100.0   yes       A    L  
    cnoesy     583   522      no  2.90   1.85   3.95   2.94    0.00    0.00     0.0    no       A    Q  
    cnoesy     588   527      no  2.84   1.83   3.84   5.51    0.00    1.67   100.0   yes       A    Q  
    cnoesy     595   534      no  1.82   1.41   2.23   5.97    0.00    3.74   100.0   yes       A    Q  
    cnoesy     608   546      no  2.80   1.82   3.79   4.03    0.00    0.25   100.0   yes       A    I  
    cnoesy     621   548      no  3.18   1.91   4.44   4.96    0.00    1.73    57.1   yes       A    L  
    cnoesy     624   550      no  2.83   1.83   3.83  11.77    0.00    7.94   100.0   yes       A    L  
    cnoesy     627   552      no  2.98   1.87   4.10   6.58    0.00    2.48   100.0   yes       A    L  
    cnoesy     629   553      no  2.74   1.80   3.68   4.11    0.00    0.43   100.0   yes       A    Q  
    cnoesy     650   567      no  2.28   1.63   2.94  12.88    0.00    9.94   100.0   yes       A    L  
    cnoesy     659   576      no  2.15   1.57   2.73   2.99    0.00    0.26   100.0   yes       A    Q  
    cnoesy     697   614      no  2.58   1.75   3.41   3.61    0.00    0.20   100.0   yes       A    L  
    cnoesy     698   615      no  2.59   1.75   3.43   3.34    0.00    0.06    14.3    no       A    L  
    cnoesy     703   620      no  3.06   1.89   4.22   6.78    0.00    2.56   100.0   yes       A    S  
    cnoesy     711   628      no  2.16   1.58   2.75   3.20    0.00    0.60    85.7   yes       A    L  
    cnoesy     721   637      no  2.16   1.57   2.74   2.91    0.00    0.18    85.7   yes       A    I  
    cnoesy     722   638      no  2.61   1.76   3.46   3.71    0.00    0.41    85.7   yes       A    M  
    cnoesy     746   658      no  2.85   1.83   3.86  25.19    0.00   21.33   100.0   yes       A    L  
    cnoesy     749   661      no  2.74   1.80   3.67   4.02    0.00    0.35   100.0   yes       A    L  
    cnoesy     761   673      no  2.70   1.79   3.62   5.00    0.00    1.39   100.0   yes       A    Q  
    cnoesy     780   692      no  2.54   1.73   3.35   3.79    0.00    0.44   100.0   yes       A    Q  
    cnoesy     805   717      no  2.99   1.87   4.11   6.05    0.00    1.93   100.0   yes       A    M  
    cnoesy     813   725      no  2.17   1.58   2.75   8.11    0.00    5.35   100.0   yes       A    L  
    cnoesy     817   729      no  2.86   1.84   3.88   4.58    0.00    0.70   100.0   yes       A    L  
    cnoesy     830   742      no  1.81   1.40   2.23   3.05    0.00    0.83   100.0   yes       A    I  
    cnoesy     837   749      no  3.03   1.88   4.19   4.91    0.00    0.72   100.0   yes       A    Q  
    cnoesy     846   758      no  2.29   1.63   2.95   3.41    0.00    0.47   100.0   yes       A    Q  
    cnoesy     848   760      no  2.67   1.78   3.56   3.90    0.00    0.49    85.7   yes       A    S  
    cnoesy     873   785      no  2.80   1.82   3.79  11.87    0.00    8.08   100.0   yes       A    L  
    cnoesy     874   786      no  2.13   1.56   2.70   3.98    0.00    1.28   100.0   yes       A    M  
    cnoesy     899   811      no  3.00   1.88   4.13   5.33    0.00    1.20   100.0   yes       A    L  
    cnoesy     907   819      no  1.99   1.50   2.49   6.70    0.00    4.21   100.0   yes       A    L  
    cnoesy     911   823      no  2.83   1.83   3.83   5.66    0.00    1.83   100.0   yes       A    S  
    cnoesy     919   831      no  3.16   1.91   4.41   4.56    0.00    0.39    42.9    no       A    L  
    cnoesy     946   857      no  2.55   1.74   3.36   3.75    0.00    0.39   100.0   yes       A    I  
    cnoesy     956   867      no  3.04   1.88   4.19   6.76    0.00    2.57   100.0   yes       A    S  
    cnoesy     962   873      no  2.80   1.82   3.78   4.07    0.00    0.34    71.4   yes       A    L  
    cnoesy     966   877      no  2.66   1.78   3.54   3.48    0.00    0.09    28.6    no       A    Q  
    cnoesy     986   897      no  2.77   1.81   3.72   4.05    0.00    0.97    57.1   yes       A    Q  
    cnoesy     988   899      no  2.83   1.83   3.83   4.28    0.00    0.44   100.0   yes       A    L  
    cnoesy     989   900      no  3.17   1.91   4.43  18.88    0.00   14.45   100.0   yes       A    L  
    cnoesy     994   905      no  2.39   1.67   3.10   2.87    0.00    0.86    28.6    no       A    I  
    cnoesy    1001   912      no  2.97   1.87   4.08   6.66    0.00    2.58   100.0   yes       A    L  
    cnoesy    1007   918      no  1.86   1.43   2.30   3.04    0.00    0.75    85.7   yes       A    I  
    cnoesy    1014   925      no  2.76   1.81   3.71   5.21    0.00    1.50   100.0   yes       A    L  
    cnoesy    1048   944      no  2.17   1.58   2.77   3.93    0.00    1.16   100.0   yes       A    L  
    cnoesy    1058   954      no  3.10   1.90   4.29   5.72    0.00    1.70    85.7   yes       A    L  
    cnoesy    1068   963      no  3.11   1.90   4.32  16.30    0.00   11.99   100.0   yes       A    L  
    cnoesy    1092   987      no  3.04   1.89   4.20   4.91    0.00    0.71   100.0   yes       A    Q  
    cnoesy    1142  1037      no  2.99   1.87   4.11   6.90    0.00    2.79   100.0   yes       A    L  
    cnoesy    1217  1100      no  2.80   1.82   3.79   3.58    0.00    0.79    28.6    no       A    L  
    cnoesy    1304  1182      no  1.89   1.44   2.34   2.65    0.00    0.60    71.4   yes       A    I  
    cnoesy    1326  1202      no  2.82   1.83   3.81   4.33    0.00    0.52   100.0   yes       A    I  
    cnoesy    1341  1216      no  2.84   1.83   3.85   4.00    0.00    0.37    57.1   yes       A    L  
    cnoesy    1441  1299      no  2.47   1.71   3.23   2.99    0.00    0.19    14.3    no       A    L  
    cnoesy    1503  1344      no  2.97   1.87   4.07   4.20    0.00    0.13    85.7   yes       A    Q  
    cnoesy    1531  1370      no  2.74   1.80   3.68  25.90    0.00   22.21   100.0   yes       A    L  
    cnoesy    1602  1435      no  3.15   1.91   4.38  13.54    0.00    9.15   100.0   yes       A    L  
    cnoesy    1603  1436      no  3.07   1.89   4.25  13.92    0.00    9.67   100.0   yes       A    L  
    cnoesy    1620  1452      no  2.83   1.83   3.83   4.28    0.00    0.45   100.0   yes       A    Q  
    cnoesy    1622  1454      no  3.01   1.88   4.15   5.60    0.00    1.45   100.0   yes       A    L  
    cnoesy    1636  1468      no  2.83   1.83   3.83  12.67    0.00    8.84   100.0   yes       A    L  
    cnoesy    1637  1469      no  3.12   1.90   4.33   3.53    0.00    0.00     0.0    no       A    L  
    cnoesy    1638  1470      no  3.14   1.91   4.38   5.34    0.00    0.96   100.0   yes       A    Q  
    cnoesy    1689  1521      no  2.83   1.83   3.83   4.39    0.00    0.56   100.0   yes       A    S  
    cnoesy    1717  1549      no  2.85   1.84   3.87   7.19    0.00    3.32   100.0   yes       A    L  
    cnoesy    1735  1567      no  2.32   1.65   2.99   3.09    0.00    0.24    42.9    no       A    I  
    cnoesy    1767  1599      no  3.07   1.89   4.25   4.59    0.00    0.35   100.0   yes       A    I  
    cnoesy    1771  1603      no  2.15   1.57   2.74   3.03    0.00    0.29   100.0   yes       A    I  
    cnoesy    1795  1626      no  2.09   1.54   2.64   2.73    0.00    0.27    71.4   yes       A    I  
    cnoesy    1814  1645      no  2.55   1.74   3.36   2.99    0.00    0.33    28.6    no       A    I  
    cnoesy    1878  1699      no  1.72   1.35   2.09   2.37    0.00    0.28   100.0   yes       A    I  
    cnoesy    1882  1703      no  2.74   1.80   3.68   8.02    0.00    4.34   100.0   yes       A    L  
    cnoesy    1892  1713      no  2.65   1.77   3.52   2.59    0.00    0.00     0.0    no       A    I  
    cnoesy    1897  1718      no  2.86   1.84   3.88   4.22    0.00    0.34   100.0   yes       A    L  
    cnoesy    1908  1729      no  2.85   1.84   3.87   8.90    0.00    5.03   100.0   yes       A    L  
    cnoesy    1917  1737      no  3.15   1.91   4.40  28.24    0.00   23.85   100.0   yes       A    L  
    cnoesy    1945  1765      no  2.71   1.79   3.62   7.79    0.00    4.87    85.7   yes       A    L  
    cnoesy    2013  1824      no  3.08   1.89   4.26   4.65    0.00    0.39   100.0   yes       A    Q  
    cnoesy    2052  1862      no  2.98   1.87   4.09   4.44    0.00    0.35   100.0   yes       A    Q  
    cnoesy    2056  1866      no  2.25   1.62   2.88   4.47    0.00    1.60   100.0   yes       A    Q  
    cnoesy    2114  1922      no  2.95   1.86   4.03   5.41    0.00    1.38   100.0   yes       A    L  
    cnoesy    2161  1960      no  2.68   1.78   3.58   3.67    0.00    0.34    71.4   yes       A    I  
    cnoesy    2180  1979      no  2.86   1.84   3.87   5.04    0.00    1.16   100.0   yes       A    S  
    cnoesy    2184  1983      no  2.80   1.82   3.79   9.22    0.00    6.54    85.7   yes       A    L  
    cnoesy    2187  1986      no  3.13   1.91   4.36   6.65    0.00    2.29   100.0   yes       A    L  
    cnoesy    2254  2048      no  2.94   1.86   4.02   8.73    0.00    4.70   100.0   yes       A    M  
    cnoesy    2261  2053      no  2.38   1.67   3.09   5.79    0.00    2.70   100.0   yes       A    Q  
    cnoesy    2267  2057      no  2.68   1.78   3.57   3.55    0.00    0.44    42.9    no       A    S  
    cnoesy    2270  2060      no  2.56   1.74   3.39   3.67    0.00    0.28    85.7   yes       A    I  
    cnoesy    2293  2083      no  3.10   1.90   4.31   6.65    0.00    2.35   100.0   yes       A    Q  
    cnoesy    2344  2127      no  2.45   1.70   3.20   2.79    0.00    0.00     0.0    no       A    I  
    cnoesy    2363  2139      no  2.70   1.79   3.61   5.77    0.00    2.16   100.0   yes       A    M  
    cnoesy    2370  2146      no  2.68   1.78   3.57   3.93    0.00    0.37   100.0   yes       A    S  
    cnoesy    2379  2155      no  2.20   1.60   2.81   3.00    0.00    0.19   100.0   yes       A    I  
    cnoesy    2396  2172      no  2.42   1.69   3.14   3.79    0.00    0.64   100.0   yes       A    I  
    cnoesy    2402  2178      no  2.56   1.74   3.38   4.71    0.00    1.81    85.7   yes       A    L  
    cnoesy    2421  2197      no  3.08   1.89   4.26   4.39    0.00    0.25    57.1   yes       A    L  
    cnoesy    2423  2199      no  3.07   1.89   4.24   4.59    0.00    0.62    57.1   yes       A    Q  
    cnoesy    2432  2208      no  2.45   1.70   3.20   3.85    0.00    0.65   100.0   yes       A    I  
    cnoesy    2437  2213      no  2.20   1.60   2.81   3.44    0.00    0.63   100.0   yes       A    Q  
    cnoesy    2439  2215      no  3.02   1.88   4.15  10.14    0.00    5.98   100.0   yes       A    L  
    cnoesy    2494  2268      no  3.15   1.91   4.40   4.81    0.00    0.41   100.0   yes       A    Q  
    cnoesy    2495  2269      no  3.16   1.91   4.42   4.71    0.00    0.29   100.0   yes       A    I  
    cnoesy    2498  2272      no  3.03   1.88   4.18   4.51    0.00    0.88    71.4   yes       A    S  
    cnoesy    2638  2404      no  3.12   1.90   4.33   4.49    0.00    0.16    57.1   yes       A    I  
    cnoesy    2694  2460      no  2.82   1.83   3.81   4.69    0.00    0.88   100.0   yes       A    Q  
    cnoesy    2696  2462      no  2.63   1.76   3.49   3.88    0.00    0.38   100.0   yes       A    I  
    cnoesy    2797  2547      no  3.13   1.90   4.35   1.66    0.24    0.00   100.0   yes       A    L  
    cnoesy    2813  2559      no  2.92   1.85   3.98   7.62    0.00    3.64   100.0   yes       A    L  
    cnoesy    2863  2596      no  3.22   1.92   4.51   5.49    0.00    0.98   100.0   yes       A    L  
    cnoesy    2893  2618      no  2.64   1.77   3.51  14.97    0.00   11.46   100.0   yes       A    L  
    cnoesy    2951  2670      no  2.49   1.71   3.26   4.36    0.00    1.10   100.0   yes       A    S  
    cnoesy    2978  2696      no  2.48   1.71   3.25   3.70    0.00    2.21    42.9    no       A    L  
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   HIS   6           HT1      HIS   6 -19.904  -7.267  -4.402
    2    H2   HIS   6           HT2      HIS   6 -21.483  -6.677  -4.553
    3    H3   HIS   6           HT3      HIS   6 -20.409  -5.938  -3.478
    4    HA   HIS   6           HA       HIS   6 -20.207  -5.983  -6.432
    5    HB2  HIS   6           HB2      HIS   6 -20.884  -3.814  -4.450
    6    HB3  HIS   6           HB1      HIS   6 -20.305  -3.445  -6.066
    7    HD1  HIS   6           HD1      HIS   6 -21.985  -3.464  -7.916
    8    HD2  HIS   6           HD2      HIS   6 -23.445  -5.180  -4.425
    9    HE1  HIS   6           HE1      HIS   6 -24.442  -3.809  -8.310
   10    HE2  HIS   6           HE2      HIS   6 -25.332  -4.672  -6.117
   11    H    GLN   7           HN       GLN   7 -18.793  -4.549  -3.461
   12    HA   GLN   7           HA       GLN   7 -16.438  -3.739  -4.788
   13    HB2  GLN   7           HB2      GLN   7 -17.205  -2.769  -2.645
   14    HB3  GLN   7           HB1      GLN   7 -16.777  -4.273  -1.857
   15    HG2  GLN   7           HG2      GLN   7 -14.990  -2.793  -1.440
   16    HG3  GLN   7           HG1      GLN   7 -14.418  -3.913  -2.674
   17   HE21  GLN   7          HE21      GLN   7 -16.658  -1.321  -3.369
   18   HE22  GLN   7          HE22      GLN   7 -15.556  -0.372  -4.303
   19    H    ASP   8           HN       ASP   8 -17.476  -6.797  -3.701
   20    HA   ASP   8           HA       ASP   8 -15.078  -8.022  -3.034
   21    HB2  ASP   8           HB2      ASP   8 -16.159 -10.141  -3.771
   22    HB3  ASP   8           HB1      ASP   8 -17.175  -9.167  -2.715
   23    H    ASN   9           HN       ASN   9 -16.467  -7.446  -6.227
   24    HA   ASN   9           HA       ASN   9 -14.088  -8.506  -7.530
   25    HB2  ASN   9           HB2      ASN   9 -16.757  -7.528  -8.410
   26    HB3  ASN   9           HB1      ASN   9 -15.421  -7.354  -9.547
   27   HD21  ASN   9          HD21      ASN   9 -17.373  -9.623  -7.747
   28   HD22  ASN   9          HD22      ASN   9 -16.951 -11.018  -8.679
   29    H    ALA  10           HN       ALA  10 -15.457  -5.478  -6.583
   30    HA   ALA  10           HA       ALA  10 -13.947  -3.836  -8.369
   31    HB1  ALA  10           HB1      ALA  10 -14.819  -1.988  -7.196
   32    HB2  ALA  10           HB2      ALA  10 -15.164  -2.961  -5.763
   33    HB3  ALA  10           HB3      ALA  10 -16.106  -3.200  -7.243
   34    H    ARG  11           HN       ARG  11 -13.597  -4.832  -5.023
   35    HA   ARG  11           HA       ARG  11 -11.544  -3.290  -4.115
   36    HB2  ARG  11           HB2      ARG  11 -10.903  -5.237  -2.723
   37    HB3  ARG  11           HB1      ARG  11 -12.622  -4.921  -2.692
   38    HG2  ARG  11           HG2      ARG  11 -12.743  -7.149  -2.996
   39    HG3  ARG  11           HG1      ARG  11 -12.515  -6.707  -4.685
   40    HD2  ARG  11           HD2      ARG  11 -10.045  -7.011  -4.325
   41    HD3  ARG  11           HD1      ARG  11 -10.440  -7.696  -2.750
   42    HE   ARG  11           HE       ARG  11 -11.934  -9.052  -4.683
   43   HH11  ARG  11          HH11      ARG  11  -8.601  -8.642  -3.696
   44   HH12  ARG  11          HH12      ARG  11  -8.109 -10.214  -4.232
   45   HH21  ARG  11          HH21      ARG  11 -11.288 -11.116  -5.420
   46   HH22  ARG  11          HH22      ARG  11  -9.641 -11.621  -5.223
   47    H    LYS  12           HN       LYS  12 -11.364  -6.131  -6.130
   48    HA   LYS  12           HA       LYS  12  -8.599  -6.341  -6.277
   49    HB2  LYS  12           HB2      LYS  12 -10.273  -8.059  -7.083
   50    HB3  LYS  12           HB1      LYS  12 -10.537  -7.028  -8.486
   51    HG2  LYS  12           HG2      LYS  12  -8.704  -7.744  -9.485
   52    HG3  LYS  12           HG1      LYS  12  -7.725  -7.478  -8.050
   53    HD2  LYS  12           HD2      LYS  12  -8.842  -9.657  -7.204
   54    HD3  LYS  12           HD1      LYS  12  -9.163  -9.931  -8.923
   55    HE2  LYS  12           HE2      LYS  12  -6.469  -9.313  -7.730
   56    HE3  LYS  12           HE1      LYS  12  -7.029 -10.917  -8.179
   57    HZ1  LYS  12           HZ1      LYS  12  -5.658 -10.013  -9.916
   58    HZ2  LYS  12           HZ2      LYS  12  -6.616  -8.622 -10.014
   59    HZ3  LYS  12           HZ3      LYS  12  -7.250 -10.123 -10.478
   60    H    SER  13           HN       SER  13 -10.889  -4.677  -8.442
   61    HA   SER  13           HA       SER  13  -8.743  -3.899 -10.186
   62    HB2  SER  13           HB2      SER  13 -10.937  -4.409 -11.103
   63    HB3  SER  13           HB1      SER  13 -11.684  -3.144 -10.120
   64    HG   SER  13           HG       SER  13  -9.663  -2.671 -12.068
   65    H    ARG  14           HN       ARG  14 -10.877  -2.176  -7.906
   66    HA   ARG  14           HA       ARG  14  -9.967   0.400  -8.589
   67    HB2  ARG  14           HB2      ARG  14 -11.062   1.166  -6.544
   68    HB3  ARG  14           HB1      ARG  14 -12.097   0.058  -7.433
   69    HG2  ARG  14           HG2      ARG  14 -12.331  -1.150  -5.585
   70    HG3  ARG  14           HG1      ARG  14 -10.599  -1.495  -5.643
   71    HD2  ARG  14           HD2      ARG  14 -11.650  -0.423  -3.524
   72    HD3  ARG  14           HD1      ARG  14 -10.081   0.123  -4.102
   73    HE   ARG  14           HE       ARG  14 -11.166   2.092  -4.986
   74   HH11  ARG  14          HH11      ARG  14 -13.244   0.084  -3.015
   75   HH12  ARG  14          HH12      ARG  14 -14.241   1.407  -2.496
   76   HH21  ARG  14          HH21      ARG  14 -12.502   3.830  -4.334
   77   HH22  ARG  14          HH22      ARG  14 -13.834   3.530  -3.262
   78    H    ILE  15           HN       ILE  15  -8.781  -1.986  -6.329
   79    HA   ILE  15           HA       ILE  15  -6.953  -0.111  -5.117
   80    HB   ILE  15           HB       ILE  15  -7.226  -3.097  -4.885
   81   HG12  ILE  15          HG12      ILE  15  -7.932  -0.932  -2.889
   82   HG13  ILE  15          HG11      ILE  15  -9.092  -1.594  -4.035
   83   HG21  ILE  15          HG21      ILE  15  -5.585  -1.185  -3.210
   84   HG22  ILE  15          HG22      ILE  15  -4.927  -2.291  -4.418
   85   HG23  ILE  15          HG23      ILE  15  -5.723  -2.933  -2.976
   86   HD11  ILE  15          HD11      ILE  15  -7.609  -3.168  -1.959
   87   HD12  ILE  15          HD12      ILE  15  -8.832  -3.785  -3.083
   88   HD13  ILE  15          HD13      ILE  15  -9.278  -2.607  -1.838
   89    H    GLN  16           HN       GLN  16  -6.886  -2.888  -7.274
   90    HA   GLN  16           HA       GLN  16  -4.234  -3.324  -7.686
   91    HB2  GLN  16           HB2      GLN  16  -6.638  -4.007  -8.904
   92    HB3  GLN  16           HB1      GLN  16  -5.626  -3.373 -10.195
   93    HG2  GLN  16           HG2      GLN  16  -3.845  -4.947  -9.488
   94    HG3  GLN  16           HG1      GLN  16  -4.985  -5.619  -8.322
   95   HE21  GLN  16          HE21      GLN  16  -4.186  -5.311 -11.690
   96   HE22  GLN  16          HE22      GLN  16  -5.246  -6.555 -12.256
   97    H    SER  17           HN       SER  17  -6.227  -0.846  -9.255
   98    HA   SER  17           HA       SER  17  -4.420   0.067 -11.140
   99    HB2  SER  17           HB2      SER  17  -6.353   1.755  -9.548
  100    HB3  SER  17           HB1      SER  17  -5.666   2.157 -11.122
  101    HG   SER  17           HG       SER  17  -6.773  -0.243 -11.321
  102    H    GLU  18           HN       GLU  18  -4.855   1.162  -7.821
  103    HA   GLU  18           HA       GLU  18  -2.564   2.900  -8.051
  104    HB2  GLU  18           HB2      GLU  18  -4.228   2.429  -5.611
  105    HB3  GLU  18           HB1      GLU  18  -3.245   3.832  -6.015
  106    HG2  GLU  18           HG2      GLU  18  -5.553   2.982  -7.693
  107    HG3  GLU  18           HG1      GLU  18  -5.745   4.041  -6.295
  108    H    HIS  19           HN       HIS  19  -3.351  -0.201  -6.688
  109    HA   HIS  19           HA       HIS  19  -1.439  -0.524  -4.727
  110    HB2  HIS  19           HB2      HIS  19  -2.836  -2.342  -4.836
  111    HB3  HIS  19           HB1      HIS  19  -2.843  -2.403  -6.588
  112    HD1  HIS  19           HD1      HIS  19  -0.331  -3.111  -3.791
  113    HD2  HIS  19           HD2      HIS  19  -1.493  -4.522  -7.517
  114    HE1  HIS  19           HE1      HIS  19   1.077  -5.146  -4.207
  115    HE2  HIS  19           HE2      HIS  19   0.242  -6.076  -6.391
  116    H    ARG  20           HN       ARG  20  -1.018  -1.108  -8.219
  117    HA   ARG  20           HA       ARG  20   1.686  -1.809  -8.164
  118    HB2  ARG  20           HB2      ARG  20   0.429  -0.098 -10.301
  119    HB3  ARG  20           HB1      ARG  20   1.765  -1.226 -10.470
  120    HG2  ARG  20           HG2      ARG  20   0.068  -3.030  -9.803
  121    HG3  ARG  20           HG1      ARG  20  -1.153  -1.803 -10.157
  122    HD2  ARG  20           HD2      ARG  20   0.970  -2.799 -12.034
  123    HD3  ARG  20           HD1      ARG  20  -0.745  -3.198 -12.104
  124    HE   ARG  20           HE       ARG  20  -1.022  -0.672 -12.416
  125   HH11  ARG  20          HH11      ARG  20   1.714  -2.513 -13.584
  126   HH12  ARG  20          HH12      ARG  20   2.067  -1.408 -14.872
  127   HH21  ARG  20          HH21      ARG  20  -0.569   0.780 -14.118
  128   HH22  ARG  20          HH22      ARG  20   0.766   0.461 -15.183
  129    H    GLU  21           HN       GLU  21   0.130   1.322  -8.259
  130    HA   GLU  21           HA       GLU  21   2.345   2.977  -8.673
  131    HB2  GLU  21           HB2      GLU  21  -0.034   3.735  -6.992
  132    HB3  GLU  21           HB1      GLU  21   0.906   4.757  -8.062
  133    HG2  GLU  21           HG2      GLU  21  -0.860   2.506  -8.981
  134    HG3  GLU  21           HG1      GLU  21  -1.378   4.190  -8.894
  135    H    LEU  22           HN       LEU  22   0.757   1.979  -5.660
  136    HA   LEU  22           HA       LEU  22   2.408   3.411  -3.914
  137    HB2  LEU  22           HB2      LEU  22   0.749   0.944  -3.508
  138    HB3  LEU  22           HB1      LEU  22   1.752   1.585  -2.222
  139    HG   LEU  22           HG       LEU  22  -0.329   2.496  -1.755
  140   HD11  LEU  22          HD11      LEU  22   0.951   4.576  -3.547
  141   HD12  LEU  22          HD12      LEU  22   1.497   4.192  -1.912
  142   HD13  LEU  22          HD13      LEU  22  -0.112   4.860  -2.171
  143   HD21  LEU  22          HD21      LEU  22  -0.673   3.206  -4.658
  144   HD22  LEU  22          HD22      LEU  22  -1.856   3.371  -3.360
  145   HD23  LEU  22          HD23      LEU  22  -1.348   1.768  -3.891
  146    H    VAL  23           HN       VAL  23   2.841   0.191  -5.308
  147    HA   VAL  23           HA       VAL  23   5.157  -0.273  -3.696
  148    HB   VAL  23           HB       VAL  23   4.805  -2.355  -4.211
  149   HG11  VAL  23          HG11      VAL  23   2.457  -1.663  -4.668
  150   HG12  VAL  23          HG12      VAL  23   2.961  -3.117  -5.533
  151   HG13  VAL  23          HG13      VAL  23   2.875  -1.574  -6.379
  152   HG21  VAL  23          HG21      VAL  23   6.512  -2.118  -5.861
  153   HG22  VAL  23          HG22      VAL  23   5.317  -1.570  -7.053
  154   HG23  VAL  23          HG23      VAL  23   5.269  -3.229  -6.455
  155    H    SER  24           HN       SER  24   4.495   0.823  -6.975
  156    HA   SER  24           HA       SER  24   7.115   1.129  -7.883
  157    HB2  SER  24           HB2      SER  24   5.005   1.591  -9.191
  158    HB3  SER  24           HB1      SER  24   4.850   3.103  -8.294
  159    HG   SER  24           HG       SER  24   6.052   2.917 -10.490
  160    H    ALA  25           HN       ALA  25   5.267   2.843  -5.504
  161    HA   ALA  25           HA       ALA  25   7.248   4.965  -5.181
  162    HB1  ALA  25           HB1      ALA  25   5.841   5.834  -3.463
  163    HB2  ALA  25           HB2      ALA  25   4.935   4.320  -3.365
  164    HB3  ALA  25           HB3      ALA  25   4.783   5.340  -4.807
  165    H    ILE  26           HN       ILE  26   6.339   1.906  -3.589
  166    HA   ILE  26           HA       ILE  26   7.930   2.216  -1.326
  167    HB   ILE  26           HB       ILE  26   6.686  -0.092  -2.682
  168   HG12  ILE  26          HG12      ILE  26   7.130   0.815   0.146
  169   HG13  ILE  26          HG11      ILE  26   5.636   0.885  -0.788
  170   HG21  ILE  26          HG21      ILE  26   9.068  -0.562  -0.898
  171   HG22  ILE  26          HG22      ILE  26   9.006  -0.903  -2.627
  172   HG23  ILE  26          HG23      ILE  26   7.969  -1.797  -1.511
  173   HD11  ILE  26          HD11      ILE  26   5.596  -0.904   0.856
  174   HD12  ILE  26          HD12      ILE  26   7.031  -1.617   0.109
  175   HD13  ILE  26          HD13      ILE  26   5.523  -1.524  -0.801
  176    H    GLN  27           HN       GLN  27   8.691   0.882  -4.498
  177    HA   GLN  27           HA       GLN  27  11.363   0.225  -3.958
  178    HB2  GLN  27           HB2      GLN  27  10.043   0.984  -6.571
  179    HB3  GLN  27           HB1      GLN  27  11.615   0.200  -6.422
  180    HG2  GLN  27           HG2      GLN  27  10.464  -1.679  -5.253
  181    HG3  GLN  27           HG1      GLN  27   8.941  -0.894  -5.621
  182   HE21  GLN  27          HE21      GLN  27  11.722  -2.503  -6.973
  183   HE22  GLN  27          HE22      GLN  27  11.005  -2.883  -8.500
  184    H    SER  28           HN       SER  28   9.798   3.208  -4.701
  185    HA   SER  28           HA       SER  28  12.183   4.704  -5.242
  186    HB2  SER  28           HB2      SER  28   9.314   5.482  -4.686
  187    HB3  SER  28           HB1      SER  28  10.567   6.631  -5.120
  188    HG   SER  28           HG       SER  28   9.364   4.622  -6.671
  189    H    TYR  29           HN       TYR  29   9.863   4.526  -2.543
  190    HA   TYR  29           HA       TYR  29  11.084   6.222  -0.711
  191    HB2  TYR  29           HB2      TYR  29   8.819   5.200  -0.521
  192    HB3  TYR  29           HB1      TYR  29   9.566   3.649  -0.187
  193    HD1  TYR  29           HD1      TYR  29   7.538   4.647   1.568
  194    HD2  TYR  29           HD2      TYR  29  11.708   5.476   1.631
  195    HE1  TYR  29           HE1      TYR  29   7.403   5.076   3.986
  196    HE2  TYR  29           HE2      TYR  29  11.582   5.904   4.046
  197    HH   TYR  29           HH       TYR  29   9.841   6.624   5.698
  198    H    ILE  30           HN       ILE  30  11.371   2.705  -1.009
  199    HA   ILE  30           HA       ILE  30  13.230   2.346   1.041
  200    HB   ILE  30           HB       ILE  30  12.543   0.676  -1.361
  201   HG12  ILE  30          HG12      ILE  30  11.729   0.611   1.549
  202   HG13  ILE  30          HG11      ILE  30  10.727   1.082   0.187
  203   HG21  ILE  30          HG21      ILE  30  13.591  -1.209  -0.118
  204   HG22  ILE  30          HG22      ILE  30  14.286  -0.025   0.990
  205   HG23  ILE  30          HG23      ILE  30  14.734  -0.006  -0.713
  206   HD11  ILE  30          HD11      ILE  30  10.100  -1.089   0.894
  207   HD12  ILE  30          HD12      ILE  30  11.770  -1.660   0.801
  208   HD13  ILE  30          HD13      ILE  30  10.904  -1.218  -0.674
  209    H    GLY  31           HN       GLY  31  13.701   2.890  -2.424
  210    HA2  GLY  31           HA2      GLY  31  16.524   2.438  -2.349
  211    HA3  GLY  31           HA1      GLY  31  15.626   3.200  -3.657
  212    H    ALA  32           HN       ALA  32  14.623   4.915  -1.178
  213    HA   ALA  32           HA       ALA  32  16.727   6.941  -1.469
  214    HB1  ALA  32           HB1      ALA  32  15.068   8.563  -0.948
  215    HB2  ALA  32           HB2      ALA  32  13.937   7.313  -0.428
  216    HB3  ALA  32           HB3      ALA  32  14.360   7.461  -2.136
  217    H    GLN  33           HN       GLN  33  15.393   4.728   0.735
  218    HA   GLN  33           HA       GLN  33  15.392   6.167   3.094
  219    HB2  GLN  33           HB2      GLN  33  15.623   3.270   2.472
  220    HB3  GLN  33           HB1      GLN  33  15.766   3.843   4.129
  221    HG2  GLN  33           HG2      GLN  33  13.480   4.922   2.687
  222    HG3  GLN  33           HG1      GLN  33  13.454   3.181   2.883
  223   HE21  GLN  33          HE21      GLN  33  14.870   5.514   5.107
  224   HE22  GLN  33          HE22      GLN  33  13.787   5.208   6.416
  225    H    ASP  34           HN       ASP  34  16.687   5.955   4.919
  226    HA   ASP  34           HA       ASP  34  19.392   6.427   4.770
  227    HB2  ASP  34           HB2      ASP  34  17.887   6.835   6.694
  228    HB3  ASP  34           HB1      ASP  34  17.854   5.107   6.993
  229    H    ASP  35           HN       ASP  35  17.613   3.492   5.028
  230    HA   ASP  35           HA       ASP  35  19.865   1.982   3.994
  231    HB2  ASP  35           HB2      ASP  35  20.110   1.647   6.402
  232    HB3  ASP  35           HB1      ASP  35  18.431   1.127   6.524
  233    HA   PRO  36           HA       PRO  36  16.195   0.758   1.720
  234    HB2  PRO  36           HB2      PRO  36  17.475  -0.309  -0.343
  235    HB3  PRO  36           HB1      PRO  36  17.482   1.434  -0.087
  236    HG2  PRO  36           HG2      PRO  36  19.556  -0.569   0.761
  237    HG3  PRO  36           HG1      PRO  36  19.795   0.899  -0.205
  238    HD2  PRO  36           HD2      PRO  36  20.242   0.928   2.421
  239    HD3  PRO  36           HD1      PRO  36  19.443   2.303   1.627
  240    H    THR  37           HN       THR  37  18.646  -1.073   3.098
  241    HA   THR  37           HA       THR  37  17.913  -3.608   2.051
  242    HB   THR  37           HB       THR  37  19.753  -4.417   3.116
  243    HG1  THR  37           HG1      THR  37  19.348  -2.612   5.287
  244   HG21  THR  37          HG21      THR  37  21.483  -2.808   3.170
  245   HG22  THR  37          HG22      THR  37  20.366  -1.517   3.640
  246   HG23  THR  37          HG23      THR  37  20.307  -2.192   2.000
  247    H    ASN  38           HN       ASN  38  17.141  -1.737   4.809
  248    HA   ASN  38           HA       ASN  38  14.854  -3.413   5.386
  249    HB2  ASN  38           HB2      ASN  38  16.777  -4.397   6.591
  250    HB3  ASN  38           HB1      ASN  38  16.963  -2.885   7.479
  251   HD21  ASN  38          HD21      ASN  38  15.016  -5.740   7.039
  252   HD22  ASN  38          HD22      ASN  38  14.078  -5.569   8.482
  253    HA   PRO  39           HA       PRO  39  14.276   1.208   6.068
  254    HB2  PRO  39           HB2      PRO  39  11.961   1.222   4.564
  255    HB3  PRO  39           HB1      PRO  39  13.552   1.739   4.010
  256    HG2  PRO  39           HG2      PRO  39  12.134  -0.817   3.538
  257    HG3  PRO  39           HG1      PRO  39  13.234   0.069   2.492
  258    HD2  PRO  39           HD2      PRO  39  13.960  -2.151   3.811
  259    HD3  PRO  39           HD1      PRO  39  15.089  -0.852   3.425
  260    H    SER  40           HN       SER  40  12.174   2.215   6.763
  261    HA   SER  40           HA       SER  40  11.131   0.672   8.955
  262    HB2  SER  40           HB2      SER  40  10.455   3.473   8.035
  263    HB3  SER  40           HB1      SER  40  10.014   2.760   9.585
  264    HG   SER  40           HG       SER  40  12.406   2.440   9.807
  265    H    GLU  41           HN       GLU  41   8.637   1.373   9.340
  266    HA   GLU  41           HA       GLU  41   7.078  -0.095   7.522
  267    HB2  GLU  41           HB2      GLU  41   6.257   0.011   9.716
  268    HB3  GLU  41           HB1      GLU  41   6.500   1.745   9.818
  269    HG2  GLU  41           HG2      GLU  41   4.700   2.094   8.271
  270    HG3  GLU  41           HG1      GLU  41   4.413   0.357   8.175
  271    H    ILE  42           HN       ILE  42   6.000   0.480   5.797
  272    HA   ILE  42           HA       ILE  42   6.353   3.226   4.881
  273    HB   ILE  42           HB       ILE  42   6.161   0.593   3.464
  274   HG12  ILE  42          HG12      ILE  42   8.196   2.786   3.749
  275   HG13  ILE  42          HG11      ILE  42   8.365   1.075   4.111
  276   HG21  ILE  42          HG21      ILE  42   6.152   3.271   2.109
  277   HG22  ILE  42          HG22      ILE  42   4.698   2.318   2.395
  278   HG23  ILE  42          HG23      ILE  42   5.982   1.677   1.376
  279   HD11  ILE  42          HD11      ILE  42   8.288   0.572   1.734
  280   HD12  ILE  42          HD12      ILE  42   9.606   1.676   2.138
  281   HD13  ILE  42          HD13      ILE  42   8.133   2.297   1.390
  282    H    THR  43           HN       THR  43   4.616   4.454   4.456
  283    HA   THR  43           HA       THR  43   2.014   3.137   4.157
  284    HB   THR  43           HB       THR  43   0.932   4.942   5.431
  285    HG1  THR  43           HG1      THR  43   2.251   6.338   6.671
  286   HG21  THR  43          HG21      THR  43   1.603   4.205   7.664
  287   HG22  THR  43          HG22      THR  43   3.079   3.502   6.995
  288   HG23  THR  43          HG23      THR  43   1.505   2.833   6.556
  289    H    LEU  44           HN       LEU  44   0.362   4.764   3.386
  290    HA   LEU  44           HA       LEU  44   1.218   5.686   0.871
  291    HB2  LEU  44           HB2      LEU  44  -1.283   6.402   2.340
  292    HB3  LEU  44           HB1      LEU  44  -1.024   6.468   0.624
  293    HG   LEU  44           HG       LEU  44  -1.327   4.068   2.353
  294   HD11  LEU  44          HD11      LEU  44  -3.162   5.482   1.009
  295   HD12  LEU  44          HD12      LEU  44  -3.284   3.758   1.332
  296   HD13  LEU  44          HD13      LEU  44  -2.687   4.316  -0.225
  297   HD21  LEU  44          HD21      LEU  44  -0.271   4.184  -0.459
  298   HD22  LEU  44          HD22      LEU  44  -0.722   2.710   0.388
  299   HD23  LEU  44          HD23      LEU  44   0.624   3.682   0.970
  300    H    ALA  45           HN       ALA  45   0.534   7.212   3.904
  301    HA   ALA  45           HA       ALA  45   0.733   9.888   3.065
  302    HB1  ALA  45           HB1      ALA  45   0.927  10.363   5.469
  303    HB2  ALA  45           HB2      ALA  45   1.154   8.635   5.777
  304    HB3  ALA  45           HB3      ALA  45  -0.387   9.229   5.112
  305    H    LYS  46           HN       LYS  46   3.074   7.460   3.859
  306    HA   LYS  46           HA       LYS  46   5.316   9.274   3.956
  307    HB2  LYS  46           HB2      LYS  46   5.080   6.296   3.973
  308    HB3  LYS  46           HB1      LYS  46   6.597   7.146   4.090
  309    HG2  LYS  46           HG2      LYS  46   5.910   8.154   6.168
  310    HG3  LYS  46           HG1      LYS  46   4.325   7.384   6.027
  311    HD2  LYS  46           HD2      LYS  46   5.543   5.177   5.953
  312    HD3  LYS  46           HD1      LYS  46   6.995   6.066   6.431
  313    HE2  LYS  46           HE2      LYS  46   4.396   5.985   7.935
  314    HE3  LYS  46           HE1      LYS  46   5.854   5.055   8.336
  315    HZ1  LYS  46           HZ1      LYS  46   5.622   8.020   8.328
  316    HZ2  LYS  46           HZ2      LYS  46   7.026   7.149   8.693
  317    HZ3  LYS  46           HZ3      LYS  46   5.675   7.037   9.702
  318    H    LEU  47           HN       LEU  47   3.852   6.969   1.767
  319    HA   LEU  47           HA       LEU  47   5.943   6.932  -0.133
  320    HB2  LEU  47           HB2      LEU  47   3.068   6.073  -0.155
  321    HB3  LEU  47           HB1      LEU  47   4.072   5.943  -1.588
  322    HG   LEU  47           HG       LEU  47   4.617   4.610   1.063
  323   HD11  LEU  47          HD11      LEU  47   4.059   2.541  -0.117
  324   HD12  LEU  47          HD12      LEU  47   3.618   3.479  -1.546
  325   HD13  LEU  47          HD13      LEU  47   2.689   3.649  -0.056
  326   HD21  LEU  47          HD21      LEU  47   6.026   4.374  -1.591
  327   HD22  LEU  47          HD22      LEU  47   6.365   3.411  -0.155
  328   HD23  LEU  47          HD23      LEU  47   6.664   5.148  -0.143
  329    H    ALA  48           HN       ALA  48   3.622   9.229   0.596
  330    HA   ALA  48           HA       ALA  48   2.614  10.259  -1.681
  331    HB1  ALA  48           HB1      ALA  48   2.277  12.275  -0.571
  332    HB2  ALA  48           HB2      ALA  48   3.748  12.110   0.377
  333    HB3  ALA  48           HB3      ALA  48   2.359  11.079   0.726
  334    HA   PRO  49           HA       PRO  49   6.457  13.056  -2.600
  335    HB2  PRO  49           HB2      PRO  49   8.629  11.711  -1.116
  336    HB3  PRO  49           HB1      PRO  49   8.256  13.425  -1.239
  337    HG2  PRO  49           HG2      PRO  49   7.785  12.148   1.020
  338    HG3  PRO  49           HG1      PRO  49   6.589  13.305   0.394
  339    HD2  PRO  49           HD2      PRO  49   6.635  10.322   0.113
  340    HD3  PRO  49           HD1      PRO  49   5.313  11.354   0.679
  341    H    TYR  50           HN       TYR  50   6.600   9.650  -2.317
  342    HA   TYR  50           HA       TYR  50   8.676   9.366  -4.361
  343    HB2  TYR  50           HB2      TYR  50   7.360   7.244  -2.669
  344    HB3  TYR  50           HB1      TYR  50   8.794   7.052  -3.669
  345    HD1  TYR  50           HD1      TYR  50  10.794   8.664  -3.070
  346    HD2  TYR  50           HD2      TYR  50   7.608   7.674  -0.445
  347    HE1  TYR  50           HE1      TYR  50  12.191   9.315  -1.153
  348    HE2  TYR  50           HE2      TYR  50   8.992   8.326   1.493
  349    HH   TYR  50           HH       TYR  50  11.485   8.503   2.003
  350    H    MET  51           HN       MET  51   5.383   9.605  -4.240
  351    HA   MET  51           HA       MET  51   4.733   7.481  -6.050
  352    HB2  MET  51           HB2      MET  51   3.116   9.902  -5.282
  353    HB3  MET  51           HB1      MET  51   2.522   8.534  -6.212
  354    HG2  MET  51           HG2      MET  51   3.612   8.322  -3.444
  355    HG3  MET  51           HG1      MET  51   1.902   8.537  -3.814
  356    HE1  MET  51           HE1      MET  51   0.874   5.398  -5.549
  357    HE2  MET  51           HE2      MET  51   2.132   6.060  -6.597
  358    HE3  MET  51           HE3      MET  51   0.989   7.150  -5.804
  359    H    SER  52           HN       SER  52   4.815   7.462  -8.076
  360    HA   SER  52           HA       SER  52   5.421   9.876  -9.618
  361    HB2  SER  52           HB2      SER  52   5.633   8.184 -11.520
  362    HB3  SER  52           HB1      SER  52   6.805   8.016 -10.215
  363    HG   SER  52           HG       SER  52   4.966   6.249 -11.089
  364    H    LYS  53           HN       LYS  53   2.996   7.695  -8.812
  365    HA   LYS  53           HA       LYS  53   1.069   8.236 -10.784
  366    HB2  LYS  53           HB2      LYS  53   1.036   6.206  -9.573
  367    HB3  LYS  53           HB1      LYS  53   1.157   7.031  -8.035
  368    HG2  LYS  53           HG2      LYS  53  -1.225   7.543  -9.669
  369    HG3  LYS  53           HG1      LYS  53  -1.067   5.968  -8.917
  370    HD2  LYS  53           HD2      LYS  53  -0.643   7.153  -6.756
  371    HD3  LYS  53           HD1      LYS  53  -1.105   8.656  -7.577
  372    HE2  LYS  53           HE2      LYS  53  -3.239   7.421  -8.214
  373    HE3  LYS  53           HE1      LYS  53  -2.769   6.224  -7.003
  374    HZ1  LYS  53           HZ1      LYS  53  -4.309   7.951  -6.191
  375    HZ2  LYS  53           HZ2      LYS  53  -3.100   9.118  -6.444
  376    HZ3  LYS  53           HZ3      LYS  53  -2.858   7.877  -5.319
  377    H    ASN  54           HN       ASN  54  -0.966   9.318 -10.336
  378    HA   ASN  54           HA       ASN  54  -1.005  11.916  -9.618
  379    HB2  ASN  54           HB2      ASN  54  -2.832  10.620 -10.602
  380    HB3  ASN  54           HB1      ASN  54  -3.198   9.971  -9.018
  381   HD21  ASN  54          HD21      ASN  54  -5.254  10.831  -8.980
  382   HD22  ASN  54          HD22      ASN  54  -5.548  12.525  -8.791
  383    H    ALA  55           HN       ALA  55   0.146  12.405  -7.934
  384    HA   ALA  55           HA       ALA  55  -1.125  12.611  -5.409
  385    HB1  ALA  55           HB1      ALA  55   1.277  10.815  -5.619
  386    HB2  ALA  55           HB2      ALA  55  -0.381  10.291  -5.315
  387    HB3  ALA  55           HB3      ALA  55   0.462  11.294  -4.126
  388    H    LYS  56           HN       LYS  56   0.102  13.916  -3.936
  389    HA   LYS  56           HA       LYS  56   2.454  15.217  -5.063
  390    HB2  LYS  56           HB2      LYS  56   0.033  16.617  -3.930
  391    HB3  LYS  56           HB1      LYS  56   1.569  17.414  -4.239
  392    HG2  LYS  56           HG2      LYS  56  -0.051  16.010  -6.342
  393    HG3  LYS  56           HG1      LYS  56  -0.124  17.744  -6.016
  394    HD2  LYS  56           HD2      LYS  56   2.000  18.121  -6.822
  395    HD3  LYS  56           HD1      LYS  56   2.523  16.464  -6.521
  396    HE2  LYS  56           HE2      LYS  56   1.195  15.667  -8.357
  397    HE3  LYS  56           HE1      LYS  56   0.536  17.280  -8.627
  398    HZ1  LYS  56           HZ1      LYS  56   3.401  16.550  -8.884
  399    HZ2  LYS  56           HZ2      LYS  56   2.720  18.058  -9.226
  400    HZ3  LYS  56           HZ3      LYS  56   2.328  16.718 -10.179
  401    H    ASN  57           HN       ASN  57   0.430  15.675  -2.178
  402    HA   ASN  57           HA       ASN  57   2.762  14.977  -0.528
  403    HB2  ASN  57           HB2      ASN  57   0.518  16.898   0.136
  404    HB3  ASN  57           HB1      ASN  57   1.846  16.474   1.201
  405   HD21  ASN  57          HD21      ASN  57   3.902  16.490  -0.748
  406   HD22  ASN  57          HD22      ASN  57   4.157  18.132  -1.227
  407    H    GLU  58           HN       GLU  58   1.533  14.674   1.896
  408    HA   GLU  58           HA       GLU  58   0.522  12.077   1.625
  409    HB2  GLU  58           HB2      GLU  58   0.932  11.950   3.801
  410    HB3  GLU  58           HB1      GLU  58   1.568  13.576   3.654
  411    HG2  GLU  58           HG2      GLU  58  -0.631  14.463   4.189
  412    HG3  GLU  58           HG1      GLU  58  -1.213  12.823   4.433
  413    H    ASP  59           HN       ASP  59  -1.067  15.145   2.075
  414    HA   ASP  59           HA       ASP  59  -3.681  14.102   2.423
  415    HB2  ASP  59           HB2      ASP  59  -3.281  16.352   3.108
  416    HB3  ASP  59           HB1      ASP  59  -2.677  16.788   1.517
  417    H    GLY  60           HN       GLY  60  -1.729  14.940  -0.343
  418    HA2  GLY  60           HA2      GLY  60  -3.828  14.786  -2.263
  419    HA3  GLY  60           HA1      GLY  60  -2.108  14.808  -2.609
  420    H    ILE  61           HN       ILE  61  -1.182  12.574  -1.398
  421    HA   ILE  61           HA       ILE  61  -1.710  10.709  -3.386
  422    HB   ILE  61           HB       ILE  61   0.412  10.692  -2.322
  423   HG12  ILE  61          HG12      ILE  61   0.720   8.408  -1.885
  424   HG13  ILE  61          HG11      ILE  61  -0.932   8.201  -1.302
  425   HG21  ILE  61          HG21      ILE  61   0.737  10.073   0.030
  426   HG22  ILE  61          HG22      ILE  61  -1.008  10.088   0.257
  427   HG23  ILE  61          HG23      ILE  61  -0.164  11.576  -0.160
  428   HD11  ILE  61          HD11      ILE  61  -1.799   8.454  -3.537
  429   HD12  ILE  61          HD12      ILE  61  -0.510   7.241  -3.569
  430   HD13  ILE  61          HD13      ILE  61  -0.194   8.871  -4.154
  431    H    VAL  62           HN       VAL  62  -2.586  10.656  -0.009
  432    HA   VAL  62           HA       VAL  62  -3.690   8.066  -0.119
  433    HB   VAL  62           HB       VAL  62  -3.986  10.236   1.948
  434   HG11  VAL  62          HG11      VAL  62  -4.439   7.281   2.188
  435   HG12  VAL  62          HG12      VAL  62  -5.705   8.519   2.162
  436   HG13  VAL  62          HG13      VAL  62  -4.537   8.465   3.491
  437   HG21  VAL  62          HG21      VAL  62  -1.820   8.573   1.135
  438   HG22  VAL  62          HG22      VAL  62  -2.322   8.160   2.784
  439   HG23  VAL  62          HG23      VAL  62  -1.864   9.824   2.388
  440    H    ASN  63           HN       ASN  63  -5.110  11.280  -0.167
  441    HA   ASN  63           HA       ASN  63  -7.807  10.456  -0.342
  442    HB2  ASN  63           HB2      ASN  63  -7.101  12.784   0.163
  443    HB3  ASN  63           HB1      ASN  63  -6.548  12.958  -1.497
  444   HD21  ASN  63          HD21      ASN  63  -9.281  12.781   0.608
  445   HD22  ASN  63          HD22      ASN  63 -10.467  13.277  -0.548
  446    H    SER  64           HN       SER  64  -5.261  10.815  -2.705
  447    HA   SER  64           HA       SER  64  -6.926  10.450  -5.017
  448    HB2  SER  64           HB2      SER  64  -3.977  10.590  -4.496
  449    HB3  SER  64           HB1      SER  64  -4.556  10.065  -6.071
  450    HG   SER  64           HG       SER  64  -5.328  12.489  -4.789
  451    H    LEU  65           HN       LEU  65  -5.705   8.380  -2.677
  452    HA   LEU  65           HA       LEU  65  -5.651   6.060  -4.454
  453    HB2  LEU  65           HB2      LEU  65  -4.812   6.443  -1.599
  454    HB3  LEU  65           HB1      LEU  65  -4.830   4.883  -2.405
  455    HG   LEU  65           HG       LEU  65  -3.217   7.252  -3.303
  456   HD11  LEU  65          HD11      LEU  65  -2.222   4.769  -1.956
  457   HD12  LEU  65          HD12      LEU  65  -2.630   6.232  -1.061
  458   HD13  LEU  65          HD13      LEU  65  -1.354   6.268  -2.272
  459   HD21  LEU  65          HD21      LEU  65  -3.707   5.785  -5.120
  460   HD22  LEU  65          HD22      LEU  65  -3.317   4.371  -4.139
  461   HD23  LEU  65          HD23      LEU  65  -2.041   5.495  -4.615
  462    H    ALA  66           HN       ALA  66  -6.723   4.091  -3.799
  463    HA   ALA  66           HA       ALA  66  -9.385   4.207  -3.183
  464    HB1  ALA  66           HB1      ALA  66  -8.237   2.178  -4.011
  465    HB2  ALA  66           HB2      ALA  66  -9.290   1.863  -2.622
  466    HB3  ALA  66           HB3      ALA  66  -7.540   1.959  -2.400
  467    H    LYS  67           HN       LYS  67 -10.621   4.171  -1.414
  468    HA   LYS  67           HA       LYS  67  -9.250   4.508   1.154
  469    HB2  LYS  67           HB2      LYS  67 -11.930   5.656   0.391
  470    HB3  LYS  67           HB1      LYS  67 -11.007   5.996   1.841
  471    HG2  LYS  67           HG2      LYS  67 -10.395   6.846  -0.969
  472    HG3  LYS  67           HG1      LYS  67 -10.810   7.865   0.405
  473    HD2  LYS  67           HD2      LYS  67  -8.348   6.154   0.386
  474    HD3  LYS  67           HD1      LYS  67  -8.359   7.766  -0.324
  475    HE2  LYS  67           HE2      LYS  67  -8.890   7.024   2.546
  476    HE3  LYS  67           HE1      LYS  67  -7.497   7.903   1.912
  477    HZ1  LYS  67           HZ1      LYS  67  -9.011   9.436   2.910
  478    HZ2  LYS  67           HZ2      LYS  67 -10.311   8.846   2.009
  479    HZ3  LYS  67           HZ3      LYS  67  -9.061   9.677   1.237
  480    H    ASP  68           HN       ASP  68  -9.885   3.255   2.817
  481    HA   ASP  68           HA       ASP  68 -11.787   1.141   2.205
  482    HB2  ASP  68           HB2      ASP  68 -10.924  -0.045   4.040
  483    HB3  ASP  68           HB1      ASP  68  -9.518   0.814   3.420
  484    H    LYS  69           HN       LYS  69 -13.327   0.586   4.245
  485    HA   LYS  69           HA       LYS  69 -14.912   3.001   4.303
  486    HB2  LYS  69           HB2      LYS  69 -15.925   0.874   3.633
  487    HB3  LYS  69           HB1      LYS  69 -15.631   0.253   5.244
  488    HG2  LYS  69           HG2      LYS  69 -17.957   0.982   4.878
  489    HG3  LYS  69           HG1      LYS  69 -17.165   1.825   6.209
  490    HD2  LYS  69           HD2      LYS  69 -18.398   3.435   4.952
  491    HD3  LYS  69           HD1      LYS  69 -16.689   3.694   4.602
  492    HE2  LYS  69           HE2      LYS  69 -17.746   3.811   2.514
  493    HE3  LYS  69           HE1      LYS  69 -17.053   2.191   2.584
  494    HZ1  LYS  69           HZ1      LYS  69 -19.170   1.271   3.086
  495    HZ2  LYS  69           HZ2      LYS  69 -19.355   2.265   1.730
  496    HZ3  LYS  69           HZ3      LYS  69 -19.874   2.803   3.244
  497    H    SER  70           HN       SER  70 -13.639   0.750   6.771
  498    HA   SER  70           HA       SER  70 -14.713   2.593   8.786
  499    HB2  SER  70           HB2      SER  70 -14.394   0.588  10.337
  500    HB3  SER  70           HB1      SER  70 -15.659   0.470   9.113
  501    HG   SER  70           HG       SER  70 -14.652  -1.341   8.692
  502    H    GLY  71           HN       GLY  71 -11.731   1.119   7.713
  503    HA2  GLY  71           HA2      GLY  71  -9.562   1.569   8.357
  504    HA3  GLY  71           HA1      GLY  71 -10.182   2.754   9.499
  505    H    ASN  72           HN       ASN  72 -11.628  -0.341   9.709
  506    HA   ASN  72           HA       ASN  72 -10.768  -0.558  12.424
  507    HB2  ASN  72           HB2      ASN  72 -12.463  -2.301  10.657
  508    HB3  ASN  72           HB1      ASN  72 -11.995  -2.824  12.268
  509   HD21  ASN  72          HD21      ASN  72 -12.104  -0.099  13.359
  510   HD22  ASN  72          HD22      ASN  72 -13.787   0.269  13.511
  511    H    SER  73           HN       SER  73  -9.264  -1.413   9.601
  512    HA   SER  73           HA       SER  73  -7.992  -3.805  10.639
  513    HB2  SER  73           HB2      SER  73  -7.452  -2.309   8.067
  514    HB3  SER  73           HB1      SER  73  -6.904  -3.936   8.476
  515    HG   SER  73           HG       SER  73  -9.313  -3.094   7.502
  516    H    SER  74           HN       SER  74  -7.574  -0.552  11.042
  517    HA   SER  74           HA       SER  74  -5.881   0.842  11.624
  518    HB2  SER  74           HB2      SER  74  -5.594  -1.002  13.355
  519    HB3  SER  74           HB1      SER  74  -4.302  -1.635  12.341
  520    HG   SER  74           HG       SER  74  -4.052   0.162  14.173
  521    H    THR  75           HN       THR  75  -5.932   0.971   9.191
  522    HA   THR  75           HA       THR  75  -3.963  -0.474   7.687
  523    HB   THR  75           HB       THR  75  -6.232   0.145   6.827
  524    HG1  THR  75           HG1      THR  75  -5.239   1.119   4.770
  525   HG21  THR  75          HG21      THR  75  -5.073   2.899   6.465
  526   HG22  THR  75          HG22      THR  75  -6.147   2.465   7.802
  527   HG23  THR  75          HG23      THR  75  -6.723   2.360   6.137
  528    H    SER  76           HN       SER  76  -3.856   2.296   9.557
  529    HA   SER  76           HA       SER  76  -2.274   3.861   9.953
  530    HB2  SER  76           HB2      SER  76  -0.604   2.422   7.883
  531    HB3  SER  76           HB1      SER  76  -0.024   3.602   9.059
  532    HG   SER  76           HG       SER  76  -1.388   1.284   9.903
  533    H    ALA  77           HN       ALA  77  -2.681   3.171   6.491
  534    HA   ALA  77           HA       ALA  77  -2.159   5.846   5.633
  535    HB1  ALA  77           HB1      ALA  77  -3.846   3.759   4.263
  536    HB2  ALA  77           HB2      ALA  77  -2.089   3.884   4.112
  537    HB3  ALA  77           HB3      ALA  77  -3.124   5.202   3.528
  538    HA   PRO  78           HA       PRO  78  -5.693   7.714   7.491
  539    HB2  PRO  78           HB2      PRO  78  -5.159   9.569   5.216
  540    HB3  PRO  78           HB1      PRO  78  -5.494   9.961   6.902
  541    HG2  PRO  78           HG2      PRO  78  -3.027  10.081   6.047
  542    HG3  PRO  78           HG1      PRO  78  -3.360   9.237   7.567
  543    HD2  PRO  78           HD2      PRO  78  -2.828   8.088   4.868
  544    HD3  PRO  78           HD1      PRO  78  -2.224   7.564   6.452
  545    H    GLY  79           HN       GLY  79  -7.436   6.508   7.106
  546    HA2  GLY  79           HA2      GLY  79  -9.343   5.694   6.159
  547    HA3  GLY  79           HA1      GLY  79  -9.363   7.173   5.223
  548    H    SER  80           HN       SER  80  -6.605   5.122   4.716
  549    HA   SER  80           HA       SER  80  -7.681   4.625   2.010
  550    HB2  SER  80           HB2      SER  80  -5.237   5.719   2.961
  551    HB3  SER  80           HB1      SER  80  -4.899   4.242   2.071
  552    HG   SER  80           HG       SER  80  -6.593   5.364   0.553
  553    H    ALA  81           HN       ALA  81  -7.310   2.824   0.918
  554    HA   ALA  81           HA       ALA  81  -7.261   0.413   2.471
  555    HB1  ALA  81           HB1      ALA  81  -7.909  -0.660   0.398
  556    HB2  ALA  81           HB2      ALA  81  -7.568   0.829  -0.490
  557    HB3  ALA  81           HB3      ALA  81  -8.888   0.787   0.683
  558    H    HIS  82           HN       HIS  82  -4.679   1.682   2.463
  559    HA   HIS  82           HA       HIS  82  -3.277  -0.633   1.401
  560    HB2  HIS  82           HB2      HIS  82  -2.420   2.210   0.954
  561    HB3  HIS  82           HB1      HIS  82  -1.370   0.848   0.737
  562    HD1  HIS  82           HD1      HIS  82  -1.979  -0.767  -1.301
  563    HD2  HIS  82           HD2      HIS  82  -4.136   2.781  -1.114
  564    HE1  HIS  82           HE1      HIS  82  -3.064  -0.512  -3.552
  565    HE2  HIS  82           HE2      HIS  82  -4.488   1.551  -3.358
  566    H    GLN  83           HN       GLN  83  -2.089  -1.576   2.868
  567    HA   GLN  83           HA       GLN  83  -0.657  -0.022   4.863
  568    HB2  GLN  83           HB2      GLN  83  -2.531  -0.512   6.203
  569    HB3  GLN  83           HB1      GLN  83  -2.752  -2.085   5.459
  570    HG2  GLN  83           HG2      GLN  83  -1.992  -2.563   7.602
  571    HG3  GLN  83           HG1      GLN  83  -0.578  -2.766   6.578
  572   HE21  GLN  83          HE21      GLN  83  -0.198   0.180   6.387
  573   HE22  GLN  83          HE22      GLN  83   0.471   0.643   7.905
  574    H    ILE  84           HN       ILE  84   1.357  -0.708   4.786
  575    HA   ILE  84           HA       ILE  84   1.964  -3.126   3.375
  576    HB   ILE  84           HB       ILE  84   3.417  -0.696   4.241
  577   HG12  ILE  84          HG12      ILE  84   4.058  -1.664   1.667
  578   HG13  ILE  84          HG11      ILE  84   2.329  -1.878   1.890
  579   HG21  ILE  84          HG21      ILE  84   4.941  -2.418   4.993
  580   HG22  ILE  84          HG22      ILE  84   5.571  -1.651   3.534
  581   HG23  ILE  84          HG23      ILE  84   4.815  -3.243   3.439
  582   HD11  ILE  84          HD11      ILE  84   2.675   0.240   0.891
  583   HD12  ILE  84          HD12      ILE  84   3.918   0.661   2.066
  584   HD13  ILE  84          HD13      ILE  84   2.233   0.528   2.574
  585    H    ASP  85           HN       ASP  85   2.963  -4.907   4.130
  586    HA   ASP  85           HA       ASP  85   3.047  -5.333   7.008
  587    HB2  ASP  85           HB2      ASP  85   2.144  -7.114   5.507
  588    HB3  ASP  85           HB1      ASP  85   3.723  -7.227   4.744
  589    H    THR  86           HN       THR  86   4.832  -4.919   8.124
  590    HA   THR  86           HA       THR  86   7.290  -4.452   6.681
  591    HB   THR  86           HB       THR  86   8.087  -3.699   8.948
  592    HG1  THR  86           HG1      THR  86   6.722  -3.811  10.614
  593   HG21  THR  86          HG21      THR  86   6.761  -1.647   8.843
  594   HG22  THR  86          HG22      THR  86   5.576  -2.466   7.820
  595   HG23  THR  86          HG23      THR  86   7.215  -2.190   7.227
  596    H    THR  87           HN       THR  87   5.895  -6.885   8.693
  597    HA   THR  87           HA       THR  87   8.116  -8.160   9.736
  598    HB   THR  87           HB       THR  87   5.612  -9.476   8.663
  599    HG1  THR  87           HG1      THR  87   6.226  -8.173  11.108
  600   HG21  THR  87          HG21      THR  87   6.094 -11.216  10.317
  601   HG22  THR  87          HG22      THR  87   7.586 -10.384  10.757
  602   HG23  THR  87          HG23      THR  87   7.402 -11.066   9.142
  603    H    ASN  88           HN       ASN  88   6.459  -8.913   6.655
  604    HA   ASN  88           HA       ASN  88   8.892 -10.312   5.777
  605    HB2  ASN  88           HB2      ASN  88   6.035 -10.365   4.852
  606    HB3  ASN  88           HB1      ASN  88   7.325 -10.970   3.819
  607   HD21  ASN  88          HD21      ASN  88   7.546 -11.271   7.271
  608   HD22  ASN  88          HD22      ASN  88   7.278 -12.977   7.343
  609    H    HIS  89           HN       HIS  89   7.288  -7.402   5.497
  610    HA   HIS  89           HA       HIS  89   7.758  -5.473   4.436
  611    HB2  HIS  89           HB2      HIS  89  10.140  -7.066   3.619
  612    HB3  HIS  89           HB1      HIS  89   9.762  -5.605   2.718
  613    HD1  HIS  89           HD1      HIS  89  11.843  -6.586   5.342
  614    HD2  HIS  89           HD2      HIS  89   9.247  -3.385   4.813
  615    HE1  HIS  89           HE1      HIS  89  12.627  -4.811   6.936
  616    HE2  HIS  89           HE2      HIS  89  10.921  -2.969   6.742
  617    H    LYS  90           HN       LYS  90   5.719  -6.627   3.636
  618    HA   LYS  90           HA       LYS  90   5.763  -6.880   0.709
  619    HB2  LYS  90           HB2      LYS  90   4.183  -8.065   2.914
  620    HB3  LYS  90           HB1      LYS  90   3.343  -7.809   1.407
  621    HG2  LYS  90           HG2      LYS  90   5.018  -9.200   0.264
  622    HG3  LYS  90           HG1      LYS  90   5.853  -9.439   1.801
  623    HD2  LYS  90           HD2      LYS  90   3.049 -10.314   1.111
  624    HD3  LYS  90           HD1      LYS  90   4.456 -11.355   1.339
  625    HE2  LYS  90           HE2      LYS  90   4.610 -10.621   3.669
  626    HE3  LYS  90           HE1      LYS  90   3.196  -9.600   3.442
  627    HZ1  LYS  90           HZ1      LYS  90   3.258 -12.562   3.217
  628    HZ2  LYS  90           HZ2      LYS  90   1.897 -11.596   2.958
  629    HZ3  LYS  90           HZ3      LYS  90   2.596 -11.677   4.498
  630    H    LEU  91           HN       LEU  91   4.348  -5.677  -0.488
  631    HA   LEU  91           HA       LEU  91   3.115  -3.386   0.834
  632    HB2  LEU  91           HB2      LEU  91   4.450  -3.006  -1.182
  633    HB3  LEU  91           HB1      LEU  91   3.437  -4.077  -2.085
  634    HG   LEU  91           HG       LEU  91   2.347  -2.287  -2.799
  635   HD11  LEU  91          HD11      LEU  91   0.614  -2.783  -1.233
  636   HD12  LEU  91          HD12      LEU  91   0.814  -1.030  -1.292
  637   HD13  LEU  91          HD13      LEU  91   1.475  -1.952   0.064
  638   HD21  LEU  91          HD21      LEU  91   2.806  -0.047  -2.061
  639   HD22  LEU  91          HD22      LEU  91   4.291  -0.975  -2.251
  640   HD23  LEU  91          HD23      LEU  91   3.643  -0.672  -0.642
  641    H    ILE  92           HN       ILE  92   1.380  -4.065   1.811
  642    HA   ILE  92           HA       ILE  92  -0.581  -5.720   0.453
  643    HB   ILE  92           HB       ILE  92  -0.084  -4.876   3.283
  644   HG12  ILE  92          HG12      ILE  92  -0.490  -7.417   3.569
  645   HG13  ILE  92          HG11      ILE  92  -0.332  -7.482   1.819
  646   HG21  ILE  92          HG21      ILE  92  -2.464  -4.490   2.943
  647   HG22  ILE  92          HG22      ILE  92  -2.198  -5.876   4.000
  648   HG23  ILE  92          HG23      ILE  92  -2.657  -6.125   2.317
  649   HD11  ILE  92          HD11      ILE  92   1.747  -8.003   2.946
  650   HD12  ILE  92          HD12      ILE  92   1.727  -6.415   3.709
  651   HD13  ILE  92          HD13      ILE  92   1.881  -6.548   1.959
  652    H    SER  93           HN       SER  93  -2.574  -4.959  -0.049
  653    HA   SER  93           HA       SER  93  -3.092  -2.138   0.544
  654    HB2  SER  93           HB2      SER  93  -4.362  -3.745  -1.661
  655    HB3  SER  93           HB1      SER  93  -4.331  -1.993  -1.475
  656    HG   SER  93           HG       SER  93  -2.098  -3.682  -1.995
  657    H    THR  94           HN       THR  94  -4.474  -2.024   2.252
  658    HA   THR  94           HA       THR  94  -6.068  -4.401   2.826
  659    HB   THR  94           HB       THR  94  -5.241  -2.112   4.617
  660    HG1  THR  94           HG1      THR  94  -3.979  -3.797   5.606
  661   HG21  THR  94          HG21      THR  94  -6.726  -4.648   5.315
  662   HG22  THR  94          HG22      THR  94  -7.457  -3.048   5.206
  663   HG23  THR  94          HG23      THR  94  -6.232  -3.378   6.436
  664    H    PHE  95           HN       PHE  95  -8.067  -4.303   2.142
  665    HA   PHE  95           HA       PHE  95  -9.473  -1.727   2.178
  666    HB2  PHE  95           HB2      PHE  95  -9.392  -3.264   0.120
  667    HB3  PHE  95           HB1      PHE  95 -10.520  -4.274   1.021
  668    HD1  PHE  95           HD1      PHE  95 -12.776  -3.662   1.347
  669    HD2  PHE  95           HD2      PHE  95 -10.078  -0.970  -0.547
  670    HE1  PHE  95           HE1      PHE  95 -14.668  -2.240   0.682
  671    HE2  PHE  95           HE2      PHE  95 -11.966   0.451  -1.220
  672    HZ   PHE  95           HZ       PHE  95 -14.262  -0.182  -0.603
  673    H    THR  96           HN       THR  96 -10.289  -1.547   4.263
  674    HA   THR  96           HA       THR  96 -11.581  -3.819   5.447
  675    HB   THR  96           HB       THR  96 -12.073  -1.092   6.512
  676    HG1  THR  96           HG1      THR  96  -9.985  -0.684   6.495
  677   HG21  THR  96          HG21      THR  96 -12.947  -3.037   7.637
  678   HG22  THR  96          HG22      THR  96 -11.667  -2.319   8.617
  679   HG23  THR  96          HG23      THR  96 -11.344  -3.773   7.664
  680    HA   PRO  97           HA       PRO  97 -15.101  -2.893   2.790
  681    HB2  PRO  97           HB2      PRO  97 -16.560  -5.065   3.579
  682    HB3  PRO  97           HB1      PRO  97 -15.319  -5.114   2.326
  683    HG2  PRO  97           HG2      PRO  97 -15.191  -5.937   5.186
  684    HG3  PRO  97           HG1      PRO  97 -14.460  -6.693   3.761
  685    HD2  PRO  97           HD2      PRO  97 -13.066  -5.165   5.486
  686    HD3  PRO  97           HD1      PRO  97 -12.674  -5.249   3.764
  687    H    SER  98           HN       SER  98 -17.363  -2.538   3.029
  688    HA   SER  98           HA       SER  98 -18.065  -1.195   5.431
  689    HB2  SER  98           HB2      SER  98 -19.926  -2.007   3.194
  690    HB3  SER  98           HB1      SER  98 -20.103  -0.650   4.306
  691    HG   SER  98           HG       SER  98 -18.462  -0.926   2.058
  692    H    ASN  99           HN       ASN  99 -18.167  -4.422   4.466
  693    HA   ASN  99           HA       ASN  99 -20.467  -5.243   5.980
  694    HB2  ASN  99           HB2      ASN  99 -19.162  -6.398   3.941
  695    HB3  ASN  99           HB1      ASN  99 -18.331  -7.182   5.275
  696   HD21  ASN  99          HD21      ASN  99 -19.499  -8.537   6.683
  697   HD22  ASN  99          HD22      ASN  99 -21.033  -9.186   6.229
  698    H    GLY 100           HN       GLY 100 -17.211  -4.517   6.672
  699    HA2  GLY 100           HA2      GLY 100 -16.109  -4.498   8.709
  700    HA3  GLY 100           HA1      GLY 100 -17.505  -5.284   9.434
  701    H    GLY 101           HN       GLY 101 -16.652  -6.968   6.723
  702    HA2  GLY 101           HA2      GLY 101 -15.614  -9.164   8.269
  703    HA3  GLY 101           HA1      GLY 101 -15.948  -9.165   6.544
  704    H    GLN 102           HN       GLN 102 -13.901 -10.400   6.537
  705    HA   GLN 102           HA       GLN 102 -11.425  -9.320   7.216
  706    HB2  GLN 102           HB2      GLN 102 -10.439 -10.994   5.817
  707    HB3  GLN 102           HB1      GLN 102 -11.863 -11.701   6.565
  708    HG2  GLN 102           HG2      GLN 102 -13.125 -11.340   4.519
  709    HG3  GLN 102           HG1      GLN 102 -11.708 -10.608   3.774
  710   HE21  GLN 102          HE21      GLN 102  -9.968 -11.917   3.190
  711   HE22  GLN 102          HE22      GLN 102 -10.120 -13.632   3.049
  712    H    ALA 103           HN       ALA 103 -10.038  -7.958   6.252
  713    HA   ALA 103           HA       ALA 103 -11.036  -6.247   4.168
  714    HB1  ALA 103           HB1      ALA 103  -8.298  -6.328   5.437
  715    HB2  ALA 103           HB2      ALA 103  -9.659  -5.333   5.967
  716    HB3  ALA 103           HB3      ALA 103  -8.928  -5.059   4.374
  717    H    THR 104           HN       THR 104 -10.241  -5.900   2.258
  718    HA   THR 104           HA       THR 104  -9.349  -8.216   0.812
  719    HB   THR 104           HB       THR 104 -10.781  -5.791   0.274
  720    HG1  THR 104           HG1      THR 104 -10.663  -8.392  -0.569
  721   HG21  THR 104          HG21      THR 104  -8.286  -5.735  -0.890
  722   HG22  THR 104          HG22      THR 104  -9.693  -4.813  -1.410
  723   HG23  THR 104          HG23      THR 104  -9.316  -6.365  -2.169
  724    H    VAL 105           HN       VAL 105  -7.403  -8.336  -0.390
  725    HA   VAL 105           HA       VAL 105  -5.461  -6.232   0.229
  726    HB   VAL 105           HB       VAL 105  -5.032  -9.188   0.598
  727   HG11  VAL 105          HG11      VAL 105  -2.754  -8.469   1.403
  728   HG12  VAL 105          HG12      VAL 105  -3.080  -6.905   0.654
  729   HG13  VAL 105          HG13      VAL 105  -3.023  -8.360  -0.336
  730   HG21  VAL 105          HG21      VAL 105  -4.672  -7.002   2.626
  731   HG22  VAL 105          HG22      VAL 105  -4.817  -8.739   2.901
  732   HG23  VAL 105          HG23      VAL 105  -6.234  -7.802   2.388
  733    H    LEU 106           HN       LEU 106  -4.252  -5.607  -1.380
  734    HA   LEU 106           HA       LEU 106  -3.646  -7.461  -3.581
  735    HB2  LEU 106           HB2      LEU 106  -3.986  -4.491  -3.526
  736    HB3  LEU 106           HB1      LEU 106  -2.861  -5.191  -4.670
  737    HG   LEU 106           HG       LEU 106  -4.936  -4.787  -5.775
  738   HD11  LEU 106          HD11      LEU 106  -5.481  -7.027  -6.579
  739   HD12  LEU 106          HD12      LEU 106  -4.640  -7.737  -5.202
  740   HD13  LEU 106          HD13      LEU 106  -3.739  -6.816  -6.407
  741   HD21  LEU 106          HD21      LEU 106  -6.442  -4.740  -3.861
  742   HD22  LEU 106          HD22      LEU 106  -6.219  -6.471  -3.606
  743   HD23  LEU 106          HD23      LEU 106  -7.039  -5.888  -5.059
  744    H    THR 107           HN       THR 107  -1.656  -8.311  -3.332
  745    HA   THR 107           HA       THR 107   0.197  -6.845  -1.573
  746    HB   THR 107           HB       THR 107   0.315  -9.790  -2.169
  747    HG1  THR 107           HG1      THR 107  -1.684  -9.317  -1.178
  748   HG21  THR 107          HG21      THR 107   1.599  -9.884  -0.094
  749   HG22  THR 107          HG22      THR 107   1.423  -8.141   0.111
  750   HG23  THR 107          HG23      THR 107   2.357  -8.780  -1.243
  751    H    TYR 108           HN       TYR 108   2.267  -6.576  -2.034
  752    HA   TYR 108           HA       TYR 108   3.446  -7.781  -4.430
  753    HB2  TYR 108           HB2      TYR 108   3.220  -5.643  -5.297
  754    HB3  TYR 108           HB1      TYR 108   3.264  -4.887  -3.719
  755    HD1  TYR 108           HD1      TYR 108   5.259  -4.025  -2.836
  756    HD2  TYR 108           HD2      TYR 108   5.393  -6.430  -6.341
  757    HE1  TYR 108           HE1      TYR 108   7.589  -3.361  -3.181
  758    HE2  TYR 108           HE2      TYR 108   7.742  -5.790  -6.693
  759    HH   TYR 108           HH       TYR 108   9.606  -4.223  -4.322
  760    H    ASP 109           HN       ASP 109   5.654  -8.345  -4.113
  761    HA   ASP 109           HA       ASP 109   6.467  -8.163  -1.291
  762    HB2  ASP 109           HB2      ASP 109   6.004 -10.442  -2.545
  763    HB3  ASP 109           HB1      ASP 109   7.641 -10.191  -3.141
  764    H    TRP 110           HN       TRP 110   8.081  -6.803  -0.918
  765    HA   TRP 110           HA       TRP 110   9.788  -5.913  -3.066
  766    HB2  TRP 110           HB2      TRP 110   9.307  -4.147  -1.654
  767    HB3  TRP 110           HB1      TRP 110   9.400  -5.124  -0.202
  768    HD1  TRP 110           HD1      TRP 110  11.609  -3.233  -2.678
  769    HE1  TRP 110           HE1      TRP 110  13.895  -2.777  -1.576
  770    HE3  TRP 110           HE3      TRP 110  11.031  -6.010   1.549
  771    HZ2  TRP 110           HZ2      TRP 110  15.262  -3.513   0.784
  772    HZ3  TRP 110           HZ3      TRP 110  12.860  -6.085   3.189
  773    HH2  TRP 110           HH2      TRP 110  14.942  -4.863   2.821
  774    H    SER 111           HN       SER 111  10.091  -7.862  -0.157
  775    HA   SER 111           HA       SER 111  12.922  -8.289  -0.618
  776    HB2  SER 111           HB2      SER 111  11.989  -7.952   1.680
  777    HB3  SER 111           HB1      SER 111  11.155  -9.489   1.515
  778    HG   SER 111           HG       SER 111  13.303 -10.412   1.142
  779    H    ALA 112           HN       ALA 112   9.901  -9.989  -0.995
  780    HA   ALA 112           HA       ALA 112   9.369 -11.984  -1.938
  781    HB1  ALA 112           HB1      ALA 112  11.793 -11.226  -3.519
  782    HB2  ALA 112           HB2      ALA 112  10.117 -10.789  -3.853
  783    HB3  ALA 112           HB3      ALA 112  10.634 -12.473  -3.988
  784    H    ASN 113           HN       ASN 113  10.271 -12.640   0.286
  785    HA   ASN 113           HA       ASN 113  12.713 -14.145   0.293
  786    HB2  ASN 113           HB2      ASN 113  11.790 -12.882   2.274
  787    HB3  ASN 113           HB1      ASN 113  10.555 -14.131   2.407
  788   HD21  ASN 113          HD21      ASN 113  13.958 -13.433   2.648
  789   HD22  ASN 113          HD22      ASN 113  14.379 -14.823   3.588
  790    H    GLY 114           HN       GLY 114  12.251 -15.602  -1.412
  791    HA2  GLY 114           HA2      GLY 114  11.562 -18.165  -0.616
  792    HA3  GLY 114           HA1      GLY 114  10.108 -17.465  -1.315
  793    H    VAL 115           HN       VAL 115   9.849 -17.649  -3.444
  794    HA   VAL 115           HA       VAL 115  12.225 -18.295  -5.060
  795    HB   VAL 115           HB       VAL 115   9.405 -19.142  -5.729
  796   HG11  VAL 115          HG11      VAL 115  12.081 -20.083  -6.763
  797   HG12  VAL 115          HG12      VAL 115  10.986 -18.986  -7.603
  798   HG13  VAL 115          HG13      VAL 115  10.499 -20.656  -7.295
  799   HG21  VAL 115          HG21      VAL 115  10.047 -20.222  -3.641
  800   HG22  VAL 115          HG22      VAL 115  11.558 -20.764  -4.370
  801   HG23  VAL 115          HG23      VAL 115  10.020 -21.392  -4.961
  802    H    ASN 116           HN       ASN 116  11.775 -15.748  -4.631
  803    HA   ASN 116           HA       ASN 116  11.618 -13.744  -5.649
  804    HB2  ASN 116           HB2      ASN 116  12.922 -15.249  -7.307
  805    HB3  ASN 116           HB1      ASN 116  11.448 -15.212  -8.257
  806   HD21  ASN 116          HD21      ASN 116  10.830 -13.279  -9.255
  807   HD22  ASN 116          HD22      ASN 116  11.910 -11.940  -9.417
  808    H    SER 117           HN       SER 117   9.170 -15.025  -4.848
  809    HA   SER 117           HA       SER 117   6.922 -14.930  -5.035
  810    HB2  SER 117           HB2      SER 117   6.004 -12.707  -5.708
  811    HB3  SER 117           HB1      SER 117   7.291 -12.614  -4.510
  812    HG   SER 117           HG       SER 117   8.340 -12.494  -6.990
  813    H    ASN 118           HN       ASN 118   8.020 -16.437  -7.077
  814    HA   ASN 118           HA       ASN 118   6.326 -15.779  -9.386
  815    HB2  ASN 118           HB2      ASN 118   8.701 -16.167  -9.907
  816    HB3  ASN 118           HB1      ASN 118   8.602 -17.765  -9.174
  817   HD21  ASN 118          HD21      ASN 118   7.636 -15.784 -11.871
  818   HD22  ASN 118          HD22      ASN 118   7.175 -17.090 -12.912
  Start of MODEL    2
    1    H1   HIS   6           HT1      HIS   6 -20.240  -7.227  -5.335
    2    H2   HIS   6           HT2      HIS   6 -21.717  -6.442  -5.564
    3    H3   HIS   6           HT3      HIS   6 -20.617  -5.851  -4.431
    4    HA   HIS   6           HA       HIS   6 -20.164  -5.991  -7.349
    5    HB2  HIS   6           HB2      HIS   6 -20.509  -3.624  -7.457
    6    HB3  HIS   6           HB1      HIS   6 -21.899  -4.315  -6.635
    7    HD1  HIS   6           HD1      HIS   6 -19.149  -1.892  -6.219
    8    HD2  HIS   6           HD2      HIS   6 -22.002  -3.731  -3.822
    9    HE1  HIS   6           HE1      HIS   6 -19.180  -0.579  -4.079
   10    HE2  HIS   6           HE2      HIS   6 -20.789  -1.809  -2.588
   11    H    GLN   7           HN       GLN   7 -18.852  -5.475  -4.151
   12    HA   GLN   7           HA       GLN   7 -16.562  -4.068  -5.195
   13    HB2  GLN   7           HB2      GLN   7 -17.552  -3.526  -2.962
   14    HB3  GLN   7           HB1      GLN   7 -16.920  -5.060  -2.387
   15    HG2  GLN   7           HG2      GLN   7 -15.308  -3.507  -1.724
   16    HG3  GLN   7           HG1      GLN   7 -14.633  -4.213  -3.195
   17   HE21  GLN   7          HE21      GLN   7 -13.374  -2.403  -3.586
   18   HE22  GLN   7          HE22      GLN   7 -14.045  -0.920  -4.171
   19    H    ASP   8           HN       ASP   8 -17.393  -7.348  -4.562
   20    HA   ASP   8           HA       ASP   8 -14.852  -8.342  -3.922
   21    HB2  ASP   8           HB2      ASP   8 -16.826  -9.730  -3.694
   22    HB3  ASP   8           HB1      ASP   8 -17.111  -9.671  -5.429
   23    H    ASN   9           HN       ASN   9 -16.297  -7.497  -6.973
   24    HA   ASN   9           HA       ASN   9 -13.949  -8.281  -8.487
   25    HB2  ASN   9           HB2      ASN   9 -16.179  -8.436  -9.491
   26    HB3  ASN   9           HB1      ASN   9 -16.423  -6.712  -9.256
   27   HD21  ASN   9          HD21      ASN   9 -13.402  -8.156 -10.320
   28   HD22  ASN   9          HD22      ASN   9 -13.452  -7.507 -11.922
   29    H    ALA  10           HN       ALA  10 -15.403  -5.427  -7.119
   30    HA   ALA  10           HA       ALA  10 -13.859  -3.519  -8.539
   31    HB1  ALA  10           HB1      ALA  10 -14.740  -1.902  -7.061
   32    HB2  ALA  10           HB2      ALA  10 -15.144  -3.124  -5.854
   33    HB3  ALA  10           HB3      ALA  10 -16.026  -3.068  -7.386
   34    H    ARG  11           HN       ARG  11 -13.593  -4.895  -5.286
   35    HA   ARG  11           HA       ARG  11 -11.547  -3.416  -4.234
   36    HB2  ARG  11           HB2      ARG  11 -10.914  -5.477  -2.978
   37    HB3  ARG  11           HB1      ARG  11 -12.610  -5.065  -2.858
   38    HG2  ARG  11           HG2      ARG  11 -12.859  -7.269  -3.260
   39    HG3  ARG  11           HG1      ARG  11 -12.687  -6.754  -4.935
   40    HD2  ARG  11           HD2      ARG  11 -10.274  -7.253  -4.810
   41    HD3  ARG  11           HD1      ARG  11 -10.509  -7.847  -3.167
   42    HE   ARG  11           HE       ARG  11 -12.029  -9.076  -5.351
   43   HH11  ARG  11          HH11      ARG  11  -9.593  -9.318  -2.848
   44   HH12  ARG  11          HH12      ARG  11  -9.422 -11.036  -3.003
   45   HH21  ARG  11          HH21      ARG  11 -11.811 -11.339  -5.546
   46   HH22  ARG  11          HH22      ARG  11 -10.685 -12.184  -4.534
   47    H    LYS  12           HN       LYS  12 -11.363  -6.117  -6.405
   48    HA   LYS  12           HA       LYS  12  -8.598  -6.384  -6.499
   49    HB2  LYS  12           HB2      LYS  12 -10.303  -8.003  -7.433
   50    HB3  LYS  12           HB1      LYS  12 -10.531  -6.879  -8.768
   51    HG2  LYS  12           HG2      LYS  12  -9.044  -8.536  -9.511
   52    HG3  LYS  12           HG1      LYS  12  -8.080  -7.089  -9.225
   53    HD2  LYS  12           HD2      LYS  12  -7.595  -8.045  -6.929
   54    HD3  LYS  12           HD1      LYS  12  -8.291  -9.556  -7.520
   55    HE2  LYS  12           HE2      LYS  12  -6.672  -9.342  -9.454
   56    HE3  LYS  12           HE1      LYS  12  -5.868  -8.100  -8.502
   57    HZ1  LYS  12           HZ1      LYS  12  -4.801 -10.198  -8.117
   58    HZ2  LYS  12           HZ2      LYS  12  -6.268 -10.938  -7.729
   59    HZ3  LYS  12           HZ3      LYS  12  -5.621  -9.758  -6.704
   60    H    SER  13           HN       SER  13 -10.812  -4.678  -8.681
   61    HA   SER  13           HA       SER  13  -8.653  -3.744 -10.306
   62    HB2  SER  13           HB2      SER  13 -11.580  -2.958 -10.251
   63    HB3  SER  13           HB1      SER  13 -10.438  -2.578 -11.549
   64    HG   SER  13           HG       SER  13 -11.909  -4.641 -11.510
   65    H    ARG  14           HN       ARG  14 -10.842  -2.154  -7.974
   66    HA   ARG  14           HA       ARG  14  -9.984   0.464  -8.476
   67    HB2  ARG  14           HB2      ARG  14 -10.981   1.056  -6.304
   68    HB3  ARG  14           HB1      ARG  14 -12.057   0.050  -7.260
   69    HG2  ARG  14           HG2      ARG  14 -12.225  -1.378  -5.558
   70    HG3  ARG  14           HG1      ARG  14 -10.481  -1.647  -5.638
   71    HD2  ARG  14           HD2      ARG  14 -11.417  -0.879  -3.412
   72    HD3  ARG  14           HD1      ARG  14 -10.037   0.011  -4.030
   73    HE   ARG  14           HE       ARG  14 -12.208   1.410  -4.929
   74   HH11  ARG  14          HH11      ARG  14 -11.117   0.368  -1.758
   75   HH12  ARG  14          HH12      ARG  14 -11.866   1.695  -0.925
   76   HH21  ARG  14          HH21      ARG  14 -13.187   3.141  -3.839
   77   HH22  ARG  14          HH22      ARG  14 -13.054   3.267  -2.114
   78    H    ILE  15           HN       ILE  15  -8.719  -1.996  -6.350
   79    HA   ILE  15           HA       ILE  15  -6.926  -0.127  -5.072
   80    HB   ILE  15           HB       ILE  15  -7.108  -3.131  -4.945
   81   HG12  ILE  15          HG12      ILE  15  -7.983  -1.080  -2.894
   82   HG13  ILE  15          HG11      ILE  15  -9.078  -1.774  -4.086
   83   HG21  ILE  15          HG21      ILE  15  -4.877  -2.214  -4.385
   84   HG22  ILE  15          HG22      ILE  15  -5.681  -2.931  -2.982
   85   HG23  ILE  15          HG23      ILE  15  -5.639  -1.170  -3.175
   86   HD11  ILE  15          HD11      ILE  15  -7.508  -3.418  -2.137
   87   HD12  ILE  15          HD12      ILE  15  -8.845  -3.936  -3.179
   88   HD13  ILE  15          HD13      ILE  15  -9.141  -2.822  -1.829
   89    H    GLN  16           HN       GLN  16  -6.871  -2.785  -7.343
   90    HA   GLN  16           HA       GLN  16  -4.229  -3.267  -7.765
   91    HB2  GLN  16           HB2      GLN  16  -6.590  -3.942  -8.966
   92    HB3  GLN  16           HB1      GLN  16  -5.709  -3.128 -10.253
   93    HG2  GLN  16           HG2      GLN  16  -3.786  -4.648  -9.782
   94    HG3  GLN  16           HG1      GLN  16  -4.848  -5.523  -8.675
   95   HE21  GLN  16          HE21      GLN  16  -7.194  -5.138 -10.309
   96   HE22  GLN  16          HE22      GLN  16  -7.035  -6.199 -11.662
   97    H    SER  17           HN       SER  17  -6.152  -0.687  -9.293
   98    HA   SER  17           HA       SER  17  -4.267   0.210 -11.121
   99    HB2  SER  17           HB2      SER  17  -6.205   1.923  -9.547
  100    HB3  SER  17           HB1      SER  17  -5.471   2.329 -11.100
  101    HG   SER  17           HG       SER  17  -6.547   0.439 -11.946
  102    H    GLU  18           HN       GLU  18  -4.720   1.171  -7.751
  103    HA   GLU  18           HA       GLU  18  -2.430   2.926  -7.804
  104    HB2  GLU  18           HB2      GLU  18  -4.056   2.049  -5.444
  105    HB3  GLU  18           HB1      GLU  18  -3.043   3.474  -5.592
  106    HG2  GLU  18           HG2      GLU  18  -4.570   4.617  -6.770
  107    HG3  GLU  18           HG1      GLU  18  -5.208   3.171  -7.545
  108    H    HIS  19           HN       HIS  19  -3.273  -0.239  -6.523
  109    HA   HIS  19           HA       HIS  19  -1.289  -0.779  -4.745
  110    HB2  HIS  19           HB2      HIS  19  -2.736  -2.552  -5.010
  111    HB3  HIS  19           HB1      HIS  19  -2.724  -2.464  -6.762
  112    HD1  HIS  19           HD1      HIS  19  -0.201  -3.406  -4.040
  113    HD2  HIS  19           HD2      HIS  19  -1.454  -4.547  -7.827
  114    HE1  HIS  19           HE1      HIS  19   1.172  -5.426  -4.620
  115    HE2  HIS  19           HE2      HIS  19   0.535  -5.977  -6.994
  116    H    ARG  20           HN       ARG  20  -0.974  -1.155  -8.272
  117    HA   ARG  20           HA       ARG  20   1.724  -1.796  -8.386
  118    HB2  ARG  20           HB2      ARG  20   0.310   0.034 -10.312
  119    HB3  ARG  20           HB1      ARG  20   1.685  -1.013 -10.636
  120    HG2  ARG  20           HG2      ARG  20   0.217  -2.968 -10.152
  121    HG3  ARG  20           HG1      ARG  20  -1.143  -1.844 -10.059
  122    HD2  ARG  20           HD2      ARG  20   0.679  -2.221 -12.413
  123    HD3  ARG  20           HD1      ARG  20  -0.959  -2.857 -12.272
  124    HE   ARG  20           HE       ARG  20  -0.912  -0.038 -11.893
  125   HH11  ARG  20          HH11      ARG  20  -0.742  -2.494 -14.389
  126   HH12  ARG  20          HH12      ARG  20  -1.392  -1.461 -15.621
  127   HH21  ARG  20          HH21      ARG  20  -1.765   1.314 -13.523
  128   HH22  ARG  20          HH22      ARG  20  -1.951   0.703 -15.135
  129    H    GLU  21           HN       GLU  21   0.248   1.454  -8.606
  130    HA   GLU  21           HA       GLU  21   2.487   3.008  -8.738
  131    HB2  GLU  21           HB2      GLU  21   0.028   3.694  -7.164
  132    HB3  GLU  21           HB1      GLU  21   1.122   4.798  -7.981
  133    HG2  GLU  21           HG2      GLU  21  -1.105   3.189  -9.062
  134    HG3  GLU  21           HG1      GLU  21  -0.494   4.754  -9.492
  135    H    LEU  22           HN       LEU  22   0.828   1.929  -5.776
  136    HA   LEU  22           HA       LEU  22   2.450   3.390  -4.009
  137    HB2  LEU  22           HB2      LEU  22   0.627   1.051  -3.633
  138    HB3  LEU  22           HB1      LEU  22   1.641   1.596  -2.311
  139    HG   LEU  22           HG       LEU  22  -0.430   2.652  -1.948
  140   HD11  LEU  22          HD11      LEU  22   1.165   4.704  -3.484
  141   HD12  LEU  22          HD12      LEU  22   1.577   4.149  -1.860
  142   HD13  LEU  22          HD13      LEU  22   0.052   4.983  -2.146
  143   HD21  LEU  22          HD21      LEU  22  -1.676   3.835  -3.643
  144   HD22  LEU  22          HD22      LEU  22  -1.386   2.172  -4.156
  145   HD23  LEU  22          HD23      LEU  22  -0.431   3.489  -4.842
  146    H    VAL  23           HN       VAL  23   2.830   0.086  -5.260
  147    HA   VAL  23           HA       VAL  23   5.099  -0.370  -3.583
  148    HB   VAL  23           HB       VAL  23   4.875  -2.463  -4.137
  149   HG11  VAL  23          HG11      VAL  23   2.985  -3.277  -5.285
  150   HG12  VAL  23          HG12      VAL  23   2.845  -1.803  -6.239
  151   HG13  VAL  23          HG13      VAL  23   2.479  -1.769  -4.516
  152   HG21  VAL  23          HG21      VAL  23   5.340  -1.510  -6.929
  153   HG22  VAL  23          HG22      VAL  23   5.144  -3.223  -6.521
  154   HG23  VAL  23          HG23      VAL  23   6.480  -2.293  -5.812
  155    H    SER  24           HN       SER  24   4.598   0.647  -6.915
  156    HA   SER  24           HA       SER  24   7.286   0.856  -7.661
  157    HB2  SER  24           HB2      SER  24   4.918   2.590  -8.360
  158    HB3  SER  24           HB1      SER  24   6.464   2.636  -9.205
  159    HG   SER  24           HG       SER  24   4.408   1.006  -9.611
  160    H    ALA  25           HN       ALA  25   5.309   2.701  -5.515
  161    HA   ALA  25           HA       ALA  25   7.220   4.867  -5.180
  162    HB1  ALA  25           HB1      ALA  25   5.742   5.733  -3.544
  163    HB2  ALA  25           HB2      ALA  25   4.961   4.164  -3.324
  164    HB3  ALA  25           HB3      ALA  25   4.701   5.071  -4.824
  165    H    ILE  26           HN       ILE  26   6.381   1.821  -3.556
  166    HA   ILE  26           HA       ILE  26   7.977   2.171  -1.296
  167    HB   ILE  26           HB       ILE  26   6.754  -0.170  -2.652
  168   HG12  ILE  26          HG12      ILE  26   7.047   0.842   0.159
  169   HG13  ILE  26          HG11      ILE  26   5.605   0.871  -0.852
  170   HG21  ILE  26          HG21      ILE  26   7.987  -1.838  -1.416
  171   HG22  ILE  26          HG22      ILE  26   9.012  -0.594  -0.701
  172   HG23  ILE  26          HG23      ILE  26   9.107  -0.924  -2.433
  173   HD11  ILE  26          HD11      ILE  26   5.370  -1.475  -0.707
  174   HD12  ILE  26          HD12      ILE  26   5.609  -0.855   0.940
  175   HD13  ILE  26          HD13      ILE  26   6.938  -1.644   0.081
  176    H    GLN  27           HN       GLN  27   8.701   0.712  -4.420
  177    HA   GLN  27           HA       GLN  27  11.381   0.099  -3.989
  178    HB2  GLN  27           HB2      GLN  27  10.003   0.941  -6.545
  179    HB3  GLN  27           HB1      GLN  27  11.565   0.132  -6.453
  180    HG2  GLN  27           HG2      GLN  27  10.433  -1.787  -5.373
  181    HG3  GLN  27           HG1      GLN  27   8.903  -0.962  -5.596
  182   HE21  GLN  27          HE21      GLN  27   8.123  -2.637  -6.880
  183   HE22  GLN  27          HE22      GLN  27   8.644  -2.869  -8.509
  184    H    SER  28           HN       SER  28   9.796   3.087  -4.755
  185    HA   SER  28           HA       SER  28  12.159   4.578  -5.360
  186    HB2  SER  28           HB2      SER  28   9.310   5.384  -4.753
  187    HB3  SER  28           HB1      SER  28  10.552   6.495  -5.305
  188    HG   SER  28           HG       SER  28   9.348   4.343  -6.683
  189    H    TYR  29           HN       TYR  29   9.853   4.610  -2.630
  190    HA   TYR  29           HA       TYR  29  11.134   6.292  -0.857
  191    HB2  TYR  29           HB2      TYR  29   8.884   5.311  -0.562
  192    HB3  TYR  29           HB1      TYR  29   9.609   3.739  -0.275
  193    HD1  TYR  29           HD1      TYR  29   7.661   4.744   1.697
  194    HD2  TYR  29           HD2      TYR  29  11.842   5.516   1.367
  195    HE1  TYR  29           HE1      TYR  29   7.762   5.289   4.086
  196    HE2  TYR  29           HE2      TYR  29  11.937   6.055   3.761
  197    HH   TYR  29           HH       TYR  29  10.378   6.839   5.528
  198    H    ILE  30           HN       ILE  30  11.434   2.774  -1.104
  199    HA   ILE  30           HA       ILE  30  13.311   2.463   0.934
  200    HB   ILE  30           HB       ILE  30  12.609   0.761  -1.440
  201   HG12  ILE  30          HG12      ILE  30  11.869   0.713   1.491
  202   HG13  ILE  30          HG11      ILE  30  10.828   1.158   0.151
  203   HG21  ILE  30          HG21      ILE  30  14.413   0.109   0.878
  204   HG22  ILE  30          HG22      ILE  30  14.828   0.125  -0.835
  205   HG23  ILE  30          HG23      ILE  30  13.717  -1.094  -0.207
  206   HD11  ILE  30          HD11      ILE  30  11.934  -1.568   0.733
  207   HD12  ILE  30          HD12      ILE  30  10.985  -1.137  -0.691
  208   HD13  ILE  30          HD13      ILE  30  10.264  -1.023   0.914
  209    H    GLY  31           HN       GLY  31  13.739   3.032  -2.528
  210    HA2  GLY  31           HA2      GLY  31  16.576   2.693  -2.482
  211    HA3  GLY  31           HA1      GLY  31  15.646   3.480  -3.751
  212    H    ALA  32           HN       ALA  32  14.482   5.170  -1.472
  213    HA   ALA  32           HA       ALA  32  16.460   7.293  -1.640
  214    HB1  ALA  32           HB1      ALA  32  14.010   7.647  -2.055
  215    HB2  ALA  32           HB2      ALA  32  14.737   8.733  -0.869
  216    HB3  ALA  32           HB3      ALA  32  13.761   7.367  -0.330
  217    H    GLN  33           HN       GLN  33  15.345   4.934   0.577
  218    HA   GLN  33           HA       GLN  33  15.661   6.277   2.980
  219    HB2  GLN  33           HB2      GLN  33  15.761   3.382   2.263
  220    HB3  GLN  33           HB1      GLN  33  16.005   3.939   3.916
  221    HG2  GLN  33           HG2      GLN  33  13.679   5.103   2.628
  222    HG3  GLN  33           HG1      GLN  33  13.607   3.359   2.770
  223   HE21  GLN  33          HE21      GLN  33  15.249   5.518   4.995
  224   HE22  GLN  33          HE22      GLN  33  14.211   5.227   6.340
  225    H    ASP  34           HN       ASP  34  17.239   5.994   4.613
  226    HA   ASP  34           HA       ASP  34  19.897   6.398   3.906
  227    HB2  ASP  34           HB2      ASP  34  18.691   6.898   6.101
  228    HB3  ASP  34           HB1      ASP  34  19.004   5.220   6.517
  229    H    ASP  35           HN       ASP  35  18.095   3.556   4.604
  230    HA   ASP  35           HA       ASP  35  20.172   1.971   3.324
  231    HB2  ASP  35           HB2      ASP  35  18.907   1.157   5.947
  232    HB3  ASP  35           HB1      ASP  35  19.788   0.065   4.900
  233    HA   PRO  36           HA       PRO  36  16.320   0.746   1.332
  234    HB2  PRO  36           HB2      PRO  36  17.454  -0.315  -0.815
  235    HB3  PRO  36           HB1      PRO  36  17.486   1.432  -0.573
  236    HG2  PRO  36           HG2      PRO  36  19.611  -0.564   0.165
  237    HG3  PRO  36           HG1      PRO  36  19.783   0.872  -0.860
  238    HD2  PRO  36           HD2      PRO  36  20.413   0.993   1.717
  239    HD3  PRO  36           HD1      PRO  36  19.544   2.337   0.945
  240    H    THR  37           HN       THR  37  18.715  -0.812   2.834
  241    HA   THR  37           HA       THR  37  18.237  -3.491   1.965
  242    HB   THR  37           HB       THR  37  20.056  -4.071   3.388
  243    HG1  THR  37           HG1      THR  37  20.280  -3.116   5.275
  244   HG21  THR  37          HG21      THR  37  20.537  -1.229   2.469
  245   HG22  THR  37          HG22      THR  37  20.665  -2.658   1.437
  246   HG23  THR  37          HG23      THR  37  21.775  -2.446   2.792
  247    H    ASN  38           HN       ASN  38  17.331  -1.454   4.586
  248    HA   ASN  38           HA       ASN  38  15.208  -3.229   5.343
  249    HB2  ASN  38           HB2      ASN  38  17.234  -4.061   6.534
  250    HB3  ASN  38           HB1      ASN  38  17.316  -2.522   7.383
  251   HD21  ASN  38          HD21      ASN  38  17.044  -3.504   9.377
  252   HD22  ASN  38          HD22      ASN  38  15.519  -4.133   9.899
  253    HA   PRO  39           HA       PRO  39  14.656   1.462   5.664
  254    HB2  PRO  39           HB2      PRO  39  12.271   1.380   4.286
  255    HB3  PRO  39           HB1      PRO  39  13.850   1.729   3.579
  256    HG2  PRO  39           HG2      PRO  39  12.345  -0.846   3.637
  257    HG3  PRO  39           HG1      PRO  39  13.282  -0.120   2.331
  258    HD2  PRO  39           HD2      PRO  39  14.272  -2.107   3.770
  259    HD3  PRO  39           HD1      PRO  39  15.296  -0.775   3.224
  260    H    SER  40           HN       SER  40  12.680   2.631   6.414
  261    HA   SER  40           HA       SER  40  11.712   1.430   8.818
  262    HB2  SER  40           HB2      SER  40  10.971   4.046   7.485
  263    HB3  SER  40           HB1      SER  40  10.523   3.578   9.123
  264    HG   SER  40           HG       SER  40  13.186   3.295   8.727
  265    H    GLU  41           HN       GLU  41   9.232   2.134   9.224
  266    HA   GLU  41           HA       GLU  41   7.636   0.387   7.674
  267    HB2  GLU  41           HB2      GLU  41   6.889   0.633   9.862
  268    HB3  GLU  41           HB1      GLU  41   7.175   2.362   9.874
  269    HG2  GLU  41           HG2      GLU  41   5.266   2.710   8.474
  270    HG3  GLU  41           HG1      GLU  41   4.954   0.975   8.409
  271    H    ILE  42           HN       ILE  42   6.301   0.781   6.027
  272    HA   ILE  42           HA       ILE  42   6.585   3.413   4.805
  273    HB   ILE  42           HB       ILE  42   6.306   0.659   3.663
  274   HG12  ILE  42          HG12      ILE  42   8.380   2.819   3.691
  275   HG13  ILE  42          HG11      ILE  42   8.544   1.108   4.066
  276   HG21  ILE  42          HG21      ILE  42   5.987   1.545   1.504
  277   HG22  ILE  42          HG22      ILE  42   6.236   3.196   2.062
  278   HG23  ILE  42          HG23      ILE  42   4.788   2.313   2.541
  279   HD11  ILE  42          HD11      ILE  42   8.159   2.310   1.351
  280   HD12  ILE  42          HD12      ILE  42   8.275   0.583   1.699
  281   HD13  ILE  42          HD13      ILE  42   9.656   1.639   2.005
  282    H    THR  43           HN       THR  43   4.827   4.610   4.561
  283    HA   THR  43           HA       THR  43   2.236   3.260   4.325
  284    HB   THR  43           HB       THR  43   1.155   5.106   5.555
  285    HG1  THR  43           HG1      THR  43   2.771   6.311   6.952
  286   HG21  THR  43          HG21      THR  43   1.753   3.000   6.693
  287   HG22  THR  43          HG22      THR  43   1.791   4.385   7.786
  288   HG23  THR  43          HG23      THR  43   3.301   3.714   7.160
  289    H    LEU  44           HN       LEU  44   0.570   4.783   3.451
  290    HA   LEU  44           HA       LEU  44   1.438   5.664   0.935
  291    HB2  LEU  44           HB2      LEU  44  -1.057   6.427   2.370
  292    HB3  LEU  44           HB1      LEU  44  -0.785   6.479   0.659
  293    HG   LEU  44           HG       LEU  44  -1.163   4.105   2.401
  294   HD11  LEU  44          HD11      LEU  44  -3.160   3.991   1.461
  295   HD12  LEU  44          HD12      LEU  44  -2.499   4.250  -0.153
  296   HD13  LEU  44          HD13      LEU  44  -2.853   5.628   0.886
  297   HD21  LEU  44          HD21      LEU  44  -0.589   2.695   0.491
  298   HD22  LEU  44          HD22      LEU  44   0.789   3.655   1.018
  299   HD23  LEU  44          HD23      LEU  44  -0.117   4.128  -0.417
  300    H    ALA  45           HN       ALA  45   0.754   7.254   3.927
  301    HA   ALA  45           HA       ALA  45   0.902   9.915   3.029
  302    HB1  ALA  45           HB1      ALA  45   1.072  10.464   5.406
  303    HB2  ALA  45           HB2      ALA  45   1.387   8.764   5.779
  304    HB3  ALA  45           HB3      ALA  45  -0.189   9.256   5.112
  305    H    LYS  46           HN       LYS  46   3.286   7.548   3.855
  306    HA   LYS  46           HA       LYS  46   5.509   9.393   3.851
  307    HB2  LYS  46           HB2      LYS  46   5.299   6.417   3.966
  308    HB3  LYS  46           HB1      LYS  46   6.815   7.274   4.004
  309    HG2  LYS  46           HG2      LYS  46   6.215   8.329   6.075
  310    HG3  LYS  46           HG1      LYS  46   4.610   7.594   6.008
  311    HD2  LYS  46           HD2      LYS  46   5.759   5.361   5.966
  312    HD3  LYS  46           HD1      LYS  46   7.260   6.216   6.343
  313    HE2  LYS  46           HE2      LYS  46   4.739   6.314   7.968
  314    HE3  LYS  46           HE1      LYS  46   6.139   5.281   8.313
  315    HZ1  LYS  46           HZ1      LYS  46   7.484   7.296   8.551
  316    HZ2  LYS  46           HZ2      LYS  46   6.211   7.268   9.659
  317    HZ3  LYS  46           HZ3      LYS  46   6.117   8.256   8.291
  318    H    LEU  47           HN       LEU  47   3.971   7.074   1.750
  319    HA   LEU  47           HA       LEU  47   6.015   6.977  -0.209
  320    HB2  LEU  47           HB2      LEU  47   3.139   6.123  -0.130
  321    HB3  LEU  47           HB1      LEU  47   4.113   5.948  -1.578
  322    HG   LEU  47           HG       LEU  47   4.688   4.682   1.098
  323   HD11  LEU  47          HD11      LEU  47   3.696   3.481  -1.481
  324   HD12  LEU  47          HD12      LEU  47   2.758   3.697  -0.002
  325   HD13  LEU  47          HD13      LEU  47   4.129   2.588  -0.023
  326   HD21  LEU  47          HD21      LEU  47   6.092   4.409  -1.555
  327   HD22  LEU  47          HD22      LEU  47   6.424   3.448  -0.116
  328   HD23  LEU  47          HD23      LEU  47   6.734   5.183  -0.109
  329    H    ALA  48           HN       ALA  48   3.724   9.300   0.559
  330    HA   ALA  48           HA       ALA  48   2.665  10.279  -1.735
  331    HB1  ALA  48           HB1      ALA  48   3.798  12.181   0.274
  332    HB2  ALA  48           HB2      ALA  48   2.442  11.129   0.674
  333    HB3  ALA  48           HB3      ALA  48   2.299  12.293  -0.645
  334    HA   PRO  49           HA       PRO  49   6.566  13.054  -2.676
  335    HB2  PRO  49           HB2      PRO  49   8.673  11.515  -1.268
  336    HB3  PRO  49           HB1      PRO  49   8.458  13.253  -1.408
  337    HG2  PRO  49           HG2      PRO  49   7.929  12.077   0.879
  338    HG3  PRO  49           HG1      PRO  49   6.804  13.303   0.251
  339    HD2  PRO  49           HD2      PRO  49   6.631  10.317   0.054
  340    HD3  PRO  49           HD1      PRO  49   5.392  11.460   0.594
  341    H    TYR  50           HN       TYR  50   6.437   9.642  -2.607
  342    HA   TYR  50           HA       TYR  50   8.357   9.386  -4.814
  343    HB2  TYR  50           HB2      TYR  50   7.202   7.209  -3.073
  344    HB3  TYR  50           HB1      TYR  50   8.542   7.067  -4.204
  345    HD1  TYR  50           HD1      TYR  50  10.637   8.474  -3.741
  346    HD2  TYR  50           HD2      TYR  50   7.588   7.786  -0.865
  347    HE1  TYR  50           HE1      TYR  50  12.192   9.124  -1.953
  348    HE2  TYR  50           HE2      TYR  50   9.135   8.433   0.942
  349    HH   TYR  50           HH       TYR  50  11.507   8.623   1.370
  350    H    MET  51           HN       MET  51   5.128   9.692  -4.294
  351    HA   MET  51           HA       MET  51   4.252   7.863  -6.364
  352    HB2  MET  51           HB2      MET  51   2.701  10.035  -4.951
  353    HB3  MET  51           HB1      MET  51   2.030   8.757  -5.954
  354    HG2  MET  51           HG2      MET  51   3.451   8.385  -3.331
  355    HG3  MET  51           HG1      MET  51   1.712   8.293  -3.597
  356    HE1  MET  51           HE1      MET  51   1.629   5.098  -5.972
  357    HE2  MET  51           HE2      MET  51   1.617   6.815  -6.380
  358    HE3  MET  51           HE3      MET  51   0.580   6.205  -5.087
  359    H    SER  52           HN       SER  52   2.748   8.900  -8.061
  360    HA   SER  52           HA       SER  52   3.641  11.517  -8.949
  361    HB2  SER  52           HB2      SER  52   5.245   9.881  -9.943
  362    HB3  SER  52           HB1      SER  52   3.890   9.096 -10.751
  363    HG   SER  52           HG       SER  52   4.379  11.859 -11.072
  364    H    LYS  53           HN       LYS  53   1.595   8.684  -9.480
  365    HA   LYS  53           HA       LYS  53  -0.190  10.020 -11.226
  366    HB2  LYS  53           HB2      LYS  53  -0.650   7.885 -11.662
  367    HB3  LYS  53           HB1      LYS  53   0.288   7.364 -10.277
  368    HG2  LYS  53           HG2      LYS  53  -2.541   8.266  -9.973
  369    HG3  LYS  53           HG1      LYS  53  -2.156   6.629 -10.492
  370    HD2  LYS  53           HD2      LYS  53  -0.933   6.231  -8.434
  371    HD3  LYS  53           HD1      LYS  53  -1.178   7.913  -7.933
  372    HE2  LYS  53           HE2      LYS  53  -2.720   6.030  -6.995
  373    HE3  LYS  53           HE1      LYS  53  -3.410   7.593  -7.466
  374    HZ1  LYS  53           HZ1      LYS  53  -4.745   5.768  -8.301
  375    HZ2  LYS  53           HZ2      LYS  53  -3.413   5.105  -9.102
  376    HZ3  LYS  53           HZ3      LYS  53  -4.038   6.593  -9.594
  377    H    ASN  54           HN       ASN  54  -1.585  11.521 -10.635
  378    HA   ASN  54           HA       ASN  54  -3.184  12.687  -9.484
  379    HB2  ASN  54           HB2      ASN  54  -3.953  10.165  -9.599
  380    HB3  ASN  54           HB1      ASN  54  -3.765  10.257  -7.864
  381   HD21  ASN  54          HD21      ASN  54  -4.597  13.056  -7.706
  382   HD22  ASN  54          HD22      ASN  54  -6.306  13.065  -7.972
  383    H    ALA  55           HN       ALA  55  -0.425  12.139  -8.206
  384    HA   ALA  55           HA       ALA  55  -1.146  12.663  -5.404
  385    HB1  ALA  55           HB1      ALA  55   1.022  10.722  -6.129
  386    HB2  ALA  55           HB2      ALA  55  -0.664  10.208  -6.006
  387    HB3  ALA  55           HB3      ALA  55   0.159  10.908  -4.599
  388    H    LYS  56           HN       LYS  56   0.591  13.463  -4.076
  389    HA   LYS  56           HA       LYS  56   3.011  14.428  -5.197
  390    HB2  LYS  56           HB2      LYS  56   1.431  16.048  -6.199
  391    HB3  LYS  56           HB1      LYS  56   0.887  16.483  -4.590
  392    HG2  LYS  56           HG2      LYS  56   2.376  18.176  -5.283
  393    HG3  LYS  56           HG1      LYS  56   3.238  17.205  -4.092
  394    HD2  LYS  56           HD2      LYS  56   3.548  16.410  -6.925
  395    HD3  LYS  56           HD1      LYS  56   4.299  17.931  -6.447
  396    HE2  LYS  56           HE2      LYS  56   5.534  16.799  -4.693
  397    HE3  LYS  56           HE1      LYS  56   4.737  15.279  -5.079
  398    HZ1  LYS  56           HZ1      LYS  56   5.771  15.322  -7.257
  399    HZ2  LYS  56           HZ2      LYS  56   6.949  15.405  -6.050
  400    HZ3  LYS  56           HZ3      LYS  56   6.518  16.796  -6.906
  401    H    ASN  57           HN       ASN  57   0.752  15.694  -2.746
  402    HA   ASN  57           HA       ASN  57   2.769  15.119  -0.703
  403    HB2  ASN  57           HB2      ASN  57   0.464  17.068  -0.725
  404    HB3  ASN  57           HB1      ASN  57   1.354  16.655   0.737
  405   HD21  ASN  57          HD21      ASN  57   3.469  17.361   0.970
  406   HD22  ASN  57          HD22      ASN  57   4.134  18.610  -0.021
  407    H    GLU  58           HN       GLU  58   1.527  14.839   1.502
  408    HA   GLU  58           HA       GLU  58   0.377  12.305   1.416
  409    HB2  GLU  58           HB2      GLU  58   0.836  12.394   3.580
  410    HB3  GLU  58           HB1      GLU  58   1.298  14.072   3.362
  411    HG2  GLU  58           HG2      GLU  58  -1.064  14.695   3.715
  412    HG3  GLU  58           HG1      GLU  58  -1.373  13.017   4.170
  413    H    ASP  59           HN       ASP  59  -1.105  15.471   1.662
  414    HA   ASP  59           HA       ASP  59  -3.766  14.623   2.006
  415    HB2  ASP  59           HB2      ASP  59  -3.117  16.892   2.501
  416    HB3  ASP  59           HB1      ASP  59  -2.616  17.150   0.841
  417    H    GLY  60           HN       GLY  60  -1.735  14.994  -0.794
  418    HA2  GLY  60           HA2      GLY  60  -4.023  14.609  -2.577
  419    HA3  GLY  60           HA1      GLY  60  -2.445  15.198  -3.054
  420    H    ILE  61           HN       ILE  61  -2.166  12.523  -0.989
  421    HA   ILE  61           HA       ILE  61  -2.030  10.757  -3.313
  422    HB   ILE  61           HB       ILE  61   0.163  10.960  -2.424
  423   HG12  ILE  61          HG12      ILE  61   0.700   8.722  -1.894
  424   HG13  ILE  61          HG11      ILE  61  -0.910   8.408  -1.245
  425   HG21  ILE  61          HG21      ILE  61   0.741  10.482  -0.107
  426   HG22  ILE  61          HG22      ILE  61  -0.967  10.287   0.275
  427   HG23  ILE  61          HG23      ILE  61  -0.354  11.856  -0.241
  428   HD11  ILE  61          HD11      ILE  61  -0.316   9.019  -4.146
  429   HD12  ILE  61          HD12      ILE  61  -1.862   8.507  -3.458
  430   HD13  ILE  61          HD13      ILE  61  -0.488   7.395  -3.482
  431    H    VAL  62           HN       VAL  62  -2.606  10.684   0.139
  432    HA   VAL  62           HA       VAL  62  -3.505   8.020   0.131
  433    HB   VAL  62           HB       VAL  62  -3.811  10.200   2.182
  434   HG11  VAL  62          HG11      VAL  62  -4.081   7.243   2.590
  435   HG12  VAL  62          HG12      VAL  62  -5.463   8.334   2.417
  436   HG13  VAL  62          HG13      VAL  62  -4.344   8.521   3.773
  437   HG21  VAL  62          HG21      VAL  62  -2.062   8.034   2.798
  438   HG22  VAL  62          HG22      VAL  62  -1.715   9.768   2.717
  439   HG23  VAL  62          HG23      VAL  62  -1.615   8.772   1.254
  440    H    ASN  63           HN       ASN  63  -5.220  11.095   0.158
  441    HA   ASN  63           HA       ASN  63  -7.792   9.818   0.151
  442    HB2  ASN  63           HB2      ASN  63  -7.280  12.153   1.048
  443    HB3  ASN  63           HB1      ASN  63  -7.256  12.677  -0.633
  444   HD21  ASN  63          HD21      ASN  63  -9.037  14.001  -0.396
  445   HD22  ASN  63          HD22      ASN  63 -10.638  13.376  -0.196
  446    H    SER  64           HN       SER  64  -5.458  10.705  -2.187
  447    HA   SER  64           HA       SER  64  -7.134  10.710  -4.502
  448    HB2  SER  64           HB2      SER  64  -4.176  10.487  -4.012
  449    HB3  SER  64           HB1      SER  64  -4.823  10.275  -5.635
  450    HG   SER  64           HG       SER  64  -4.195  12.454  -5.163
  451    H    LEU  65           HN       LEU  65  -5.609   8.386  -2.547
  452    HA   LEU  65           HA       LEU  65  -5.808   6.206  -4.438
  453    HB2  LEU  65           HB2      LEU  65  -4.889   6.329  -1.576
  454    HB3  LEU  65           HB1      LEU  65  -4.855   4.887  -2.572
  455    HG   LEU  65           HG       LEU  65  -3.342   7.415  -3.150
  456   HD11  LEU  65          HD11      LEU  65  -1.391   6.153  -2.447
  457   HD12  LEU  65          HD12      LEU  65  -2.413   4.781  -2.033
  458   HD13  LEU  65          HD13      LEU  65  -2.552   6.290  -1.131
  459   HD21  LEU  65          HD21      LEU  65  -3.804   6.256  -5.166
  460   HD22  LEU  65          HD22      LEU  65  -3.427   4.709  -4.414
  461   HD23  LEU  65          HD23      LEU  65  -2.138   5.875  -4.718
  462    H    ALA  66           HN       ALA  66  -6.837   4.178  -3.795
  463    HA   ALA  66           HA       ALA  66  -9.492   4.313  -3.119
  464    HB1  ALA  66           HB1      ALA  66  -9.392   1.934  -2.604
  465    HB2  ALA  66           HB2      ALA  66  -7.628   2.023  -2.487
  466    HB3  ALA  66           HB3      ALA  66  -8.420   2.285  -4.047
  467    H    LYS  67           HN       LYS  67 -10.647   4.308  -1.329
  468    HA   LYS  67           HA       LYS  67  -9.173   4.532   1.187
  469    HB2  LYS  67           HB2      LYS  67 -11.926   5.601   0.594
  470    HB3  LYS  67           HB1      LYS  67 -10.956   5.916   2.020
  471    HG2  LYS  67           HG2      LYS  67 -10.502   6.910  -0.774
  472    HG3  LYS  67           HG1      LYS  67 -10.876   7.851   0.662
  473    HD2  LYS  67           HD2      LYS  67  -8.370   6.225   0.483
  474    HD3  LYS  67           HD1      LYS  67  -8.460   7.836  -0.220
  475    HE2  LYS  67           HE2      LYS  67  -8.760   7.052   2.669
  476    HE3  LYS  67           HE1      LYS  67  -7.512   8.079   1.949
  477    HZ1  LYS  67           HZ1      LYS  67  -9.373   9.652   1.375
  478    HZ2  LYS  67           HZ2      LYS  67  -9.055   9.493   3.029
  479    HZ3  LYS  67           HZ3      LYS  67 -10.392   8.713   2.349
  480    H    ASP  68           HN       ASP  68  -9.729   3.235   2.861
  481    HA   ASP  68           HA       ASP  68 -11.301   0.931   2.136
  482    HB2  ASP  68           HB2      ASP  68  -9.217   0.633   3.435
  483    HB3  ASP  68           HB1      ASP  68  -9.914   1.541   4.772
  484    H    LYS  69           HN       LYS  69 -13.039   0.129   3.621
  485    HA   LYS  69           HA       LYS  69 -14.890   2.330   3.902
  486    HB2  LYS  69           HB2      LYS  69 -15.582   0.297   2.761
  487    HB3  LYS  69           HB1      LYS  69 -15.339  -0.605   4.245
  488    HG2  LYS  69           HG2      LYS  69 -17.157   0.378   5.304
  489    HG3  LYS  69           HG1      LYS  69 -17.200   1.729   4.168
  490    HD2  LYS  69           HD2      LYS  69 -19.035   0.261   3.696
  491    HD3  LYS  69           HD1      LYS  69 -17.856   0.149   2.390
  492    HE2  LYS  69           HE2      LYS  69 -16.990  -1.920   3.316
  493    HE3  LYS  69           HE1      LYS  69 -18.100  -1.798   4.681
  494    HZ1  LYS  69           HZ1      LYS  69 -19.942  -1.890   3.050
  495    HZ2  LYS  69           HZ2      LYS  69 -19.014  -3.301   3.096
  496    HZ3  LYS  69           HZ3      LYS  69 -18.813  -2.199   1.832
  497    H    SER  70           HN       SER  70 -13.622  -0.233   6.033
  498    HA   SER  70           HA       SER  70 -14.953   1.129   8.264
  499    HB2  SER  70           HB2      SER  70 -13.778  -1.643   8.208
  500    HB3  SER  70           HB1      SER  70 -14.800  -0.956   9.468
  501    HG   SER  70           HG       SER  70 -15.467  -1.983   6.983
  502    H    GLY  71           HN       GLY  71 -11.800   0.028   7.152
  503    HA2  GLY  71           HA2      GLY  71  -9.685   0.530   7.925
  504    HA3  GLY  71           HA1      GLY  71 -10.417   1.731   8.983
  505    H    ASN  72           HN       ASN  72 -11.694  -1.406   9.185
  506    HA   ASN  72           HA       ASN  72 -11.376  -1.610  11.937
  507    HB2  ASN  72           HB2      ASN  72 -13.052  -2.817  10.499
  508    HB3  ASN  72           HB1      ASN  72 -11.767  -3.916  10.019
  509   HD21  ASN  72          HD21      ASN  72 -14.284  -4.411  11.408
  510   HD22  ASN  72          HD22      ASN  72 -13.863  -5.205  12.886
  511    H    SER  73           HN       SER  73  -9.370  -2.843   9.325
  512    HA   SER  73           HA       SER  73  -7.783  -4.473  11.089
  513    HB2  SER  73           HB2      SER  73  -7.248  -3.817   8.191
  514    HB3  SER  73           HB1      SER  73  -6.649  -5.201   9.106
  515    HG   SER  73           HG       SER  73  -8.576  -6.150   8.989
  516    H    SER  74           HN       SER  74  -7.876  -1.298  10.872
  517    HA   SER  74           HA       SER  74  -6.484   0.439  11.276
  518    HB2  SER  74           HB2      SER  74  -4.629  -1.727  12.286
  519    HB3  SER  74           HB1      SER  74  -4.501  -0.007  12.654
  520    HG   SER  74           HG       SER  74  -6.979  -1.056  13.172
  521    H    THR  75           HN       THR  75  -6.420   0.575   8.905
  522    HA   THR  75           HA       THR  75  -4.436  -0.712   7.367
  523    HB   THR  75           HB       THR  75  -6.644   0.184   6.548
  524    HG1  THR  75           HG1      THR  75  -5.602   1.042   4.531
  525   HG21  THR  75          HG21      THR  75  -5.205   2.809   6.262
  526   HG22  THR  75          HG22      THR  75  -6.239   2.449   7.652
  527   HG23  THR  75          HG23      THR  75  -6.922   2.456   6.024
  528    H    SER  76           HN       SER  76  -4.255   2.055   9.361
  529    HA   SER  76           HA       SER  76  -2.500   3.350   9.974
  530    HB2  SER  76           HB2      SER  76  -0.871   1.759   7.981
  531    HB3  SER  76           HB1      SER  76  -0.232   2.816   9.241
  532    HG   SER  76           HG       SER  76  -1.879   0.551   9.732
  533    H    ALA  77           HN       ALA  77  -2.694   2.874   6.446
  534    HA   ALA  77           HA       ALA  77  -1.957   5.570   5.814
  535    HB1  ALA  77           HB1      ALA  77  -2.858   5.115   3.614
  536    HB2  ALA  77           HB2      ALA  77  -3.663   3.656   4.223
  537    HB3  ALA  77           HB3      ALA  77  -1.898   3.725   4.150
  538    HA   PRO  78           HA       PRO  78  -5.456   7.474   7.666
  539    HB2  PRO  78           HB2      PRO  78  -4.946   9.421   5.469
  540    HB3  PRO  78           HB1      PRO  78  -5.221   9.734   7.181
  541    HG2  PRO  78           HG2      PRO  78  -2.778   9.862   6.208
  542    HG3  PRO  78           HG1      PRO  78  -3.066   9.023   7.743
  543    HD2  PRO  78           HD2      PRO  78  -2.576   7.876   5.043
  544    HD3  PRO  78           HD1      PRO  78  -2.005   7.318   6.627
  545    H    GLY  79           HN       GLY  79  -7.216   6.285   7.239
  546    HA2  GLY  79           HA2      GLY  79  -9.174   5.592   6.294
  547    HA3  GLY  79           HA1      GLY  79  -9.151   7.103   5.411
  548    H    SER  80           HN       SER  80  -6.429   5.129   4.647
  549    HA   SER  80           HA       SER  80  -7.639   4.773   1.984
  550    HB2  SER  80           HB2      SER  80  -5.415   5.956   2.372
  551    HB3  SER  80           HB1      SER  80  -4.740   4.358   2.651
  552    HG   SER  80           HG       SER  80  -6.250   4.968   0.334
  553    H    ALA  81           HN       ALA  81  -7.086   2.967   0.717
  554    HA   ALA  81           HA       ALA  81  -7.497   0.493   2.186
  555    HB1  ALA  81           HB1      ALA  81  -8.981   1.144   0.315
  556    HB2  ALA  81           HB2      ALA  81  -8.187  -0.416   0.049
  557    HB3  ALA  81           HB3      ALA  81  -7.599   1.033  -0.776
  558    H    HIS  82           HN       HIS  82  -4.830   1.850   2.033
  559    HA   HIS  82           HA       HIS  82  -3.418  -0.501   1.017
  560    HB2  HIS  82           HB2      HIS  82  -2.568   2.366   0.702
  561    HB3  HIS  82           HB1      HIS  82  -1.557   0.995   0.359
  562    HD1  HIS  82           HD1      HIS  82  -2.463  -0.561  -1.712
  563    HD2  HIS  82           HD2      HIS  82  -4.213   3.190  -1.298
  564    HE1  HIS  82           HE1      HIS  82  -3.600  -0.089  -3.906
  565    HE2  HIS  82           HE2      HIS  82  -4.792   2.114  -3.576
  566    H    GLN  83           HN       GLN  83  -2.149  -1.442   2.465
  567    HA   GLN  83           HA       GLN  83  -0.872   0.130   4.565
  568    HB2  GLN  83           HB2      GLN  83  -2.853  -0.574   5.724
  569    HB3  GLN  83           HB1      GLN  83  -2.721  -2.201   5.069
  570    HG2  GLN  83           HG2      GLN  83  -0.683  -2.568   6.355
  571    HG3  GLN  83           HG1      GLN  83  -0.798  -0.935   7.005
  572   HE21  GLN  83          HE21      GLN  83  -0.851  -1.761   9.095
  573   HE22  GLN  83          HE22      GLN  83  -2.288  -2.474   9.746
  574    H    ILE  84           HN       ILE  84   1.186  -0.431   4.515
  575    HA   ILE  84           HA       ILE  84   1.917  -2.937   3.306
  576    HB   ILE  84           HB       ILE  84   3.306  -0.408   4.011
  577   HG12  ILE  84          HG12      ILE  84   3.821  -1.525   1.440
  578   HG13  ILE  84          HG11      ILE  84   2.091  -1.624   1.769
  579   HG21  ILE  84          HG21      ILE  84   4.847  -2.137   4.756
  580   HG22  ILE  84          HG22      ILE  84   5.441  -1.370   3.283
  581   HG23  ILE  84          HG23      ILE  84   4.691  -2.964   3.207
  582   HD11  ILE  84          HD11      ILE  84   2.194   0.823   2.351
  583   HD12  ILE  84          HD12      ILE  84   2.502   0.435   0.659
  584   HD13  ILE  84          HD13      ILE  84   3.848   0.825   1.730
  585    H    ASP  85           HN       ASP  85   2.642  -4.659   4.316
  586    HA   ASP  85           HA       ASP  85   2.751  -4.768   7.204
  587    HB2  ASP  85           HB2      ASP  85   1.853  -6.662   5.791
  588    HB3  ASP  85           HB1      ASP  85   3.480  -6.899   5.177
  589    H    THR  86           HN       THR  86   4.533  -4.110   8.232
  590    HA   THR  86           HA       THR  86   7.021  -3.942   6.779
  591    HB   THR  86           HB       THR  86   7.807  -2.792   8.841
  592    HG1  THR  86           HG1      THR  86   6.619  -2.973  10.579
  593   HG21  THR  86          HG21      THR  86   6.896  -1.573   6.951
  594   HG22  THR  86          HG22      THR  86   6.371  -0.813   8.459
  595   HG23  THR  86          HG23      THR  86   5.257  -1.837   7.549
  596    H    THR  87           HN       THR  87   5.532  -6.097   8.902
  597    HA   THR  87           HA       THR  87   7.737  -7.233  10.213
  598    HB   THR  87           HB       THR  87   5.202  -8.624   9.333
  599    HG1  THR  87           HG1      THR  87   4.209  -7.589  10.898
  600   HG21  THR  87          HG21      THR  87   6.929 -10.151  10.093
  601   HG22  THR  87          HG22      THR  87   5.629 -10.060  11.282
  602   HG23  THR  87          HG23      THR  87   7.145  -9.204  11.565
  603    H    ASN  88           HN       ASN  88   5.968  -8.405   7.337
  604    HA   ASN  88           HA       ASN  88   8.301 -10.021   6.590
  605    HB2  ASN  88           HB2      ASN  88   5.495  -9.934   5.464
  606    HB3  ASN  88           HB1      ASN  88   6.769 -11.004   4.887
  607   HD21  ASN  88          HD21      ASN  88   7.412 -12.738   6.160
  608   HD22  ASN  88          HD22      ASN  88   6.471 -13.293   7.501
  609    H    HIS  89           HN       HIS  89   6.846  -7.079   5.929
  610    HA   HIS  89           HA       HIS  89   7.521  -5.313   4.692
  611    HB2  HIS  89           HB2      HIS  89   9.727  -7.214   3.994
  612    HB3  HIS  89           HB1      HIS  89   9.518  -5.732   3.072
  613    HD1  HIS  89           HD1      HIS  89  11.492  -6.877   5.686
  614    HD2  HIS  89           HD2      HIS  89   9.172  -3.472   5.170
  615    HE1  HIS  89           HE1      HIS  89  12.413  -5.185   7.296
  616    HE2  HIS  89           HE2      HIS  89  10.895  -3.184   7.076
  617    H    LYS  90           HN       LYS  90   5.394  -6.495   3.970
  618    HA   LYS  90           HA       LYS  90   5.497  -6.876   1.054
  619    HB2  LYS  90           HB2      LYS  90   3.855  -7.981   3.249
  620    HB3  LYS  90           HB1      LYS  90   3.034  -7.717   1.730
  621    HG2  LYS  90           HG2      LYS  90   4.648  -9.163   0.608
  622    HG3  LYS  90           HG1      LYS  90   5.514  -9.386   2.131
  623    HD2  LYS  90           HD2      LYS  90   2.699 -10.256   1.484
  624    HD3  LYS  90           HD1      LYS  90   4.099 -11.293   1.775
  625    HE2  LYS  90           HE2      LYS  90   4.231 -10.236   4.073
  626    HE3  LYS  90           HE1      LYS  90   2.651  -9.539   3.742
  627    HZ1  LYS  90           HZ1      LYS  90   3.271 -12.443   3.756
  628    HZ2  LYS  90           HZ2      LYS  90   1.754 -11.756   3.461
  629    HZ3  LYS  90           HZ3      LYS  90   2.468 -11.601   4.986
  630    H    LEU  91           HN       LEU  91   4.148  -5.706  -0.223
  631    HA   LEU  91           HA       LEU  91   2.885  -3.361   0.963
  632    HB2  LEU  91           HB2      LEU  91   4.305  -3.043  -0.979
  633    HB3  LEU  91           HB1      LEU  91   3.374  -4.171  -1.897
  634    HG   LEU  91           HG       LEU  91   2.294  -2.451  -2.764
  635   HD11  LEU  91          HD11      LEU  91   0.675  -1.122  -1.435
  636   HD12  LEU  91          HD12      LEU  91   1.272  -1.932   0.017
  637   HD13  LEU  91          HD13      LEU  91   0.488  -2.867  -1.258
  638   HD21  LEU  91          HD21      LEU  91   4.198  -1.094  -2.207
  639   HD22  LEU  91          HD22      LEU  91   3.486  -0.711  -0.641
  640   HD23  LEU  91          HD23      LEU  91   2.706  -0.162  -2.125
  641    H    ILE  92           HN       ILE  92   1.092  -3.926   1.877
  642    HA   ILE  92           HA       ILE  92  -0.813  -5.702   0.578
  643    HB   ILE  92           HB       ILE  92  -0.354  -4.678   3.342
  644   HG12  ILE  92          HG12      ILE  92  -0.876  -7.226   3.744
  645   HG13  ILE  92          HG11      ILE  92  -0.561  -7.351   2.015
  646   HG21  ILE  92          HG21      ILE  92  -2.966  -5.912   2.450
  647   HG22  ILE  92          HG22      ILE  92  -2.732  -4.256   3.000
  648   HG23  ILE  92          HG23      ILE  92  -2.502  -5.600   4.119
  649   HD11  ILE  92          HD11      ILE  92   1.634  -6.444   2.314
  650   HD12  ILE  92          HD12      ILE  92   1.400  -7.834   3.375
  651   HD13  ILE  92          HD13      ILE  92   1.327  -6.200   4.030
  652    H    SER  93           HN       SER  93  -2.864  -5.014   0.081
  653    HA   SER  93           HA       SER  93  -3.480  -2.216   0.635
  654    HB2  SER  93           HB2      SER  93  -4.248  -3.715  -1.862
  655    HB3  SER  93           HB1      SER  93  -4.526  -2.007  -1.525
  656    HG   SER  93           HG       SER  93  -1.956  -3.209  -1.643
  657    H    THR  94           HN       THR  94  -5.155  -2.122   1.983
  658    HA   THR  94           HA       THR  94  -6.514  -4.637   2.556
  659    HB   THR  94           HB       THR  94  -6.163  -2.106   4.154
  660    HG1  THR  94           HG1      THR  94  -4.397  -3.027   4.823
  661   HG21  THR  94          HG21      THR  94  -7.104  -3.291   6.049
  662   HG22  THR  94          HG22      THR  94  -7.359  -4.724   5.055
  663   HG23  THR  94          HG23      THR  94  -8.274  -3.252   4.730
  664    H    PHE  95           HN       PHE  95  -8.642  -4.929   2.329
  665    HA   PHE  95           HA       PHE  95 -10.407  -2.573   2.256
  666    HB2  PHE  95           HB2      PHE  95 -10.348  -3.784   0.065
  667    HB3  PHE  95           HB1      PHE  95 -10.925  -5.213   0.921
  668    HD1  PHE  95           HD1      PHE  95 -13.206  -5.507   1.480
  669    HD2  PHE  95           HD2      PHE  95 -11.831  -1.765  -0.050
  670    HE1  PHE  95           HE1      PHE  95 -15.533  -4.747   1.234
  671    HE2  PHE  95           HE2      PHE  95 -14.159  -1.008  -0.292
  672    HZ   PHE  95           HZ       PHE  95 -16.012  -2.498   0.352
  673    H    THR  96           HN       THR  96 -11.523  -2.545   4.150
  674    HA   THR  96           HA       THR  96 -11.987  -5.050   5.515
  675    HB   THR  96           HB       THR  96 -13.150  -3.599   7.220
  676    HG1  THR  96           HG1      THR  96 -11.922  -1.488   5.749
  677   HG21  THR  96          HG21      THR  96 -10.335  -2.746   6.621
  678   HG22  THR  96          HG22      THR  96 -10.752  -4.369   7.216
  679   HG23  THR  96          HG23      THR  96 -11.114  -2.943   8.198
  680    HA   PRO  97           HA       PRO  97 -15.929  -5.547   3.396
  681    HB2  PRO  97           HB2      PRO  97 -16.408  -7.851   4.892
  682    HB3  PRO  97           HB1      PRO  97 -15.707  -7.794   3.275
  683    HG2  PRO  97           HG2      PRO  97 -14.413  -8.190   5.894
  684    HG3  PRO  97           HG1      PRO  97 -13.911  -8.731   4.284
  685    HD2  PRO  97           HD2      PRO  97 -12.738  -6.679   5.627
  686    HD3  PRO  97           HD1      PRO  97 -12.755  -6.824   3.865
  687    H    SER  98           HN       SER  98 -18.129  -5.890   4.235
  688    HA   SER  98           HA       SER  98 -18.705  -3.973   6.195
  689    HB2  SER  98           HB2      SER  98 -20.569  -6.107   5.157
  690    HB3  SER  98           HB1      SER  98 -21.004  -4.522   5.795
  691    HG   SER  98           HG       SER  98 -20.846  -4.880   3.379
  692    H    ASN  99           HN       ASN  99 -17.819  -7.194   6.542
  693    HA   ASN  99           HA       ASN  99 -19.174  -7.561   9.089
  694    HB2  ASN  99           HB2      ASN  99 -17.655  -9.295   7.221
  695    HB3  ASN  99           HB1      ASN  99 -17.662  -9.730   8.924
  696   HD21  ASN  99          HD21      ASN  99 -18.826 -11.149   6.690
  697   HD22  ASN  99          HD22      ASN  99 -20.520 -11.280   7.018
  698    H    GLY 100           HN       GLY 100 -16.195  -6.443   7.901
  699    HA2  GLY 100           HA2      GLY 100 -14.391  -5.573   9.075
  700    HA3  GLY 100           HA1      GLY 100 -15.119  -6.159  10.565
  701    H    GLY 101           HN       GLY 101 -14.930  -8.366   8.041
  702    HA2  GLY 101           HA2      GLY 101 -13.158 -10.062   9.574
  703    HA3  GLY 101           HA1      GLY 101 -14.045 -10.513   8.125
  704    H    GLN 102           HN       GLN 102 -11.962 -11.553   7.594
  705    HA   GLN 102           HA       GLN 102  -9.584 -10.272   7.122
  706    HB2  GLN 102           HB2      GLN 102 -10.903 -12.530   5.643
  707    HB3  GLN 102           HB1      GLN 102  -9.311 -11.934   5.195
  708    HG2  GLN 102           HG2      GLN 102  -8.532 -12.407   7.490
  709    HG3  GLN 102           HG1      GLN 102 -10.111 -13.108   7.846
  710   HE21  GLN 102          HE21      GLN 102  -9.191 -15.123   8.277
  711   HE22  GLN 102          HE22      GLN 102  -8.599 -16.149   7.018
  712    H    ALA 103           HN       ALA 103  -8.882  -8.822   5.823
  713    HA   ALA 103           HA       ALA 103 -10.713  -7.425   4.052
  714    HB1  ALA 103           HB1      ALA 103  -9.285  -6.168   5.557
  715    HB2  ALA 103           HB2      ALA 103  -8.905  -5.803   3.869
  716    HB3  ALA 103           HB3      ALA 103  -7.847  -6.868   4.807
  717    H    THR 104           HN       THR 104 -10.239  -6.829   2.031
  718    HA   THR 104           HA       THR 104  -9.109  -8.854   0.356
  719    HB   THR 104           HB       THR 104 -10.941  -6.721   0.111
  720    HG1  THR 104           HG1      THR 104 -11.225  -8.829  -0.707
  721   HG21  THR 104          HG21      THR 104 -10.110  -5.247  -1.364
  722   HG22  THR 104          HG22      THR 104  -9.377  -6.527  -2.342
  723   HG23  THR 104          HG23      THR 104  -8.528  -5.901  -0.934
  724    H    VAL 105           HN       VAL 105  -7.147  -8.727  -0.711
  725    HA   VAL 105           HA       VAL 105  -5.503  -6.398  -0.037
  726    HB   VAL 105           HB       VAL 105  -4.620  -9.263   0.248
  727   HG11  VAL 105          HG11      VAL 105  -3.201  -6.667   0.761
  728   HG12  VAL 105          HG12      VAL 105  -2.769  -7.912  -0.406
  729   HG13  VAL 105          HG13      VAL 105  -2.619  -8.231   1.323
  730   HG21  VAL 105          HG21      VAL 105  -6.192  -8.568   2.022
  731   HG22  VAL 105          HG22      VAL 105  -5.132  -7.205   2.397
  732   HG23  VAL 105          HG23      VAL 105  -4.562  -8.857   2.644
  733    H    LEU 106           HN       LEU 106  -4.360  -5.628  -1.651
  734    HA   LEU 106           HA       LEU 106  -3.534  -7.429  -3.817
  735    HB2  LEU 106           HB2      LEU 106  -3.901  -4.461  -3.668
  736    HB3  LEU 106           HB1      LEU 106  -2.779  -5.135  -4.830
  737    HG   LEU 106           HG       LEU 106  -4.858  -4.716  -5.930
  738   HD11  LEU 106          HD11      LEU 106  -4.552  -7.671  -5.401
  739   HD12  LEU 106          HD12      LEU 106  -3.642  -6.728  -6.581
  740   HD13  LEU 106          HD13      LEU 106  -5.382  -6.939  -6.775
  741   HD21  LEU 106          HD21      LEU 106  -6.960  -5.813  -5.231
  742   HD22  LEU 106          HD22      LEU 106  -6.353  -4.721  -3.989
  743   HD23  LEU 106          HD23      LEU 106  -6.140  -6.462  -3.807
  744    H    THR 107           HN       THR 107  -1.615  -8.317  -3.387
  745    HA   THR 107           HA       THR 107   0.140  -6.870  -1.526
  746    HB   THR 107           HB       THR 107   0.380  -9.797  -2.161
  747    HG1  THR 107           HG1      THR 107  -1.746  -9.447  -1.427
  748   HG21  THR 107          HG21      THR 107   1.118  -8.167   0.284
  749   HG22  THR 107          HG22      THR 107   2.243  -8.712  -0.962
  750   HG23  THR 107          HG23      THR 107   1.409  -9.892   0.050
  751    H    TYR 108           HN       TYR 108   2.265  -6.626  -1.853
  752    HA   TYR 108           HA       TYR 108   3.542  -7.808  -4.196
  753    HB2  TYR 108           HB2      TYR 108   3.264  -5.686  -5.104
  754    HB3  TYR 108           HB1      TYR 108   3.312  -4.902  -3.544
  755    HD1  TYR 108           HD1      TYR 108   5.292  -4.005  -2.690
  756    HD2  TYR 108           HD2      TYR 108   5.443  -6.506  -6.123
  757    HE1  TYR 108           HE1      TYR 108   7.620  -3.354  -3.042
  758    HE2  TYR 108           HE2      TYR 108   7.796  -5.877  -6.482
  759    HH   TYR 108           HH       TYR 108   9.671  -4.366  -4.174
  760    H    ASP 109           HN       ASP 109   5.646  -8.425  -3.790
  761    HA   ASP 109           HA       ASP 109   6.493  -8.186  -1.003
  762    HB2  ASP 109           HB2      ASP 109   7.974 -10.160  -1.661
  763    HB3  ASP 109           HB1      ASP 109   6.254 -10.473  -1.541
  764    H    TRP 110           HN       TRP 110   8.134  -6.893  -0.570
  765    HA   TRP 110           HA       TRP 110   9.915  -6.060  -2.724
  766    HB2  TRP 110           HB2      TRP 110   9.309  -4.186  -1.481
  767    HB3  TRP 110           HB1      TRP 110   9.388  -5.038   0.052
  768    HD1  TRP 110           HD1      TRP 110  11.687  -3.471  -2.598
  769    HE1  TRP 110           HE1      TRP 110  13.939  -2.891  -1.495
  770    HE3  TRP 110           HE3      TRP 110  10.904  -5.579   1.975
  771    HZ2  TRP 110           HZ2      TRP 110  15.207  -3.286   1.004
  772    HZ3  TRP 110           HZ3      TRP 110  12.676  -5.438   3.674
  773    HH2  TRP 110           HH2      TRP 110  14.793  -4.315   3.200
  774    H    SER 111           HN       SER 111   9.969  -7.719   0.371
  775    HA   SER 111           HA       SER 111  12.776  -8.057   0.504
  776    HB2  SER 111           HB2      SER 111  11.275  -8.173   2.470
  777    HB3  SER 111           HB1      SER 111  10.614  -9.678   1.849
  778    HG   SER 111           HG       SER 111  12.746  -9.364   3.365
  779    H    ALA 112           HN       ALA 112  10.207  -9.825  -1.001
  780    HA   ALA 112           HA       ALA 112  12.041 -12.025  -1.650
  781    HB1  ALA 112           HB1      ALA 112   9.983 -12.650  -0.469
  782    HB2  ALA 112           HB2      ALA 112  10.067 -13.363  -2.080
  783    HB3  ALA 112           HB3      ALA 112   9.037 -11.960  -1.789
  784    H    ASN 113           HN       ASN 113  11.403  -9.278  -2.964
  785    HA   ASN 113           HA       ASN 113  10.321  -9.952  -5.520
  786    HB2  ASN 113           HB2      ASN 113  10.156  -7.666  -4.520
  787    HB3  ASN 113           HB1      ASN 113  11.885  -7.468  -4.800
  788   HD21  ASN 113          HD21      ASN 113  11.593  -5.754  -6.214
  789   HD22  ASN 113          HD22      ASN 113  10.944  -5.961  -7.805
  790    H    GLY 114           HN       GLY 114  11.494 -11.518  -6.495
  791    HA2  GLY 114           HA2      GLY 114  13.014 -11.913  -8.258
  792    HA3  GLY 114           HA1      GLY 114  13.998 -10.579  -7.675
  793    H    VAL 115           HN       VAL 115  12.897 -12.719  -5.284
  794    HA   VAL 115           HA       VAL 115  15.224 -14.458  -5.426
  795    HB   VAL 115           HB       VAL 115  15.949 -12.414  -4.164
  796   HG11  VAL 115          HG11      VAL 115  13.855 -11.844  -3.088
  797   HG12  VAL 115          HG12      VAL 115  15.124 -12.075  -1.885
  798   HG13  VAL 115          HG13      VAL 115  13.914 -13.332  -2.143
  799   HG21  VAL 115          HG21      VAL 115  15.873 -14.995  -2.611
  800   HG22  VAL 115          HG22      VAL 115  16.954 -13.640  -2.284
  801   HG23  VAL 115          HG23      VAL 115  17.079 -14.518  -3.806
  802    H    ASN 116           HN       ASN 116  15.010 -16.311  -4.016
  803    HA   ASN 116           HA       ASN 116  12.271 -17.137  -3.776
  804    HB2  ASN 116           HB2      ASN 116  14.104 -18.647  -4.534
  805    HB3  ASN 116           HB1      ASN 116  14.779 -18.592  -2.911
  806   HD21  ASN 116          HD21      ASN 116  11.346 -18.716  -3.661
  807   HD22  ASN 116          HD22      ASN 116  11.079 -20.289  -2.999
  808    H    SER 117           HN       SER 117  12.198 -15.129  -2.186
  809    HA   SER 117           HA       SER 117  11.780 -14.335  -0.102
  810    HB2  SER 117           HB2      SER 117  11.192 -17.251   0.462
  811    HB3  SER 117           HB1      SER 117  10.617 -15.875   1.406
  812    HG   SER 117           HG       SER 117  10.091 -15.974  -1.357
  813    H    ASN 118           HN       ASN 118  14.512 -14.860  -0.582
  814    HA   ASN 118           HA       ASN 118  15.556 -16.179   1.781
  815    HB2  ASN 118           HB2      ASN 118  16.673 -16.511  -0.399
  816    HB3  ASN 118           HB1      ASN 118  17.033 -14.788  -0.463
  817   HD21  ASN 118          HD21      ASN 118  17.162 -16.783   2.422
  818   HD22  ASN 118          HD22      ASN 118  18.873 -16.676   2.644
  Start of MODEL    3
    1    H1   HIS   6           HT1      HIS   6 -20.731  -3.412  -7.434
    2    H2   HIS   6           HT2      HIS   6 -21.008  -3.882  -5.836
    3    H3   HIS   6           HT3      HIS   6 -21.930  -4.549  -7.081
    4    HA   HIS   6           HA       HIS   6 -20.267  -6.115  -6.312
    5    HB2  HIS   6           HB2      HIS   6 -19.799  -4.995  -9.082
    6    HB3  HIS   6           HB1      HIS   6 -19.157  -6.533  -8.518
    7    HD1  HIS   6           HD1      HIS   6 -21.876  -5.243 -10.393
    8    HD2  HIS   6           HD2      HIS   6 -21.465  -8.253  -7.553
    9    HE1  HIS   6           HE1      HIS   6 -23.900  -6.710 -10.661
   10    HE2  HIS   6           HE2      HIS   6 -23.706  -8.425  -8.826
   11    H    GLN   7           HN       GLN   7 -19.323  -4.226  -4.793
   12    HA   GLN   7           HA       GLN   7 -16.902  -3.044  -5.671
   13    HB2  GLN   7           HB2      GLN   7 -18.096  -1.972  -3.921
   14    HB3  GLN   7           HB1      GLN   7 -18.075  -3.434  -2.950
   15    HG2  GLN   7           HG2      GLN   7 -15.608  -3.251  -2.813
   16    HG3  GLN   7           HG1      GLN   7 -15.725  -1.688  -3.631
   17   HE21  GLN   7          HE21      GLN   7 -16.667   0.048  -2.536
   18   HE22  GLN   7          HE22      GLN   7 -16.882   0.046  -0.822
   19    H    ASP   8           HN       ASP   8 -17.687  -6.049  -4.036
   20    HA   ASP   8           HA       ASP   8 -15.182  -6.679  -3.024
   21    HB2  ASP   8           HB2      ASP   8 -17.132  -8.016  -2.502
   22    HB3  ASP   8           HB1      ASP   8 -17.275  -8.526  -4.178
   23    H    ASN   9           HN       ASN   9 -16.499  -7.169  -6.247
   24    HA   ASN   9           HA       ASN   9 -14.078  -8.231  -7.357
   25    HB2  ASN   9           HB2      ASN   9 -16.655  -7.175  -8.487
   26    HB3  ASN   9           HB1      ASN   9 -15.281  -7.506  -9.548
   27   HD21  ASN   9          HD21      ASN   9 -14.575  -9.643  -9.800
   28   HD22  ASN   9          HD22      ASN   9 -15.585 -10.987  -9.396
   29    H    ALA  10           HN       ALA  10 -15.559  -5.092  -7.030
   30    HA   ALA  10           HA       ALA  10 -13.969  -3.663  -8.856
   31    HB1  ALA  10           HB1      ALA  10 -16.070  -2.805  -7.931
   32    HB2  ALA  10           HB2      ALA  10 -14.725  -1.670  -7.734
   33    HB3  ALA  10           HB3      ALA  10 -15.287  -2.626  -6.356
   34    H    ARG  11           HN       ARG  11 -13.654  -4.097  -5.344
   35    HA   ARG  11           HA       ARG  11 -11.536  -2.439  -4.797
   36    HB2  ARG  11           HB2      ARG  11 -11.898  -5.222  -3.699
   37    HB3  ARG  11           HB1      ARG  11 -10.940  -3.945  -2.976
   38    HG2  ARG  11           HG2      ARG  11 -12.810  -2.795  -2.265
   39    HG3  ARG  11           HG1      ARG  11 -13.862  -3.579  -3.452
   40    HD2  ARG  11           HD2      ARG  11 -13.390  -5.744  -2.258
   41    HD3  ARG  11           HD1      ARG  11 -12.639  -4.786  -0.983
   42    HE   ARG  11           HE       ARG  11 -15.080  -3.663  -1.191
   43   HH11  ARG  11          HH11      ARG  11 -13.983  -6.963  -0.813
   44   HH12  ARG  11          HH12      ARG  11 -15.417  -7.482   0.015
   45   HH21  ARG  11          HH21      ARG  11 -16.979  -4.335  -0.119
   46   HH22  ARG  11          HH22      ARG  11 -17.130  -5.984   0.407
   47    H    LYS  12           HN       LYS  12 -11.391  -5.812  -5.803
   48    HA   LYS  12           HA       LYS  12  -8.667  -6.172  -5.913
   49    HB2  LYS  12           HB2      LYS  12 -10.494  -7.876  -6.295
   50    HB3  LYS  12           HB1      LYS  12 -10.585  -7.294  -7.950
   51    HG2  LYS  12           HG2      LYS  12  -9.216  -9.138  -8.080
   52    HG3  LYS  12           HG1      LYS  12  -8.073  -7.800  -8.018
   53    HD2  LYS  12           HD2      LYS  12  -7.898  -8.157  -5.556
   54    HD3  LYS  12           HD1      LYS  12  -8.895  -9.602  -5.747
   55    HE2  LYS  12           HE2      LYS  12  -7.240 -10.532  -7.282
   56    HE3  LYS  12           HE1      LYS  12  -6.265  -9.080  -7.082
   57    HZ1  LYS  12           HZ1      LYS  12  -5.521 -10.978  -5.706
   58    HZ2  LYS  12           HZ2      LYS  12  -6.987 -10.912  -4.864
   59    HZ3  LYS  12           HZ3      LYS  12  -5.912  -9.611  -4.792
   60    H    SER  13           HN       SER  13 -10.765  -4.591  -8.259
   61    HA   SER  13           HA       SER  13  -8.563  -4.240 -10.132
   62    HB2  SER  13           HB2      SER  13 -10.816  -4.721 -10.982
   63    HB3  SER  13           HB1      SER  13 -11.437  -3.267 -10.201
   64    HG   SER  13           HG       SER  13 -10.561  -3.426 -12.613
   65    H    ARG  14           HN       ARG  14 -10.702  -2.131  -8.231
   66    HA   ARG  14           HA       ARG  14  -9.574   0.289  -9.066
   67    HB2  ARG  14           HB2      ARG  14 -10.747   1.287  -7.140
   68    HB3  ARG  14           HB1      ARG  14 -11.786   0.197  -8.052
   69    HG2  ARG  14           HG2      ARG  14 -12.274  -0.828  -6.146
   70    HG3  ARG  14           HG1      ARG  14 -10.592  -1.371  -6.095
   71    HD2  ARG  14           HD2      ARG  14 -11.733  -0.001  -4.126
   72    HD3  ARG  14           HD1      ARG  14 -10.014   0.093  -4.492
   73    HE   ARG  14           HE       ARG  14 -10.539   2.172  -5.734
   74   HH11  ARG  14          HH11      ARG  14 -12.928   1.025  -3.448
   75   HH12  ARG  14          HH12      ARG  14 -13.492   2.614  -3.045
   76   HH21  ARG  14          HH21      ARG  14 -11.305   4.269  -5.217
   77   HH22  ARG  14          HH22      ARG  14 -12.593   4.455  -4.067
   78    H    ILE  15           HN       ILE  15  -8.746  -1.829  -6.365
   79    HA   ILE  15           HA       ILE  15  -6.962   0.070  -5.202
   80    HB   ILE  15           HB       ILE  15  -7.130  -2.908  -4.823
   81   HG12  ILE  15          HG12      ILE  15  -8.284  -0.711  -3.099
   82   HG13  ILE  15          HG11      ILE  15  -9.214  -1.648  -4.269
   83   HG21  ILE  15          HG21      ILE  15  -5.910  -2.532  -2.759
   84   HG22  ILE  15          HG22      ILE  15  -5.859  -0.797  -3.085
   85   HG23  ILE  15          HG23      ILE  15  -4.982  -1.917  -4.133
   86   HD11  ILE  15          HD11      ILE  15  -9.597  -2.622  -2.179
   87   HD12  ILE  15          HD12      ILE  15  -7.880  -2.613  -1.772
   88   HD13  ILE  15          HD13      ILE  15  -8.486  -3.696  -3.033
   89    H    GLN  16           HN       GLN  16  -6.737  -2.789  -7.242
   90    HA   GLN  16           HA       GLN  16  -4.053  -3.282  -7.265
   91    HB2  GLN  16           HB2      GLN  16  -6.188  -4.294  -8.508
   92    HB3  GLN  16           HB1      GLN  16  -5.408  -3.485  -9.856
   93    HG2  GLN  16           HG2      GLN  16  -3.983  -5.381  -8.040
   94    HG3  GLN  16           HG1      GLN  16  -4.804  -5.897  -9.512
   95   HE21  GLN  16          HE21      GLN  16  -3.992  -5.147 -11.522
   96   HE22  GLN  16          HE22      GLN  16  -2.348  -4.634 -11.682
   97    H    SER  17           HN       SER  17  -5.801  -1.025  -9.371
   98    HA   SER  17           HA       SER  17  -3.692  -0.236 -10.992
   99    HB2  SER  17           HB2      SER  17  -5.903   1.557  -9.962
  100    HB3  SER  17           HB1      SER  17  -4.979   1.769 -11.450
  101    HG   SER  17           HG       SER  17  -6.005  -0.686 -11.465
  102    H    GLU  18           HN       GLU  18  -4.716   1.182  -7.895
  103    HA   GLU  18           HA       GLU  18  -2.514   2.972  -7.670
  104    HB2  GLU  18           HB2      GLU  18  -4.325   1.818  -5.565
  105    HB3  GLU  18           HB1      GLU  18  -3.244   3.183  -5.354
  106    HG2  GLU  18           HG2      GLU  18  -4.520   4.564  -6.657
  107    HG3  GLU  18           HG1      GLU  18  -5.307   3.228  -7.487
  108    H    HIS  19           HN       HIS  19  -3.235  -0.245  -6.400
  109    HA   HIS  19           HA       HIS  19  -1.261  -0.685  -4.584
  110    HB2  HIS  19           HB2      HIS  19  -2.739  -2.471  -4.900
  111    HB3  HIS  19           HB1      HIS  19  -2.518  -2.491  -6.639
  112    HD1  HIS  19           HD1      HIS  19  -0.162  -3.027  -3.679
  113    HD2  HIS  19           HD2      HIS  19  -1.208  -4.706  -7.329
  114    HE1  HIS  19           HE1      HIS  19   1.311  -5.044  -3.937
  115    HE2  HIS  19           HE2      HIS  19   0.755  -5.972  -6.213
  116    H    ARG  20           HN       ARG  20  -0.914  -1.242  -8.082
  117    HA   ARG  20           HA       ARG  20   1.785  -1.837  -8.138
  118    HB2  ARG  20           HB2      ARG  20   0.120  -0.329 -10.154
  119    HB3  ARG  20           HB1      ARG  20   1.696  -1.044 -10.480
  120    HG2  ARG  20           HG2      ARG  20  -0.533  -2.696  -9.390
  121    HG3  ARG  20           HG1      ARG  20  -0.418  -2.358 -11.121
  122    HD2  ARG  20           HD2      ARG  20   1.772  -3.368 -11.203
  123    HD3  ARG  20           HD1      ARG  20   1.780  -3.572  -9.451
  124    HE   ARG  20           HE       ARG  20  -0.422  -4.938 -10.220
  125   HH11  ARG  20          HH11      ARG  20   2.924  -5.001 -11.235
  126   HH12  ARG  20          HH12      ARG  20   2.904  -6.685 -11.651
  127   HH21  ARG  20          HH21      ARG  20  -0.459  -7.162 -10.766
  128   HH22  ARG  20          HH22      ARG  20   0.974  -7.915 -11.388
  129    H    GLU  21           HN       GLU  21   0.205   1.321  -8.334
  130    HA   GLU  21           HA       GLU  21   2.423   2.976  -8.648
  131    HB2  GLU  21           HB2      GLU  21  -0.025   3.618  -6.990
  132    HB3  GLU  21           HB1      GLU  21   1.025   4.757  -7.816
  133    HG2  GLU  21           HG2      GLU  21  -0.620   2.709  -9.231
  134    HG3  GLU  21           HG1      GLU  21  -1.209   4.330  -8.891
  135    H    LEU  22           HN       LEU  22   0.843   1.871  -5.659
  136    HA   LEU  22           HA       LEU  22   2.494   3.333  -3.915
  137    HB2  LEU  22           HB2      LEU  22   0.688   0.980  -3.509
  138    HB3  LEU  22           HB1      LEU  22   1.712   1.550  -2.207
  139    HG   LEU  22           HG       LEU  22  -0.363   2.570  -1.811
  140   HD11  LEU  22          HD11      LEU  22   1.195   4.625  -3.382
  141   HD12  LEU  22          HD12      LEU  22   1.572   4.119  -1.733
  142   HD13  LEU  22          HD13      LEU  22   0.044   4.925  -2.082
  143   HD21  LEU  22          HD21      LEU  22  -1.651   3.755  -3.496
  144   HD22  LEU  22          HD22      LEU  22  -1.405   2.068  -3.947
  145   HD23  LEU  22          HD23      LEU  22  -0.456   3.337  -4.721
  146    H    VAL  23           HN       VAL  23   2.898   0.101  -5.303
  147    HA   VAL  23           HA       VAL  23   5.166  -0.392  -3.613
  148    HB   VAL  23           HB       VAL  23   4.833  -2.484  -4.116
  149   HG11  VAL  23          HG11      VAL  23   2.493  -1.780  -4.628
  150   HG12  VAL  23          HG12      VAL  23   3.012  -3.269  -5.424
  151   HG13  VAL  23          HG13      VAL  23   2.945  -1.760  -6.333
  152   HG21  VAL  23          HG21      VAL  23   5.384  -1.722  -6.957
  153   HG22  VAL  23          HG22      VAL  23   5.326  -3.378  -6.346
  154   HG23  VAL  23          HG23      VAL  23   6.559  -2.259  -5.744
  155    H    SER  24           HN       SER  24   4.623   0.697  -6.923
  156    HA   SER  24           HA       SER  24   7.313   0.934  -7.681
  157    HB2  SER  24           HB2      SER  24   5.343   1.353  -9.184
  158    HB3  SER  24           HB1      SER  24   5.073   2.875  -8.333
  159    HG   SER  24           HG       SER  24   6.365   3.585  -9.858
  160    H    ALA  25           HN       ALA  25   5.301   2.683  -5.500
  161    HA   ALA  25           HA       ALA  25   7.112   4.891  -5.098
  162    HB1  ALA  25           HB1      ALA  25   4.944   4.045  -3.209
  163    HB2  ALA  25           HB2      ALA  25   4.580   4.909  -4.710
  164    HB3  ALA  25           HB3      ALA  25   5.603   5.663  -3.472
  165    H    ILE  26           HN       ILE  26   6.345   1.833  -3.448
  166    HA   ILE  26           HA       ILE  26   7.985   2.160  -1.234
  167    HB   ILE  26           HB       ILE  26   6.754  -0.160  -2.598
  168   HG12  ILE  26          HG12      ILE  26   7.152   0.763   0.231
  169   HG13  ILE  26          HG11      ILE  26   5.672   0.822  -0.722
  170   HG21  ILE  26          HG21      ILE  26   8.041  -1.844  -1.419
  171   HG22  ILE  26          HG22      ILE  26   9.112  -0.601  -0.776
  172   HG23  ILE  26          HG23      ILE  26   9.090  -0.933  -2.508
  173   HD11  ILE  26          HD11      ILE  26   5.697  -0.960   0.983
  174   HD12  ILE  26          HD12      ILE  26   7.053  -1.703   0.123
  175   HD13  ILE  26          HD13      ILE  26   5.488  -1.551  -0.674
  176    H    GLN  27           HN       GLN  27   8.696   0.813  -4.412
  177    HA   GLN  27           HA       GLN  27  11.371   0.156  -3.925
  178    HB2  GLN  27           HB2      GLN  27  10.019   0.933  -6.513
  179    HB3  GLN  27           HB1      GLN  27  11.592   0.146  -6.390
  180    HG2  GLN  27           HG2      GLN  27  10.452  -1.734  -5.212
  181    HG3  GLN  27           HG1      GLN  27   8.924  -0.950  -5.569
  182   HE21  GLN  27          HE21      GLN  27   8.216  -2.673  -6.819
  183   HE22  GLN  27          HE22      GLN  27   8.858  -3.007  -8.387
  184    H    SER  28           HN       SER  28   9.829   3.164  -4.760
  185    HA   SER  28           HA       SER  28  12.234   4.605  -5.333
  186    HB2  SER  28           HB2      SER  28   9.866   5.225  -6.075
  187    HB3  SER  28           HB1      SER  28   9.612   5.763  -4.426
  188    HG   SER  28           HG       SER  28  11.342   6.805  -6.384
  189    H    TYR  29           HN       TYR  29   9.938   4.677  -2.609
  190    HA   TYR  29           HA       TYR  29  11.246   6.276  -0.809
  191    HB2  TYR  29           HB2      TYR  29   8.976   5.295  -0.554
  192    HB3  TYR  29           HB1      TYR  29   9.704   3.735  -0.219
  193    HD1  TYR  29           HD1      TYR  29   7.757   4.684   1.598
  194    HD2  TYR  29           HD2      TYR  29  11.903   5.648   1.500
  195    HE1  TYR  29           HE1      TYR  29   7.693   5.149   4.018
  196    HE2  TYR  29           HE2      TYR  29  11.844   6.113   3.910
  197    HH   TYR  29           HH       TYR  29   9.204   5.264   5.905
  198    H    ILE  30           HN       ILE  30  11.504   2.752  -1.075
  199    HA   ILE  30           HA       ILE  30  13.407   2.445   0.953
  200    HB   ILE  30           HB       ILE  30  12.668   0.686  -1.368
  201   HG12  ILE  30          HG12      ILE  30  11.853   0.769   1.542
  202   HG13  ILE  30          HG11      ILE  30  10.855   1.175   0.156
  203   HG21  ILE  30          HG21      ILE  30  14.857   0.030  -0.689
  204   HG22  ILE  30          HG22      ILE  30  13.712  -1.141  -0.025
  205   HG23  ILE  30          HG23      ILE  30  14.412   0.103   1.012
  206   HD11  ILE  30          HD11      ILE  30  10.225  -0.963   0.974
  207   HD12  ILE  30          HD12      ILE  30  11.893  -1.538   0.896
  208   HD13  ILE  30          HD13      ILE  30  11.018  -1.163  -0.590
  209    H    GLY  31           HN       GLY  31  13.780   2.865  -2.539
  210    HA2  GLY  31           HA2      GLY  31  16.580   2.332  -2.568
  211    HA3  GLY  31           HA1      GLY  31  15.667   3.152  -3.831
  212    H    ALA  32           HN       ALA  32  14.676   5.017  -1.649
  213    HA   ALA  32           HA       ALA  32  16.844   6.945  -1.901
  214    HB1  ALA  32           HB1      ALA  32  14.125   7.316  -0.675
  215    HB2  ALA  32           HB2      ALA  32  14.452   7.506  -2.400
  216    HB3  ALA  32           HB3      ALA  32  15.233   8.573  -1.228
  217    H    GLN  33           HN       GLN  33  15.386   4.861   0.398
  218    HA   GLN  33           HA       GLN  33  15.730   6.164   2.765
  219    HB2  GLN  33           HB2      GLN  33  15.599   3.333   1.942
  220    HB3  GLN  33           HB1      GLN  33  16.065   3.707   3.600
  221    HG2  GLN  33           HG2      GLN  33  13.733   5.120   2.513
  222    HG3  GLN  33           HG1      GLN  33  13.556   3.407   2.846
  223   HE21  GLN  33          HE21      GLN  33  12.144   3.792   4.596
  224   HE22  GLN  33          HE22      GLN  33  12.684   4.472   6.096
  225    H    ASP  34           HN       ASP  34  17.118   5.798   4.480
  226    HA   ASP  34           HA       ASP  34  19.851   6.145   3.969
  227    HB2  ASP  34           HB2      ASP  34  18.605   6.932   5.972
  228    HB3  ASP  34           HB1      ASP  34  18.533   5.268   6.524
  229    H    ASP  35           HN       ASP  35  17.882   3.448   4.702
  230    HA   ASP  35           HA       ASP  35  20.024   1.657   3.871
  231    HB2  ASP  35           HB2      ASP  35  20.113   1.574   6.305
  232    HB3  ASP  35           HB1      ASP  35  18.399   1.172   6.383
  233    HA   PRO  36           HA       PRO  36  16.299   0.583   1.565
  234    HB2  PRO  36           HB2      PRO  36  17.580  -0.408  -0.540
  235    HB3  PRO  36           HB1      PRO  36  17.635   1.319  -0.219
  236    HG2  PRO  36           HG2      PRO  36  19.606  -0.778   0.633
  237    HG3  PRO  36           HG1      PRO  36  19.931   0.655  -0.355
  238    HD2  PRO  36           HD2      PRO  36  20.355   0.769   2.255
  239    HD3  PRO  36           HD1      PRO  36  19.530   2.106   1.421
  240    H    THR  37           HN       THR  37  18.452  -1.171   3.259
  241    HA   THR  37           HA       THR  37  17.814  -3.759   2.157
  242    HB   THR  37           HB       THR  37  19.649  -4.536   3.249
  243    HG1  THR  37           HG1      THR  37  19.255  -2.651   5.357
  244   HG21  THR  37          HG21      THR  37  21.394  -2.934   3.255
  245   HG22  THR  37          HG22      THR  37  20.276  -1.618   3.641
  246   HG23  THR  37          HG23      THR  37  20.233  -2.378   2.040
  247    H    ASN  38           HN       ASN  38  17.115  -1.746   4.832
  248    HA   ASN  38           HA       ASN  38  14.754  -3.275   5.504
  249    HB2  ASN  38           HB2      ASN  38  16.734  -4.249   6.767
  250    HB3  ASN  38           HB1      ASN  38  16.798  -2.724   7.650
  251   HD21  ASN  38          HD21      ASN  38  15.173  -2.239   9.118
  252   HD22  ASN  38          HD22      ASN  38  14.061  -3.429   9.699
  253    HA   PRO  39           HA       PRO  39  14.646   1.433   5.944
  254    HB2  PRO  39           HB2      PRO  39  12.348   1.660   4.451
  255    HB3  PRO  39           HB1      PRO  39  13.988   1.890   3.842
  256    HG2  PRO  39           HG2      PRO  39  12.220  -0.493   3.630
  257    HG3  PRO  39           HG1      PRO  39  13.348   0.180   2.462
  258    HD2  PRO  39           HD2      PRO  39  13.928  -1.998   3.887
  259    HD3  PRO  39           HD1      PRO  39  15.159  -0.828   3.409
  260    H    SER  40           HN       SER  40  12.670   2.721   6.567
  261    HA   SER  40           HA       SER  40  11.510   1.638   8.896
  262    HB2  SER  40           HB2      SER  40  10.234   3.990   7.604
  263    HB3  SER  40           HB1      SER  40  10.787   3.779   9.267
  264    HG   SER  40           HG       SER  40  12.839   4.257   8.671
  265    H    GLU  41           HN       GLU  41   9.070   1.829   9.267
  266    HA   GLU  41           HA       GLU  41   7.628   0.157   7.519
  267    HB2  GLU  41           HB2      GLU  41   6.855   0.096   9.700
  268    HB3  GLU  41           HB1      GLU  41   7.020   1.828   9.918
  269    HG2  GLU  41           HG2      GLU  41   5.086   2.196   8.545
  270    HG3  GLU  41           HG1      GLU  41   4.884   0.463   8.309
  271    H    ILE  42           HN       ILE  42   6.277   0.600   5.895
  272    HA   ILE  42           HA       ILE  42   6.498   3.320   4.871
  273    HB   ILE  42           HB       ILE  42   6.299   0.641   3.557
  274   HG12  ILE  42          HG12      ILE  42   8.308   2.866   3.718
  275   HG13  ILE  42          HG11      ILE  42   8.512   1.162   4.102
  276   HG21  ILE  42          HG21      ILE  42   4.764   2.264   2.473
  277   HG22  ILE  42          HG22      ILE  42   6.060   1.680   1.437
  278   HG23  ILE  42          HG23      ILE  42   6.162   3.289   2.146
  279   HD11  ILE  42          HD11      ILE  42   9.677   1.746   2.081
  280   HD12  ILE  42          HD12      ILE  42   8.174   2.339   1.373
  281   HD13  ILE  42          HD13      ILE  42   8.362   0.621   1.739
  282    H    THR  43           HN       THR  43   4.751   4.505   4.487
  283    HA   THR  43           HA       THR  43   2.155   3.169   4.256
  284    HB   THR  43           HB       THR  43   1.094   4.971   5.565
  285    HG1  THR  43           HG1      THR  43   2.531   6.260   6.882
  286   HG21  THR  43          HG21      THR  43   3.255   3.478   7.062
  287   HG22  THR  43          HG22      THR  43   1.666   2.835   6.635
  288   HG23  THR  43          HG23      THR  43   1.797   4.178   7.772
  289    H    LEU  44           HN       LEU  44   0.466   4.760   3.486
  290    HA   LEU  44           HA       LEU  44   1.298   5.668   0.961
  291    HB2  LEU  44           HB2      LEU  44  -1.191   6.404   2.431
  292    HB3  LEU  44           HB1      LEU  44  -0.930   6.481   0.717
  293    HG   LEU  44           HG       LEU  44  -1.298   4.090   2.429
  294   HD11  LEU  44          HD11      LEU  44  -2.576   4.378  -0.185
  295   HD12  LEU  44          HD12      LEU  44  -3.048   5.559   1.032
  296   HD13  LEU  44          HD13      LEU  44  -3.241   3.840   1.355
  297   HD21  LEU  44          HD21      LEU  44  -0.635   2.685   0.562
  298   HD22  LEU  44          HD22      LEU  44   0.700   3.717   1.055
  299   HD23  LEU  44          HD23      LEU  44  -0.235   4.113  -0.383
  300    H    ALA  45           HN       ALA  45   0.638   7.225   3.972
  301    HA   ALA  45           HA       ALA  45   0.768   9.893   3.094
  302    HB1  ALA  45           HB1      ALA  45  -0.305   9.263   5.166
  303    HB2  ALA  45           HB2      ALA  45   1.021  10.391   5.502
  304    HB3  ALA  45           HB3      ALA  45   1.241   8.663   5.808
  305    H    LYS  46           HN       LYS  46   3.167   7.526   3.836
  306    HA   LYS  46           HA       LYS  46   5.389   9.384   3.849
  307    HB2  LYS  46           HB2      LYS  46   5.186   6.403   3.975
  308    HB3  LYS  46           HB1      LYS  46   6.695   7.268   4.038
  309    HG2  LYS  46           HG2      LYS  46   6.054   8.325   6.098
  310    HG3  LYS  46           HG1      LYS  46   4.456   7.577   6.006
  311    HD2  LYS  46           HD2      LYS  46   5.628   5.349   5.997
  312    HD3  LYS  46           HD1      LYS  46   7.113   6.224   6.397
  313    HE2  LYS  46           HE2      LYS  46   4.558   6.215   7.980
  314    HE3  LYS  46           HE1      LYS  46   6.040   5.328   8.376
  315    HZ1  LYS  46           HZ1      LYS  46   5.855   7.379   9.656
  316    HZ2  LYS  46           HZ2      LYS  46   5.785   8.287   8.233
  317    HZ3  LYS  46           HZ3      LYS  46   7.193   7.438   8.621
  318    H    LEU  47           HN       LEU  47   3.884   7.025   1.745
  319    HA   LEU  47           HA       LEU  47   5.956   6.990  -0.200
  320    HB2  LEU  47           HB2      LEU  47   3.122   6.003  -0.122
  321    HB3  LEU  47           HB1      LEU  47   4.107   5.863  -1.569
  322    HG   LEU  47           HG       LEU  47   4.720   4.642   1.120
  323   HD11  LEU  47          HD11      LEU  47   3.819   3.395  -1.470
  324   HD12  LEU  47          HD12      LEU  47   2.860   3.558   0.001
  325   HD13  LEU  47          HD13      LEU  47   4.285   2.519  -0.011
  326   HD21  LEU  47          HD21      LEU  47   6.761   5.245  -0.047
  327   HD22  LEU  47          HD22      LEU  47   6.185   4.448  -1.510
  328   HD23  LEU  47          HD23      LEU  47   6.541   3.497  -0.068
  329    H    ALA  48           HN       ALA  48   3.643   9.243   0.558
  330    HA   ALA  48           HA       ALA  48   2.468  10.202  -1.665
  331    HB1  ALA  48           HB1      ALA  48   3.776  12.110   0.230
  332    HB2  ALA  48           HB2      ALA  48   2.421  11.097   0.727
  333    HB3  ALA  48           HB3      ALA  48   2.223  12.249  -0.593
  334    HA   PRO  49           HA       PRO  49   6.245  12.987  -2.909
  335    HB2  PRO  49           HB2      PRO  49   8.501  11.541  -1.653
  336    HB3  PRO  49           HB1      PRO  49   8.188  13.268  -1.734
  337    HG2  PRO  49           HG2      PRO  49   7.882  11.995   0.554
  338    HG3  PRO  49           HG1      PRO  49   6.675  13.196   0.050
  339    HD2  PRO  49           HD2      PRO  49   6.590  10.220  -0.232
  340    HD3  PRO  49           HD1      PRO  49   5.357  11.299   0.439
  341    H    TYR  50           HN       TYR  50   6.316   9.560  -2.734
  342    HA   TYR  50           HA       TYR  50   8.157   9.323  -4.999
  343    HB2  TYR  50           HB2      TYR  50   7.034   7.135  -3.258
  344    HB3  TYR  50           HB1      TYR  50   8.365   7.020  -4.389
  345    HD1  TYR  50           HD1      TYR  50  10.520   8.200  -3.882
  346    HD2  TYR  50           HD2      TYR  50   7.362   7.918  -1.056
  347    HE1  TYR  50           HE1      TYR  50  12.087   8.805  -2.080
  348    HE2  TYR  50           HE2      TYR  50   8.913   8.514   0.756
  349    HH   TYR  50           HH       TYR  50  12.030   9.759   0.173
  350    H    MET  51           HN       MET  51   4.887   9.448  -4.381
  351    HA   MET  51           HA       MET  51   4.021   7.587  -6.402
  352    HB2  MET  51           HB2      MET  51   2.500   9.796  -5.029
  353    HB3  MET  51           HB1      MET  51   1.797   8.500  -5.986
  354    HG2  MET  51           HG2      MET  51   3.256   8.218  -3.375
  355    HG3  MET  51           HG1      MET  51   1.519   8.056  -3.646
  356    HE1  MET  51           HE1      MET  51   0.460   5.945  -5.075
  357    HE2  MET  51           HE2      MET  51   1.524   4.830  -5.937
  358    HE3  MET  51           HE3      MET  51   1.482   6.534  -6.387
  359    H    SER  52           HN       SER  52   2.359   8.653  -8.098
  360    HA   SER  52           HA       SER  52   3.604  11.023  -9.243
  361    HB2  SER  52           HB2      SER  52   4.986   9.176 -10.034
  362    HB3  SER  52           HB1      SER  52   3.558   8.358 -10.666
  363    HG   SER  52           HG       SER  52   5.085  10.130 -11.883
  364    H    LYS  53           HN       LYS  53   1.000   8.618  -9.500
  365    HA   LYS  53           HA       LYS  53  -0.005   9.523 -11.918
  366    HB2  LYS  53           HB2      LYS  53  -1.679   7.988 -11.688
  367    HB3  LYS  53           HB1      LYS  53  -0.442   7.319 -10.656
  368    HG2  LYS  53           HG2      LYS  53  -2.560   9.069  -9.499
  369    HG3  LYS  53           HG1      LYS  53  -2.920   7.391  -9.883
  370    HD2  LYS  53           HD2      LYS  53  -0.945   6.744  -8.462
  371    HD3  LYS  53           HD1      LYS  53  -0.851   8.445  -7.950
  372    HE2  LYS  53           HE2      LYS  53  -2.166   6.815  -6.465
  373    HE3  LYS  53           HE1      LYS  53  -2.927   8.361  -6.874
  374    HZ1  LYS  53           HZ1      LYS  53  -3.450   5.748  -8.206
  375    HZ2  LYS  53           HZ2      LYS  53  -4.184   7.215  -8.605
  376    HZ3  LYS  53           HZ3      LYS  53  -4.474   6.514  -7.099
  377    H    ASN  54           HN       ASN  54  -0.702  10.562  -8.775
  378    HA   ASN  54           HA       ASN  54  -2.290  12.812  -9.666
  379    HB2  ASN  54           HB2      ASN  54  -3.748  10.668  -9.507
  380    HB3  ASN  54           HB1      ASN  54  -3.607  10.879  -7.767
  381   HD21  ASN  54          HD21      ASN  54  -4.652  12.612  -6.784
  382   HD22  ASN  54          HD22      ASN  54  -5.852  13.555  -7.597
  383    H    ALA  55           HN       ALA  55   0.056  11.885  -8.009
  384    HA   ALA  55           HA       ALA  55  -0.814  12.747  -5.340
  385    HB1  ALA  55           HB1      ALA  55  -0.541  10.325  -5.582
  386    HB2  ALA  55           HB2      ALA  55   0.604  11.020  -4.424
  387    HB3  ALA  55           HB3      ALA  55   1.141  10.581  -6.050
  388    H    LYS  56           HN       LYS  56   0.927  13.441  -3.904
  389    HA   LYS  56           HA       LYS  56   3.440  14.269  -4.888
  390    HB2  LYS  56           HB2      LYS  56   1.999  15.930  -6.052
  391    HB3  LYS  56           HB1      LYS  56   1.427  16.479  -4.483
  392    HG2  LYS  56           HG2      LYS  56   3.122  17.977  -5.296
  393    HG3  LYS  56           HG1      LYS  56   3.726  17.108  -3.887
  394    HD2  LYS  56           HD2      LYS  56   5.460  17.214  -5.557
  395    HD3  LYS  56           HD1      LYS  56   4.906  15.549  -5.400
  396    HE2  LYS  56           HE2      LYS  56   3.503  15.838  -7.394
  397    HE3  LYS  56           HE1      LYS  56   4.082  17.497  -7.552
  398    HZ1  LYS  56           HZ1      LYS  56   5.755  15.052  -7.712
  399    HZ2  LYS  56           HZ2      LYS  56   6.326  16.636  -7.847
  400    HZ3  LYS  56           HZ3      LYS  56   5.281  16.014  -9.019
  401    H    ASN  57           HN       ASN  57   1.043  15.662  -2.636
  402    HA   ASN  57           HA       ASN  57   2.905  15.095  -0.449
  403    HB2  ASN  57           HB2      ASN  57   0.518  16.958  -0.498
  404    HB3  ASN  57           HB1      ASN  57   1.546  16.663   0.899
  405   HD21  ASN  57          HD21      ASN  57   3.651  17.496   0.909
  406   HD22  ASN  57          HD22      ASN  57   4.133  18.759  -0.167
  407    H    GLU  58           HN       GLU  58   1.648  14.671   1.633
  408    HA   GLU  58           HA       GLU  58   0.277  12.262   1.408
  409    HB2  GLU  58           HB2      GLU  58   0.777  12.269   3.574
  410    HB3  GLU  58           HB1      GLU  58   1.159  13.981   3.487
  411    HG2  GLU  58           HG2      GLU  58  -1.082  14.582   3.951
  412    HG3  GLU  58           HG1      GLU  58  -1.600  12.898   3.875
  413    H    ASP  59           HN       ASP  59  -0.805  15.548   1.550
  414    HA   ASP  59           HA       ASP  59  -3.557  15.184   1.857
  415    HB2  ASP  59           HB2      ASP  59  -2.280  17.335   2.017
  416    HB3  ASP  59           HB1      ASP  59  -2.193  17.334   0.267
  417    H    GLY  60           HN       GLY  60  -1.489  14.961  -0.952
  418    HA2  GLY  60           HA2      GLY  60  -3.852  14.718  -2.681
  419    HA3  GLY  60           HA1      GLY  60  -2.261  15.208  -3.220
  420    H    ILE  61           HN       ILE  61  -2.085  12.584  -1.077
  421    HA   ILE  61           HA       ILE  61  -1.961  10.762  -3.363
  422    HB   ILE  61           HB       ILE  61   0.210  10.923  -2.404
  423   HG12  ILE  61          HG12      ILE  61   0.686   8.694  -1.809
  424   HG13  ILE  61          HG11      ILE  61  -0.938   8.424  -1.182
  425   HG21  ILE  61          HG21      ILE  61  -0.415  11.890  -0.262
  426   HG22  ILE  61          HG22      ILE  61   0.712  10.548  -0.073
  427   HG23  ILE  61          HG23      ILE  61  -0.996  10.318   0.279
  428   HD11  ILE  61          HD11      ILE  61  -0.446   7.358  -3.393
  429   HD12  ILE  61          HD12      ILE  61  -0.334   8.980  -4.081
  430   HD13  ILE  61          HD13      ILE  61  -1.856   8.422  -3.373
  431    H    VAL  62           HN       VAL  62  -2.571  10.709   0.082
  432    HA   VAL  62           HA       VAL  62  -3.724   8.137   0.060
  433    HB   VAL  62           HB       VAL  62  -3.779  10.331   2.131
  434   HG11  VAL  62          HG11      VAL  62  -5.589   8.660   2.419
  435   HG12  VAL  62          HG12      VAL  62  -4.401   8.680   3.731
  436   HG13  VAL  62          HG13      VAL  62  -4.338   7.407   2.511
  437   HG21  VAL  62          HG21      VAL  62  -1.694   8.814   1.192
  438   HG22  VAL  62          HG22      VAL  62  -2.223   7.969   2.656
  439   HG23  VAL  62          HG23      VAL  62  -1.758   9.672   2.734
  440    H    ASN  63           HN       ASN  63  -5.036  11.388   0.147
  441    HA   ASN  63           HA       ASN  63  -7.760  10.600   0.293
  442    HB2  ASN  63           HB2      ASN  63  -6.787  12.872   0.883
  443    HB3  ASN  63           HB1      ASN  63  -6.716  13.199  -0.844
  444   HD21  ASN  63          HD21      ASN  63  -8.736  12.857   1.929
  445   HD22  ASN  63          HD22      ASN  63 -10.199  13.418   1.199
  446    H    SER  64           HN       SER  64  -5.474  10.724  -2.255
  447    HA   SER  64           HA       SER  64  -7.496  10.776  -4.355
  448    HB2  SER  64           HB2      SER  64  -4.476  10.579  -4.564
  449    HB3  SER  64           HB1      SER  64  -5.600  10.857  -5.898
  450    HG   SER  64           HG       SER  64  -6.142  12.662  -4.056
  451    H    LEU  65           HN       LEU  65  -5.701   8.578  -2.510
  452    HA   LEU  65           HA       LEU  65  -5.918   6.365  -4.361
  453    HB2  LEU  65           HB2      LEU  65  -4.911   6.616  -1.541
  454    HB3  LEU  65           HB1      LEU  65  -5.033   5.075  -2.368
  455    HG   LEU  65           HG       LEU  65  -3.352   7.398  -3.270
  456   HD11  LEU  65          HD11      LEU  65  -1.476   6.074  -2.513
  457   HD12  LEU  65          HD12      LEU  65  -2.561   4.796  -1.983
  458   HD13  LEU  65          HD13      LEU  65  -2.580   6.362  -1.170
  459   HD21  LEU  65          HD21      LEU  65  -3.651   4.584  -4.254
  460   HD22  LEU  65          HD22      LEU  65  -2.347   5.667  -4.739
  461   HD23  LEU  65          HD23      LEU  65  -4.019   6.066  -5.136
  462    H    ALA  66           HN       ALA  66  -6.941   4.348  -3.709
  463    HA   ALA  66           HA       ALA  66  -9.601   4.487  -3.025
  464    HB1  ALA  66           HB1      ALA  66  -9.522   2.121  -2.625
  465    HB2  ALA  66           HB2      ALA  66  -7.775   2.181  -2.381
  466    HB3  ALA  66           HB3      ALA  66  -8.451   2.493  -3.987
  467    H    LYS  67           HN       LYS  67 -10.776   4.355  -1.197
  468    HA   LYS  67           HA       LYS  67  -9.267   4.660   1.295
  469    HB2  LYS  67           HB2      LYS  67 -11.981   5.821   0.697
  470    HB3  LYS  67           HB1      LYS  67 -10.997   6.115   2.116
  471    HG2  LYS  67           HG2      LYS  67 -10.506   7.060  -0.688
  472    HG3  LYS  67           HG1      LYS  67 -10.850   8.031   0.737
  473    HD2  LYS  67           HD2      LYS  67  -8.397   6.316   0.520
  474    HD3  LYS  67           HD1      LYS  67  -8.440   7.964  -0.095
  475    HE2  LYS  67           HE2      LYS  67  -8.911   7.108   2.758
  476    HE3  LYS  67           HE1      LYS  67  -7.449   7.879   2.130
  477    HZ1  LYS  67           HZ1      LYS  67  -8.730   9.845   1.637
  478    HZ2  LYS  67           HZ2      LYS  67  -8.920   9.443   3.264
  479    HZ3  LYS  67           HZ3      LYS  67 -10.158   9.112   2.161
  480    H    ASP  68           HN       ASP  68  -9.739   3.364   2.933
  481    HA   ASP  68           HA       ASP  68 -11.588   1.187   2.447
  482    HB2  ASP  68           HB2      ASP  68 -10.465   0.037   4.113
  483    HB3  ASP  68           HB1      ASP  68  -9.194   1.135   3.589
  484    H    LYS  69           HN       LYS  69 -13.292   0.651   3.979
  485    HA   LYS  69           HA       LYS  69 -14.716   3.105   4.506
  486    HB2  LYS  69           HB2      LYS  69 -15.685   1.183   3.230
  487    HB3  LYS  69           HB1      LYS  69 -15.744   0.309   4.747
  488    HG2  LYS  69           HG2      LYS  69 -17.908   1.236   4.278
  489    HG3  LYS  69           HG1      LYS  69 -17.212   2.050   5.680
  490    HD2  LYS  69           HD2      LYS  69 -18.278   3.653   4.185
  491    HD3  LYS  69           HD1      LYS  69 -16.538   3.926   4.252
  492    HE2  LYS  69           HE2      LYS  69 -16.258   2.758   2.134
  493    HE3  LYS  69           HE1      LYS  69 -17.985   2.412   2.080
  494    HZ1  LYS  69           HZ1      LYS  69 -17.405   4.297   0.685
  495    HZ2  LYS  69           HZ2      LYS  69 -16.766   5.120   2.017
  496    HZ3  LYS  69           HZ3      LYS  69 -18.421   4.780   1.948
  497    H    SER  70           HN       SER  70 -13.796   0.222   6.396
  498    HA   SER  70           HA       SER  70 -15.187   1.410   8.678
  499    HB2  SER  70           HB2      SER  70 -14.783  -0.979   9.624
  500    HB3  SER  70           HB1      SER  70 -16.004  -0.736   8.373
  501    HG   SER  70           HG       SER  70 -14.855  -1.881   7.027
  502    H    GLY  71           HN       GLY  71 -11.970   0.634   7.633
  503    HA2  GLY  71           HA2      GLY  71  -9.935   1.017   8.623
  504    HA3  GLY  71           HA1      GLY  71 -10.784   1.941   9.852
  505    H    ASN  72           HN       ASN  72 -11.881  -1.247   9.440
  506    HA   ASN  72           HA       ASN  72 -11.465  -1.812  12.163
  507    HB2  ASN  72           HB2      ASN  72 -13.346  -2.707  10.856
  508    HB3  ASN  72           HB1      ASN  72 -12.228  -3.701   9.931
  509   HD21  ASN  72          HD21      ASN  72 -13.751  -3.212  13.018
  510   HD22  ASN  72          HD22      ASN  72 -13.405  -4.781  13.662
  511    H    SER  73           HN       SER  73  -9.560  -2.577   9.337
  512    HA   SER  73           HA       SER  73  -8.075  -4.617  10.780
  513    HB2  SER  73           HB2      SER  73  -7.769  -3.665   7.927
  514    HB3  SER  73           HB1      SER  73  -6.995  -5.080   8.640
  515    HG   SER  73           HG       SER  73  -9.029  -6.008   8.917
  516    H    SER  74           HN       SER  74  -7.917  -1.394  10.812
  517    HA   SER  74           HA       SER  74  -6.345   0.174  11.277
  518    HB2  SER  74           HB2      SER  74  -5.835  -1.445  13.109
  519    HB3  SER  74           HB1      SER  74  -4.621  -2.189  12.071
  520    HG   SER  74           HG       SER  74  -3.907  -0.517  13.637
  521    H    THR  75           HN       THR  75  -6.236   0.662   9.036
  522    HA   THR  75           HA       THR  75  -4.282  -0.670   7.378
  523    HB   THR  75           HB       THR  75  -6.562   0.102   6.589
  524    HG1  THR  75           HG1      THR  75  -5.531   1.096   4.592
  525   HG21  THR  75          HG21      THR  75  -6.305   2.361   7.721
  526   HG22  THR  75          HG22      THR  75  -6.943   2.371   6.077
  527   HG23  THR  75          HG23      THR  75  -5.254   2.803   6.367
  528    H    SER  76           HN       SER  76  -4.305   2.027   9.448
  529    HA   SER  76           HA       SER  76  -2.731   3.536  10.037
  530    HB2  SER  76           HB2      SER  76  -1.116   1.690   9.794
  531    HB3  SER  76           HB1      SER  76  -0.911   2.104   8.094
  532    HG   SER  76           HG       SER  76  -0.561   4.203   9.853
  533    H    ALA  77           HN       ALA  77  -2.778   2.999   6.509
  534    HA   ALA  77           HA       ALA  77  -2.141   5.668   5.790
  535    HB1  ALA  77           HB1      ALA  77  -3.096   5.154   3.621
  536    HB2  ALA  77           HB2      ALA  77  -3.874   3.704   4.288
  537    HB3  ALA  77           HB3      ALA  77  -2.112   3.786   4.176
  538    HA   PRO  78           HA       PRO  78  -5.604   7.659   7.611
  539    HB2  PRO  78           HB2      PRO  78  -5.076   9.551   5.370
  540    HB3  PRO  78           HB1      PRO  78  -5.340   9.907   7.074
  541    HG2  PRO  78           HG2      PRO  78  -2.902   9.981   6.109
  542    HG3  PRO  78           HG1      PRO  78  -3.198   9.155   7.644
  543    HD2  PRO  78           HD2      PRO  78  -2.764   7.982   4.941
  544    HD3  PRO  78           HD1      PRO  78  -2.153   7.442   6.516
  545    H    GLY  79           HN       GLY  79  -7.376   6.492   7.227
  546    HA2  GLY  79           HA2      GLY  79  -9.300   5.713   6.278
  547    HA3  GLY  79           HA1      GLY  79  -9.306   7.203   5.358
  548    H    SER  80           HN       SER  80  -6.537   5.229   4.744
  549    HA   SER  80           HA       SER  80  -7.630   4.820   2.035
  550    HB2  SER  80           HB2      SER  80  -5.133   5.747   3.075
  551    HB3  SER  80           HB1      SER  80  -4.876   4.345   2.048
  552    HG   SER  80           HG       SER  80  -6.503   5.662   0.646
  553    H    ALA  81           HN       ALA  81  -7.204   3.050   0.836
  554    HA   ALA  81           HA       ALA  81  -7.334   0.585   2.326
  555    HB1  ALA  81           HB1      ALA  81  -8.917   1.076   0.540
  556    HB2  ALA  81           HB2      ALA  81  -7.984  -0.390   0.201
  557    HB3  ALA  81           HB3      ALA  81  -7.587   1.123  -0.618
  558    H    HIS  82           HN       HIS  82  -4.705   1.741   2.383
  559    HA   HIS  82           HA       HIS  82  -3.347  -0.553   1.222
  560    HB2  HIS  82           HB2      HIS  82  -2.433   2.290   0.887
  561    HB3  HIS  82           HB1      HIS  82  -1.462   0.903   0.531
  562    HD1  HIS  82           HD1      HIS  82  -2.312  -0.557  -1.597
  563    HD2  HIS  82           HD2      HIS  82  -4.143   3.137  -1.068
  564    HE1  HIS  82           HE1      HIS  82  -3.453  -0.042  -3.779
  565    HE2  HIS  82           HE2      HIS  82  -4.691   2.126  -3.383
  566    H    GLN  83           HN       GLN  83  -2.121  -1.540   2.682
  567    HA   GLN  83           HA       GLN  83  -0.631   0.014   4.640
  568    HB2  GLN  83           HB2      GLN  83  -2.579  -0.440   5.940
  569    HB3  GLN  83           HB1      GLN  83  -2.664  -2.092   5.352
  570    HG2  GLN  83           HG2      GLN  83  -1.899  -1.849   7.712
  571    HG3  GLN  83           HG1      GLN  83  -0.814  -2.762   6.669
  572   HE21  GLN  83          HE21      GLN  83  -1.002   0.723   6.547
  573   HE22  GLN  83          HE22      GLN  83   0.554   1.013   7.251
  574    H    ILE  84           HN       ILE  84   1.361  -0.674   4.570
  575    HA   ILE  84           HA       ILE  84   1.966  -3.148   3.241
  576    HB   ILE  84           HB       ILE  84   3.469  -0.712   4.041
  577   HG12  ILE  84          HG12      ILE  84   3.896  -1.667   1.399
  578   HG13  ILE  84          HG11      ILE  84   2.174  -1.767   1.756
  579   HG21  ILE  84          HG21      ILE  84   4.751  -3.249   3.039
  580   HG22  ILE  84          HG22      ILE  84   4.953  -2.551   4.645
  581   HG23  ILE  84          HG23      ILE  84   5.550  -1.688   3.227
  582   HD11  ILE  84          HD11      ILE  84   2.279   0.623   2.467
  583   HD12  ILE  84          HD12      ILE  84   2.619   0.350   0.759
  584   HD13  ILE  84          HD13      ILE  84   3.944   0.665   1.880
  585    H    ASP  85           HN       ASP  85   2.750  -4.932   4.109
  586    HA   ASP  85           HA       ASP  85   2.932  -5.175   6.991
  587    HB2  ASP  85           HB2      ASP  85   1.906  -6.962   5.480
  588    HB3  ASP  85           HB1      ASP  85   3.536  -7.285   4.911
  589    H    THR  86           HN       THR  86   4.772  -4.613   7.963
  590    HA   THR  86           HA       THR  86   7.223  -4.577   6.435
  591    HB   THR  86           HB       THR  86   8.160  -3.531   8.492
  592    HG1  THR  86           HG1      THR  86   7.027  -3.629  10.276
  593   HG21  THR  86          HG21      THR  86   5.629  -2.365   7.343
  594   HG22  THR  86          HG22      THR  86   7.259  -2.195   6.681
  595   HG23  THR  86          HG23      THR  86   6.851  -1.453   8.233
  596    H    THR  87           HN       THR  87   5.666  -6.566   8.771
  597    HA   THR  87           HA       THR  87   7.818  -7.967   9.853
  598    HB   THR  87           HB       THR  87   5.030  -8.922   9.183
  599    HG1  THR  87           HG1      THR  87   4.604  -8.407  11.324
  600   HG21  THR  87          HG21      THR  87   6.534 -10.821   9.429
  601   HG22  THR  87          HG22      THR  87   5.434 -10.714  10.804
  602   HG23  THR  87          HG23      THR  87   7.108 -10.182  10.967
  603    H    ASN  88           HN       ASN  88   5.807  -8.863   7.038
  604    HA   ASN  88           HA       ASN  88   7.878 -10.751   6.196
  605    HB2  ASN  88           HB2      ASN  88   5.084 -10.237   5.171
  606    HB3  ASN  88           HB1      ASN  88   6.180 -11.436   4.489
  607   HD21  ASN  88          HD21      ASN  88   4.236 -10.546   7.234
  608   HD22  ASN  88          HD22      ASN  88   4.231 -12.111   7.985
  609    H    HIS  89           HN       HIS  89   6.823  -7.612   5.623
  610    HA   HIS  89           HA       HIS  89   7.739  -5.928   4.429
  611    HB2  HIS  89           HB2      HIS  89   9.679  -8.111   3.840
  612    HB3  HIS  89           HB1      HIS  89   9.706  -6.683   2.821
  613    HD1  HIS  89           HD1      HIS  89  11.528  -7.883   5.485
  614    HD2  HIS  89           HD2      HIS  89   9.505  -4.298   4.898
  615    HE1  HIS  89           HE1      HIS  89  12.616  -6.228   7.035
  616    HE2  HIS  89           HE2      HIS  89  11.260  -4.120   6.787
  617    H    LYS  90           HN       LYS  90   5.480  -6.925   3.667
  618    HA   LYS  90           HA       LYS  90   5.542  -7.187   0.737
  619    HB2  LYS  90           HB2      LYS  90   3.827  -8.240   2.912
  620    HB3  LYS  90           HB1      LYS  90   3.058  -7.942   1.375
  621    HG2  LYS  90           HG2      LYS  90   4.658  -9.462   0.300
  622    HG3  LYS  90           HG1      LYS  90   5.441  -9.734   1.860
  623    HD2  LYS  90           HD2      LYS  90   2.597 -10.427   1.124
  624    HD3  LYS  90           HD1      LYS  90   3.924 -11.561   1.373
  625    HE2  LYS  90           HE2      LYS  90   4.093 -10.836   3.706
  626    HE3  LYS  90           HE1      LYS  90   2.756  -9.719   3.457
  627    HZ1  LYS  90           HZ1      LYS  90   1.935 -11.704   4.483
  628    HZ2  LYS  90           HZ2      LYS  90   2.649 -12.682   3.304
  629    HZ3  LYS  90           HZ3      LYS  90   1.363 -11.666   2.890
  630    H    LEU  91           HN       LEU  91   4.261  -5.843  -0.474
  631    HA   LEU  91           HA       LEU  91   3.067  -3.531   0.862
  632    HB2  LEU  91           HB2      LEU  91   4.446  -3.103  -1.097
  633    HB3  LEU  91           HB1      LEU  91   3.483  -4.165  -2.063
  634    HG   LEU  91           HG       LEU  91   2.403  -2.375  -2.792
  635   HD11  LEU  91          HD11      LEU  91   1.420  -1.998   0.017
  636   HD12  LEU  91          HD12      LEU  91   0.625  -2.891  -1.279
  637   HD13  LEU  91          HD13      LEU  91   0.802  -1.140  -1.396
  638   HD21  LEU  91          HD21      LEU  91   4.332  -1.075  -2.163
  639   HD22  LEU  91          HD22      LEU  91   3.614  -0.769  -0.583
  640   HD23  LEU  91          HD23      LEU  91   2.843  -0.144  -2.041
  641    H    ILE  92           HN       ILE  92   1.291  -4.157   1.775
  642    HA   ILE  92           HA       ILE  92  -0.693  -5.738   0.367
  643    HB   ILE  92           HB       ILE  92  -0.242  -4.864   3.191
  644   HG12  ILE  92          HG12      ILE  92  -0.820  -7.381   3.505
  645   HG13  ILE  92          HG11      ILE  92  -0.592  -7.483   1.762
  646   HG21  ILE  92          HG21      ILE  92  -2.589  -4.353   2.797
  647   HG22  ILE  92          HG22      ILE  92  -2.438  -5.756   3.855
  648   HG23  ILE  92          HG23      ILE  92  -2.857  -5.973   2.158
  649   HD11  ILE  92          HD11      ILE  92   1.400  -8.102   3.018
  650   HD12  ILE  92          HD12      ILE  92   1.447  -6.482   3.711
  651   HD13  ILE  92          HD13      ILE  92   1.663  -6.702   1.978
  652    H    SER  93           HN       SER  93  -2.600  -4.902  -0.266
  653    HA   SER  93           HA       SER  93  -3.096  -2.085   0.361
  654    HB2  SER  93           HB2      SER  93  -4.204  -3.634  -1.975
  655    HB3  SER  93           HB1      SER  93  -4.239  -1.888  -1.727
  656    HG   SER  93           HG       SER  93  -1.899  -3.467  -2.074
  657    H    THR  94           HN       THR  94  -4.591  -1.964   1.955
  658    HA   THR  94           HA       THR  94  -6.190  -4.359   2.444
  659    HB   THR  94           HB       THR  94  -5.621  -2.053   4.307
  660    HG1  THR  94           HG1      THR  94  -4.056  -3.461   5.211
  661   HG21  THR  94          HG21      THR  94  -6.390  -3.551   6.046
  662   HG22  THR  94          HG22      THR  94  -6.616  -4.841   4.867
  663   HG23  THR  94          HG23      THR  94  -7.635  -3.404   4.801
  664    H    PHE  95           HN       PHE  95  -8.181  -4.222   1.623
  665    HA   PHE  95           HA       PHE  95  -9.568  -1.645   1.810
  666    HB2  PHE  95           HB2      PHE  95  -9.509  -3.123  -0.338
  667    HB3  PHE  95           HB1      PHE  95 -10.733  -4.082   0.507
  668    HD1  PHE  95           HD1      PHE  95 -12.893  -3.093   1.107
  669    HD2  PHE  95           HD2      PHE  95 -10.032  -0.930  -1.187
  670    HE1  PHE  95           HE1      PHE  95 -14.631  -1.471   0.470
  671    HE2  PHE  95           HE2      PHE  95 -11.767   0.689  -1.833
  672    HZ   PHE  95           HZ       PHE  95 -14.068   0.421  -1.002
  673    H    THR  96           HN       THR  96 -10.292  -1.582   3.911
  674    HA   THR  96           HA       THR  96 -11.663  -3.858   5.004
  675    HB   THR  96           HB       THR  96 -12.086  -1.301   6.369
  676    HG1  THR  96           HG1      THR  96 -10.086  -0.612   6.244
  677   HG21  THR  96          HG21      THR  96 -12.512  -3.444   7.407
  678   HG22  THR  96          HG22      THR  96 -11.189  -2.632   8.246
  679   HG23  THR  96          HG23      THR  96 -10.846  -3.943   7.117
  680    HA   PRO  97           HA       PRO  97 -15.130  -2.590   2.445
  681    HB2  PRO  97           HB2      PRO  97 -16.703  -4.722   3.214
  682    HB3  PRO  97           HB1      PRO  97 -15.556  -4.731   1.871
  683    HG2  PRO  97           HG2      PRO  97 -15.290  -5.819   4.621
  684    HG3  PRO  97           HG1      PRO  97 -14.635  -6.429   3.092
  685    HD2  PRO  97           HD2      PRO  97 -13.142  -5.130   4.908
  686    HD3  PRO  97           HD1      PRO  97 -12.820  -5.054   3.174
  687    H    SER  98           HN       SER  98 -17.415  -2.198   2.704
  688    HA   SER  98           HA       SER  98 -17.997  -0.698   5.028
  689    HB2  SER  98           HB2      SER  98 -19.958  -1.623   2.923
  690    HB3  SER  98           HB1      SER  98 -20.069  -0.187   3.939
  691    HG   SER  98           HG       SER  98 -19.325   0.453   1.940
  692    H    ASN  99           HN       ASN  99 -18.529  -3.962   4.102
  693    HA   ASN  99           HA       ASN  99 -20.599  -4.614   5.936
  694    HB2  ASN  99           HB2      ASN  99 -18.626  -6.114   4.296
  695    HB3  ASN  99           HB1      ASN  99 -19.383  -6.961   5.634
  696   HD21  ASN  99          HD21      ASN  99 -20.410  -8.363   4.192
  697   HD22  ASN  99          HD22      ASN  99 -21.774  -7.862   3.253
  698    H    GLY 100           HN       GLY 100 -17.269  -4.015   6.265
  699    HA2  GLY 100           HA2      GLY 100 -16.003  -3.836   8.202
  700    HA3  GLY 100           HA1      GLY 100 -17.347  -4.517   9.108
  701    H    GLY 101           HN       GLY 101 -16.730  -6.361   6.427
  702    HA2  GLY 101           HA2      GLY 101 -15.698  -8.515   8.048
  703    HA3  GLY 101           HA1      GLY 101 -16.209  -8.617   6.370
  704    H    GLN 102           HN       GLN 102 -14.287  -9.964   6.207
  705    HA   GLN 102           HA       GLN 102 -11.694  -9.034   6.673
  706    HB2  GLN 102           HB2      GLN 102 -12.700 -11.144   4.771
  707    HB3  GLN 102           HB1      GLN 102 -10.997 -10.860   5.113
  708    HG2  GLN 102           HG2      GLN 102 -11.454 -11.292   7.502
  709    HG3  GLN 102           HG1      GLN 102 -13.112 -11.710   7.074
  710   HE21  GLN 102          HE21      GLN 102 -13.509 -13.610   5.935
  711   HE22  GLN 102          HE22      GLN 102 -12.333 -14.874   5.831
  712    H    ALA 103           HN       ALA 103 -10.199  -8.064   5.483
  713    HA   ALA 103           HA       ALA 103 -11.195  -6.207   3.503
  714    HB1  ALA 103           HB1      ALA 103  -8.407  -6.567   4.597
  715    HB2  ALA 103           HB2      ALA 103  -9.644  -5.498   5.261
  716    HB3  ALA 103           HB3      ALA 103  -9.000  -5.202   3.641
  717    H    THR 104           HN       THR 104 -10.416  -5.828   1.583
  718    HA   THR 104           HA       THR 104  -9.557  -8.114   0.046
  719    HB   THR 104           HB       THR 104 -10.806  -5.498  -0.488
  720    HG1  THR 104           HG1      THR 104 -11.278  -8.180  -1.282
  721   HG21  THR 104          HG21      THR 104  -9.225  -7.020  -2.553
  722   HG22  THR 104          HG22      THR 104  -8.983  -5.354  -2.023
  723   HG23  THR 104          HG23      THR 104 -10.422  -5.785  -2.937
  724    H    VAL 105           HN       VAL 105  -7.527  -8.268  -0.908
  725    HA   VAL 105           HA       VAL 105  -5.697  -6.050  -0.279
  726    HB   VAL 105           HB       VAL 105  -5.217  -8.976   0.224
  727   HG11  VAL 105          HG11      VAL 105  -3.166  -8.080  -0.595
  728   HG12  VAL 105          HG12      VAL 105  -3.021  -8.216   1.159
  729   HG13  VAL 105          HG13      VAL 105  -3.326  -6.645   0.415
  730   HG21  VAL 105          HG21      VAL 105  -6.561  -7.841   1.943
  731   HG22  VAL 105          HG22      VAL 105  -5.276  -6.639   2.125
  732   HG23  VAL 105          HG23      VAL 105  -4.969  -8.321   2.556
  733    H    LEU 106           HN       LEU 106  -4.257  -5.535  -1.718
  734    HA   LEU 106           HA       LEU 106  -3.588  -7.415  -3.877
  735    HB2  LEU 106           HB2      LEU 106  -3.676  -4.405  -3.849
  736    HB3  LEU 106           HB1      LEU 106  -2.785  -5.298  -5.065
  737    HG   LEU 106           HG       LEU 106  -4.859  -4.677  -6.011
  738   HD11  LEU 106          HD11      LEU 106  -5.807  -6.827  -6.599
  739   HD12  LEU 106          HD12      LEU 106  -5.058  -7.572  -5.186
  740   HD13  LEU 106          HD13      LEU 106  -4.050  -6.954  -6.497
  741   HD21  LEU 106          HD21      LEU 106  -7.034  -5.235  -5.038
  742   HD22  LEU 106          HD22      LEU 106  -6.097  -4.266  -3.903
  743   HD23  LEU 106          HD23      LEU 106  -6.239  -6.008  -3.661
  744    H    THR 107           HN       THR 107  -1.565  -8.205  -3.728
  745    HA   THR 107           HA       THR 107   0.162  -6.909  -1.722
  746    HB   THR 107           HB       THR 107   0.185  -9.846  -2.382
  747    HG1  THR 107           HG1      THR 107  -0.937  -9.422  -0.020
  748   HG21  THR 107          HG21      THR 107   2.175  -8.912  -1.240
  749   HG22  THR 107          HG22      THR 107   1.293 -10.062  -0.236
  750   HG23  THR 107          HG23      THR 107   1.131  -8.329   0.060
  751    H    TYR 108           HN       TYR 108   2.334  -6.818  -2.001
  752    HA   TYR 108           HA       TYR 108   3.575  -7.942  -4.392
  753    HB2  TYR 108           HB2      TYR 108   3.393  -5.814  -5.270
  754    HB3  TYR 108           HB1      TYR 108   3.366  -5.053  -3.691
  755    HD1  TYR 108           HD1      TYR 108   5.295  -4.127  -2.765
  756    HD2  TYR 108           HD2      TYR 108   5.631  -6.629  -6.186
  757    HE1  TYR 108           HE1      TYR 108   7.626  -3.440  -3.019
  758    HE2  TYR 108           HE2      TYR 108   7.989  -5.963  -6.442
  759    HH   TYR 108           HH       TYR 108   9.708  -4.321  -4.027
  760    H    ASP 109           HN       ASP 109   5.773  -8.466  -4.061
  761    HA   ASP 109           HA       ASP 109   6.545  -8.494  -1.236
  762    HB2  ASP 109           HB2      ASP 109   7.446 -10.222  -3.546
  763    HB3  ASP 109           HB1      ASP 109   7.992 -10.372  -1.890
  764    H    TRP 110           HN       TRP 110   7.875  -6.782  -0.823
  765    HA   TRP 110           HA       TRP 110   9.877  -5.986  -2.745
  766    HB2  TRP 110           HB2      TRP 110   9.119  -4.174  -1.439
  767    HB3  TRP 110           HB1      TRP 110   9.242  -5.081   0.062
  768    HD1  TRP 110           HD1      TRP 110  11.533  -3.469  -2.589
  769    HE1  TRP 110           HE1      TRP 110  13.760  -2.826  -1.455
  770    HE3  TRP 110           HE3      TRP 110  10.687  -5.456   2.020
  771    HZ2  TRP 110           HZ2      TRP 110  14.986  -3.154   1.067
  772    HZ3  TRP 110           HZ3      TRP 110  12.428  -5.264   3.742
  773    HH2  TRP 110           HH2      TRP 110  14.540  -4.133   3.279
  774    H    SER 111           HN       SER 111   9.711  -7.787   0.247
  775    HA   SER 111           HA       SER 111  12.427  -8.254   0.671
  776    HB2  SER 111           HB2      SER 111  11.445 -10.370   1.827
  777    HB3  SER 111           HB1      SER 111  11.021  -8.780   2.445
  778    HG   SER 111           HG       SER 111   9.088  -9.701   2.250
  779    H    ALA 112           HN       ALA 112  10.066  -9.910  -1.309
  780    HA   ALA 112           HA       ALA 112  11.987 -11.931  -2.103
  781    HB1  ALA 112           HB1      ALA 112   9.632 -12.537  -1.664
  782    HB2  ALA 112           HB2      ALA 112  10.174 -12.980  -3.282
  783    HB3  ALA 112           HB3      ALA 112   9.161 -11.558  -3.053
  784    H    ASN 113           HN       ASN 113  11.703  -8.897  -2.911
  785    HA   ASN 113           HA       ASN 113  11.827  -9.152  -5.807
  786    HB2  ASN 113           HB2      ASN 113  10.730  -7.171  -4.716
  787    HB3  ASN 113           HB1      ASN 113  12.314  -6.696  -4.108
  788   HD21  ASN 113          HD21      ASN 113  10.278  -6.946  -6.904
  789   HD22  ASN 113          HD22      ASN 113  11.259  -5.985  -7.952
  790    H    GLY 114           HN       GLY 114  13.637 -10.602  -5.718
  791    HA2  GLY 114           HA2      GLY 114  16.005  -9.740  -6.547
  792    HA3  GLY 114           HA1      GLY 114  16.174  -9.516  -4.810
  793    H    VAL 115           HN       VAL 115  17.968 -11.115  -5.548
  794    HA   VAL 115           HA       VAL 115  17.320 -13.667  -4.534
  795    HB   VAL 115           HB       VAL 115  16.422 -13.848  -6.854
  796   HG11  VAL 115          HG11      VAL 115  19.303 -13.511  -7.662
  797   HG12  VAL 115          HG12      VAL 115  17.973 -12.410  -8.024
  798   HG13  VAL 115          HG13      VAL 115  17.998 -14.026  -8.731
  799   HG21  VAL 115          HG21      VAL 115  17.077 -15.855  -5.700
  800   HG22  VAL 115          HG22      VAL 115  18.765 -15.610  -6.149
  801   HG23  VAL 115          HG23      VAL 115  17.567 -15.989  -7.390
  802    H    ASN 116           HN       ASN 116  19.146 -14.770  -3.962
  803    HA   ASN 116           HA       ASN 116  21.651 -13.410  -3.981
  804    HB2  ASN 116           HB2      ASN 116  20.969 -14.925  -2.174
  805    HB3  ASN 116           HB1      ASN 116  20.927 -16.261  -3.308
  806   HD21  ASN 116          HD21      ASN 116  22.425 -17.394  -2.029
  807   HD22  ASN 116          HD22      ASN 116  24.108 -16.985  -2.031
  808    H    SER 117           HN       SER 117  23.217 -13.500  -5.486
  809    HA   SER 117           HA       SER 117  22.595 -14.445  -8.050
  810    HB2  SER 117           HB2      SER 117  25.295 -13.622  -6.966
  811    HB3  SER 117           HB1      SER 117  24.832 -13.694  -8.667
  812    HG   SER 117           HG       SER 117  23.019 -12.199  -7.729
  813    H    ASN 118           HN       ASN 118  22.206 -16.612  -8.087
  814    HA   ASN 118           HA       ASN 118  24.595 -18.315  -7.861
  815    HB2  ASN 118           HB2      ASN 118  21.747 -18.958  -7.084
  816    HB3  ASN 118           HB1      ASN 118  22.960 -20.203  -7.364
  817   HD21  ASN 118          HD21      ASN 118  21.889 -17.665  -5.276
  818   HD22  ASN 118          HD22      ASN 118  22.931 -18.045  -3.947
  Start of MODEL    4
    1    H1   HIS   6           HT1      HIS   6 -19.379  -8.050  -4.407
    2    H2   HIS   6           HT2      HIS   6 -21.028  -7.679  -4.319
    3    H3   HIS   6           HT3      HIS   6 -19.936  -6.890  -3.304
    4    HA   HIS   6           HA       HIS   6 -20.072  -6.655  -6.251
    5    HB2  HIS   6           HB2      HIS   6 -20.891  -4.823  -4.004
    6    HB3  HIS   6           HB1      HIS   6 -20.498  -4.190  -5.595
    7    HD1  HIS   6           HD1      HIS   6 -22.100  -4.921  -7.573
    8    HD2  HIS   6           HD2      HIS   6 -23.415  -5.910  -3.753
    9    HE1  HIS   6           HE1      HIS   6 -24.540  -5.463  -7.814
   10    HE2  HIS   6           HE2      HIS   6 -25.322  -6.054  -5.497
   11    H    GLN   7           HN       GLN   7 -18.721  -4.944  -3.411
   12    HA   GLN   7           HA       GLN   7 -16.506  -3.948  -4.859
   13    HB2  GLN   7           HB2      GLN   7 -17.295  -2.846  -2.834
   14    HB3  GLN   7           HB1      GLN   7 -16.872  -4.265  -1.896
   15    HG2  GLN   7           HG2      GLN   7 -15.136  -2.743  -1.525
   16    HG3  GLN   7           HG1      GLN   7 -14.501  -3.924  -2.667
   17   HE21  GLN   7          HE21      GLN   7 -16.730  -1.363  -3.526
   18   HE22  GLN   7          HE22      GLN   7 -15.613  -0.472  -4.498
   19    H    ASP   8           HN       ASP   8 -17.154  -6.970  -3.418
   20    HA   ASP   8           HA       ASP   8 -14.583  -7.799  -2.737
   21    HB2  ASP   8           HB2      ASP   8 -15.424 -10.049  -2.832
   22    HB3  ASP   8           HB1      ASP   8 -16.669  -9.007  -2.160
   23    H    ASN   9           HN       ASN   9 -16.201  -7.704  -5.849
   24    HA   ASN   9           HA       ASN   9 -13.856  -8.782  -7.185
   25    HB2  ASN   9           HB2      ASN   9 -16.447  -7.624  -8.238
   26    HB3  ASN   9           HB1      ASN   9 -15.138  -8.183  -9.278
   27   HD21  ASN   9          HD21      ASN   9 -14.660 -10.389  -9.361
   28   HD22  ASN   9          HD22      ASN   9 -15.787 -11.586  -8.829
   29    H    ALA  10           HN       ALA  10 -15.357  -5.722  -6.494
   30    HA   ALA  10           HA       ALA  10 -14.000  -4.143  -8.414
   31    HB1  ALA  10           HB1      ALA  10 -16.061  -3.460  -7.198
   32    HB2  ALA  10           HB2      ALA  10 -14.775  -2.247  -7.202
   33    HB3  ALA  10           HB3      ALA  10 -15.065  -3.218  -5.756
   34    H    ARG  11           HN       ARG  11 -13.321  -4.914  -5.039
   35    HA   ARG  11           HA       ARG  11 -11.254  -3.213  -4.491
   36    HB2  ARG  11           HB2      ARG  11 -10.367  -4.991  -3.000
   37    HB3  ARG  11           HB1      ARG  11 -12.072  -4.648  -2.765
   38    HG2  ARG  11           HG2      ARG  11 -12.180  -6.916  -2.759
   39    HG3  ARG  11           HG1      ARG  11 -12.312  -6.649  -4.494
   40    HD2  ARG  11           HD2      ARG  11  -9.887  -7.015  -4.716
   41    HD3  ARG  11           HD1      ARG  11  -9.799  -7.353  -2.991
   42    HE   ARG  11           HE       ARG  11 -11.712  -9.044  -4.184
   43   HH11  ARG  11          HH11      ARG  11  -8.250  -8.560  -4.003
   44   HH12  ARG  11          HH12      ARG  11  -7.868 -10.222  -4.301
   45   HH21  ARG  11          HH21      ARG  11 -11.206 -11.247  -4.588
   46   HH22  ARG  11          HH22      ARG  11  -9.543 -11.747  -4.627
   47    H    LYS  12           HN       LYS  12 -11.170  -6.189  -6.298
   48    HA   LYS  12           HA       LYS  12  -8.414  -6.470  -6.516
   49    HB2  LYS  12           HB2      LYS  12 -10.072  -8.213  -7.147
   50    HB3  LYS  12           HB1      LYS  12 -10.521  -7.238  -8.544
   51    HG2  LYS  12           HG2      LYS  12  -9.055  -8.963  -9.252
   52    HG3  LYS  12           HG1      LYS  12  -8.177  -7.439  -9.334
   53    HD2  LYS  12           HD2      LYS  12  -7.279  -8.008  -7.029
   54    HD3  LYS  12           HD1      LYS  12  -7.930  -9.629  -7.289
   55    HE2  LYS  12           HE2      LYS  12  -6.596  -9.849  -9.307
   56    HE3  LYS  12           HE1      LYS  12  -5.991  -8.215  -9.077
   57    HZ1  LYS  12           HZ1      LYS  12  -5.518 -10.524  -7.275
   58    HZ2  LYS  12           HZ2      LYS  12  -4.977  -8.953  -6.986
   59    HZ3  LYS  12           HZ3      LYS  12  -4.381  -9.821  -8.309
   60    H    SER  13           HN       SER  13 -10.743  -4.647  -8.378
   61    HA   SER  13           HA       SER  13  -8.738  -3.859 -10.315
   62    HB2  SER  13           HB2      SER  13 -11.687  -3.233 -10.007
   63    HB3  SER  13           HB1      SER  13 -10.694  -2.699 -11.370
   64    HG   SER  13           HG       SER  13 -10.236  -4.998 -11.688
   65    H    ARG  14           HN       ARG  14 -10.810  -2.288  -7.882
   66    HA   ARG  14           HA       ARG  14  -9.973   0.343  -8.445
   67    HB2  ARG  14           HB2      ARG  14 -11.038   0.949  -6.306
   68    HB3  ARG  14           HB1      ARG  14 -12.069  -0.109  -7.259
   69    HG2  ARG  14           HG2      ARG  14 -12.242  -1.458  -5.503
   70    HG3  ARG  14           HG1      ARG  14 -10.514  -1.786  -5.659
   71    HD2  ARG  14           HD2      ARG  14 -11.380  -1.004  -3.399
   72    HD3  ARG  14           HD1      ARG  14  -9.940  -0.226  -4.030
   73    HE   ARG  14           HE       ARG  14 -11.508   1.616  -4.738
   74   HH11  ARG  14          HH11      ARG  14 -12.344  -0.513  -2.082
   75   HH12  ARG  14          HH12      ARG  14 -13.302   0.674  -1.264
   76   HH21  ARG  14          HH21      ARG  14 -12.769   3.180  -3.656
   77   HH22  ARG  14          HH22      ARG  14 -13.552   2.775  -2.161
   78    H    ILE  15           HN       ILE  15  -8.711  -2.106  -6.273
   79    HA   ILE  15           HA       ILE  15  -6.921  -0.233  -5.009
   80    HB   ILE  15           HB       ILE  15  -6.876  -3.252  -4.994
   81   HG12  ILE  15          HG12      ILE  15  -7.924  -1.376  -2.858
   82   HG13  ILE  15          HG11      ILE  15  -8.960  -2.167  -4.045
   83   HG21  ILE  15          HG21      ILE  15  -4.740  -2.205  -4.417
   84   HG22  ILE  15          HG22      ILE  15  -5.473  -2.977  -3.007
   85   HG23  ILE  15          HG23      ILE  15  -5.552  -1.217  -3.196
   86   HD11  ILE  15          HD11      ILE  15  -7.147  -3.637  -2.162
   87   HD12  ILE  15          HD12      ILE  15  -8.396  -4.318  -3.222
   88   HD13  ILE  15          HD13      ILE  15  -8.852  -3.298  -1.843
   89    H    GLN  16           HN       GLN  16  -6.817  -2.813  -7.379
   90    HA   GLN  16           HA       GLN  16  -4.168  -3.228  -7.809
   91    HB2  GLN  16           HB2      GLN  16  -6.498  -3.916  -9.035
   92    HB3  GLN  16           HB1      GLN  16  -5.659  -3.013 -10.292
   93    HG2  GLN  16           HG2      GLN  16  -3.656  -4.523  -9.719
   94    HG3  GLN  16           HG1      GLN  16  -4.863  -5.533  -8.921
   95   HE21  GLN  16          HE21      GLN  16  -3.192  -6.076 -11.255
   96   HE22  GLN  16          HE22      GLN  16  -4.287  -6.469 -12.537
   97    H    SER  17           HN       SER  17  -6.136  -0.693  -9.357
   98    HA   SER  17           HA       SER  17  -4.259   0.226 -11.175
   99    HB2  SER  17           HB2      SER  17  -6.635   0.955 -11.096
  100    HB3  SER  17           HB1      SER  17  -6.275   1.907  -9.658
  101    HG   SER  17           HG       SER  17  -4.605   2.927 -11.104
  102    H    GLU  18           HN       GLU  18  -4.825   1.336  -7.859
  103    HA   GLU  18           HA       GLU  18  -2.514   3.063  -7.973
  104    HB2  GLU  18           HB2      GLU  18  -4.276   2.500  -5.609
  105    HB3  GLU  18           HB1      GLU  18  -3.205   3.874  -5.862
  106    HG2  GLU  18           HG2      GLU  18  -5.560   3.260  -7.590
  107    HG3  GLU  18           HG1      GLU  18  -5.614   4.341  -6.211
  108    H    HIS  19           HN       HIS  19  -3.336  -0.092  -6.720
  109    HA   HIS  19           HA       HIS  19  -1.416  -0.486  -4.771
  110    HB2  HIS  19           HB2      HIS  19  -2.844  -2.292  -4.989
  111    HB3  HIS  19           HB1      HIS  19  -2.756  -2.319  -6.739
  112    HD1  HIS  19           HD1      HIS  19  -0.357  -3.045  -3.844
  113    HD2  HIS  19           HD2      HIS  19  -1.381  -4.441  -7.615
  114    HE1  HIS  19           HE1      HIS  19   1.079  -5.069  -4.221
  115    HE2  HIS  19           HE2      HIS  19   0.329  -5.992  -6.441
  116    H    ARG  20           HN       ARG  20  -1.013  -0.961  -8.282
  117    HA   ARG  20           HA       ARG  20   1.694  -1.630  -8.257
  118    HB2  ARG  20           HB2      ARG  20   0.316   0.081 -10.327
  119    HB3  ARG  20           HB1      ARG  20   1.767  -0.885 -10.553
  120    HG2  ARG  20           HG2      ARG  20   0.287  -2.887  -9.937
  121    HG3  ARG  20           HG1      ARG  20  -1.066  -1.793 -10.245
  122    HD2  ARG  20           HD2      ARG  20   1.132  -2.529 -12.159
  123    HD3  ARG  20           HD1      ARG  20  -0.547  -3.055 -12.242
  124    HE   ARG  20           HE       ARG  20  -0.706  -0.337 -12.293
  125   HH11  ARG  20          HH11      ARG  20   1.037  -2.700 -14.193
  126   HH12  ARG  20          HH12      ARG  20   1.002  -1.750 -15.644
  127   HH21  ARG  20          HH21      ARG  20  -0.728   0.936 -14.186
  128   HH22  ARG  20          HH22      ARG  20   0.006   0.329 -15.637
  129    H    GLU  21           HN       GLU  21   0.118   1.518  -8.248
  130    HA   GLU  21           HA       GLU  21   2.346   3.186  -8.514
  131    HB2  GLU  21           HB2      GLU  21  -0.087   3.805  -6.835
  132    HB3  GLU  21           HB1      GLU  21   0.941   4.940  -7.692
  133    HG2  GLU  21           HG2      GLU  21  -0.725   2.877  -9.068
  134    HG3  GLU  21           HG1      GLU  21  -1.333   4.491  -8.700
  135    H    LEU  22           HN       LEU  22   0.724   2.004  -5.569
  136    HA   LEU  22           HA       LEU  22   2.348   3.359  -3.740
  137    HB2  LEU  22           HB2      LEU  22   0.690   0.876  -3.479
  138    HB3  LEU  22           HB1      LEU  22   1.686   1.433  -2.153
  139    HG   LEU  22           HG       LEU  22  -0.407   2.299  -1.650
  140   HD11  LEU  22          HD11      LEU  22  -0.185   4.678  -1.844
  141   HD12  LEU  22          HD12      LEU  22   0.900   4.518  -3.221
  142   HD13  LEU  22          HD13      LEU  22   1.420   3.985  -1.621
  143   HD21  LEU  22          HD21      LEU  22  -1.436   1.761  -3.815
  144   HD22  LEU  22          HD22      LEU  22  -0.697   3.210  -4.502
  145   HD23  LEU  22          HD23      LEU  22  -1.892   3.353  -3.211
  146    H    VAL  23           HN       VAL  23   2.764   0.126  -5.151
  147    HA   VAL  23           HA       VAL  23   5.123  -0.347  -3.633
  148    HB   VAL  23           HB       VAL  23   4.719  -2.417  -4.192
  149   HG11  VAL  23          HG11      VAL  23   2.384  -1.654  -4.684
  150   HG12  VAL  23          HG12      VAL  23   2.878  -3.121  -5.531
  151   HG13  VAL  23          HG13      VAL  23   2.843  -1.582  -6.386
  152   HG21  VAL  23          HG21      VAL  23   6.437  -2.159  -5.827
  153   HG22  VAL  23          HG22      VAL  23   5.255  -1.569  -7.007
  154   HG23  VAL  23          HG23      VAL  23   5.183  -3.241  -6.449
  155    H    SER  24           HN       SER  24   4.425   0.896  -6.854
  156    HA   SER  24           HA       SER  24   7.070   1.137  -7.759
  157    HB2  SER  24           HB2      SER  24   4.969   1.632  -9.095
  158    HB3  SER  24           HB1      SER  24   4.860   3.161  -8.221
  159    HG   SER  24           HG       SER  24   6.781   2.302 -10.096
  160    H    ALA  25           HN       ALA  25   5.231   2.808  -5.362
  161    HA   ALA  25           HA       ALA  25   7.174   4.951  -5.032
  162    HB1  ALA  25           HB1      ALA  25   5.769   5.788  -3.312
  163    HB2  ALA  25           HB2      ALA  25   4.929   4.243  -3.161
  164    HB3  ALA  25           HB3      ALA  25   4.689   5.233  -4.609
  165    H    ILE  26           HN       ILE  26   6.288   1.896  -3.428
  166    HA   ILE  26           HA       ILE  26   7.919   2.090  -1.202
  167    HB   ILE  26           HB       ILE  26   6.940  -0.229  -2.820
  168   HG12  ILE  26          HG12      ILE  26   6.713   0.675   0.028
  169   HG13  ILE  26          HG11      ILE  26   5.437   0.586  -1.179
  170   HG21  ILE  26          HG21      ILE  26   8.904  -0.575  -0.570
  171   HG22  ILE  26          HG22      ILE  26   9.289  -0.783  -2.280
  172   HG23  ILE  26          HG23      ILE  26   8.119  -1.851  -1.503
  173   HD11  ILE  26          HD11      ILE  26   5.388  -1.781  -1.087
  174   HD12  ILE  26          HD12      ILE  26   5.413  -1.191   0.593
  175   HD13  ILE  26          HD13      ILE  26   6.887  -1.824  -0.141
  176    H    GLN  27           HN       GLN  27   8.653   0.779  -4.384
  177    HA   GLN  27           HA       GLN  27  11.345   0.201  -3.958
  178    HB2  GLN  27           HB2      GLN  27   9.964   0.968  -6.534
  179    HB3  GLN  27           HB1      GLN  27  11.499   0.110  -6.401
  180    HG2  GLN  27           HG2      GLN  27  10.318  -1.711  -5.221
  181    HG3  GLN  27           HG1      GLN  27   8.809  -0.853  -5.479
  182   HE21  GLN  27          HE21      GLN  27   7.933  -0.750  -7.549
  183   HE22  GLN  27          HE22      GLN  27   8.457  -1.797  -8.822
  184    H    SER  28           HN       SER  28   9.732   3.171  -4.759
  185    HA   SER  28           HA       SER  28  12.088   4.644  -5.427
  186    HB2  SER  28           HB2      SER  28   9.244   5.434  -4.802
  187    HB3  SER  28           HB1      SER  28  10.476   6.577  -5.308
  188    HG   SER  28           HG       SER  28   9.203   4.548  -6.756
  189    H    TYR  29           HN       TYR  29   9.886   4.608  -2.619
  190    HA   TYR  29           HA       TYR  29  11.201   6.365  -0.920
  191    HB2  TYR  29           HB2      TYR  29   8.974   5.384  -0.512
  192    HB3  TYR  29           HB1      TYR  29   9.703   3.808  -0.269
  193    HD1  TYR  29           HD1      TYR  29   7.880   4.648   1.816
  194    HD2  TYR  29           HD2      TYR  29  11.971   5.726   1.270
  195    HE1  TYR  29           HE1      TYR  29   8.083   5.157   4.209
  196    HE2  TYR  29           HE2      TYR  29  12.169   6.239   3.667
  197    HH   TYR  29           HH       TYR  29   9.848   5.282   5.936
  198    H    ILE  30           HN       ILE  30  11.507   2.860  -1.168
  199    HA   ILE  30           HA       ILE  30  13.500   2.575   0.772
  200    HB   ILE  30           HB       ILE  30  12.665   0.822  -1.523
  201   HG12  ILE  30          HG12      ILE  30  11.993   0.904   1.425
  202   HG13  ILE  30          HG11      ILE  30  10.924   1.270   0.085
  203   HG21  ILE  30          HG21      ILE  30  14.566   0.262   0.735
  204   HG22  ILE  30          HG22      ILE  30  14.872   0.151  -0.997
  205   HG23  ILE  30          HG23      ILE  30  13.787  -1.003  -0.215
  206   HD11  ILE  30          HD11      ILE  30  10.391  -0.876   0.990
  207   HD12  ILE  30          HD12      ILE  30  12.059  -1.420   0.782
  208   HD13  ILE  30          HD13      ILE  30  11.059  -1.069  -0.630
  209    H    GLY  31           HN       GLY  31  13.711   3.072  -2.720
  210    HA2  GLY  31           HA2      GLY  31  16.536   2.623  -2.846
  211    HA3  GLY  31           HA1      GLY  31  15.547   3.380  -4.091
  212    H    ALA  32           HN       ALA  32  14.627   5.155  -1.704
  213    HA   ALA  32           HA       ALA  32  16.691   7.193  -2.059
  214    HB1  ALA  32           HB1      ALA  32  15.076   8.750  -1.276
  215    HB2  ALA  32           HB2      ALA  32  14.048   7.458  -0.654
  216    HB3  ALA  32           HB3      ALA  32  14.240   7.671  -2.398
  217    H    GLN  33           HN       GLN  33  15.417   5.001   0.286
  218    HA   GLN  33           HA       GLN  33  15.930   6.304   2.648
  219    HB2  GLN  33           HB2      GLN  33  15.823   3.425   1.890
  220    HB3  GLN  33           HB1      GLN  33  16.201   3.921   3.537
  221    HG2  GLN  33           HG2      GLN  33  13.873   5.180   2.271
  222    HG3  GLN  33           HG1      GLN  33  13.734   3.485   2.685
  223   HE21  GLN  33          HE21      GLN  33  14.173   6.711   3.906
  224   HE22  GLN  33          HE22      GLN  33  13.818   6.352   5.560
  225    H    ASP  34           HN       ASP  34  17.552   6.001   4.203
  226    HA   ASP  34           HA       ASP  34  20.190   6.270   3.254
  227    HB2  ASP  34           HB2      ASP  34  19.224   7.210   5.384
  228    HB3  ASP  34           HB1      ASP  34  19.351   5.592   6.056
  229    H    ASP  35           HN       ASP  35  18.300   3.670   4.444
  230    HA   ASP  35           HA       ASP  35  20.358   1.809   3.479
  231    HB2  ASP  35           HB2      ASP  35  18.702   0.856   5.770
  232    HB3  ASP  35           HB1      ASP  35  20.307   0.373   5.271
  233    HA   PRO  36           HA       PRO  36  16.468   0.874   1.334
  234    HB2  PRO  36           HB2      PRO  36  17.587  -0.156  -0.834
  235    HB3  PRO  36           HB1      PRO  36  17.676   1.576  -0.530
  236    HG2  PRO  36           HG2      PRO  36  19.721  -0.519   0.153
  237    HG3  PRO  36           HG1      PRO  36  19.958   0.951  -0.809
  238    HD2  PRO  36           HD2      PRO  36  20.561   0.940   1.776
  239    HD3  PRO  36           HD1      PRO  36  19.754   2.348   1.051
  240    H    THR  37           HN       THR  37  18.813  -0.877   2.748
  241    HA   THR  37           HA       THR  37  18.240  -3.471   1.733
  242    HB   THR  37           HB       THR  37  19.959  -4.212   3.238
  243    HG1  THR  37           HG1      THR  37  20.779  -2.315   4.680
  244   HG21  THR  37          HG21      THR  37  20.551  -1.415   2.260
  245   HG22  THR  37          HG22      THR  37  20.734  -2.904   1.323
  246   HG23  THR  37          HG23      THR  37  21.764  -2.612   2.726
  247    H    ASN  38           HN       ASN  38  17.305  -1.579   4.453
  248    HA   ASN  38           HA       ASN  38  15.067  -3.295   4.981
  249    HB2  ASN  38           HB2      ASN  38  17.100  -4.269   6.166
  250    HB3  ASN  38           HB1      ASN  38  17.032  -2.856   7.218
  251   HD21  ASN  38          HD21      ASN  38  15.592  -5.882   6.373
  252   HD22  ASN  38          HD22      ASN  38  14.465  -5.952   7.684
  253    HA   PRO  39           HA       PRO  39  14.862   1.402   5.664
  254    HB2  PRO  39           HB2      PRO  39  12.484   1.589   4.267
  255    HB3  PRO  39           HB1      PRO  39  14.093   1.917   3.622
  256    HG2  PRO  39           HG2      PRO  39  12.430  -0.541   3.378
  257    HG3  PRO  39           HG1      PRO  39  13.490   0.223   2.199
  258    HD2  PRO  39           HD2      PRO  39  14.223  -1.968   3.499
  259    HD3  PRO  39           HD1      PRO  39  15.385  -0.704   3.087
  260    H    SER  40           HN       SER  40  12.898   2.683   6.360
  261    HA   SER  40           HA       SER  40  11.862   1.558   8.746
  262    HB2  SER  40           HB2      SER  40  11.020   4.083   7.304
  263    HB3  SER  40           HB1      SER  40  10.673   3.688   8.987
  264    HG   SER  40           HG       SER  40  13.288   3.429   8.622
  265    H    GLU  41           HN       GLU  41   9.381   2.123   9.154
  266    HA   GLU  41           HA       GLU  41   7.829   0.328   7.598
  267    HB2  GLU  41           HB2      GLU  41   7.116   0.487   9.804
  268    HB3  GLU  41           HB1      GLU  41   7.333   2.225   9.860
  269    HG2  GLU  41           HG2      GLU  41   5.386   2.522   8.481
  270    HG3  GLU  41           HG1      GLU  41   5.135   0.779   8.418
  271    H    ILE  42           HN       ILE  42   6.499   0.697   5.965
  272    HA   ILE  42           HA       ILE  42   6.683   3.351   4.772
  273    HB   ILE  42           HB       ILE  42   6.331   0.606   3.614
  274   HG12  ILE  42          HG12      ILE  42   8.469   2.677   3.670
  275   HG13  ILE  42          HG11      ILE  42   8.580   0.930   3.831
  276   HG21  ILE  42          HG21      ILE  42   6.061   1.600   1.447
  277   HG22  ILE  42          HG22      ILE  42   6.145   3.214   2.139
  278   HG23  ILE  42          HG23      ILE  42   4.786   2.158   2.523
  279   HD11  ILE  42          HD11      ILE  42   8.120   2.446   1.287
  280   HD12  ILE  42          HD12      ILE  42   8.205   0.687   1.437
  281   HD13  ILE  42          HD13      ILE  42   9.624   1.673   1.793
  282    H    THR  43           HN       THR  43   4.908   4.550   4.559
  283    HA   THR  43           HA       THR  43   2.314   3.185   4.412
  284    HB   THR  43           HB       THR  43   1.262   5.056   5.636
  285    HG1  THR  43           HG1      THR  43   2.797   6.367   6.912
  286   HG21  THR  43          HG21      THR  43   3.444   3.664   7.193
  287   HG22  THR  43          HG22      THR  43   1.860   2.981   6.810
  288   HG23  THR  43          HG23      THR  43   1.984   4.387   7.870
  289    H    LEU  44           HN       LEU  44   0.606   4.701   3.573
  290    HA   LEU  44           HA       LEU  44   1.399   5.527   1.012
  291    HB2  LEU  44           HB2      LEU  44  -1.074   6.310   2.482
  292    HB3  LEU  44           HB1      LEU  44  -0.835   6.318   0.763
  293    HG   LEU  44           HG       LEU  44  -1.246   4.018   2.582
  294   HD11  LEU  44          HD11      LEU  44  -2.838   5.424   0.850
  295   HD12  LEU  44          HD12      LEU  44  -3.186   3.850   1.558
  296   HD13  LEU  44          HD13      LEU  44  -2.436   3.954  -0.036
  297   HD21  LEU  44          HD21      LEU  44  -0.595   2.508   0.740
  298   HD22  LEU  44          HD22      LEU  44   0.760   3.424   1.391
  299   HD23  LEU  44          HD23      LEU  44   0.028   3.903  -0.136
  300    H    ALA  45           HN       ALA  45   0.771   7.177   3.983
  301    HA   ALA  45           HA       ALA  45   0.863   9.815   3.015
  302    HB1  ALA  45           HB1      ALA  45   1.095  10.420   5.384
  303    HB2  ALA  45           HB2      ALA  45   1.386   8.720   5.779
  304    HB3  ALA  45           HB3      ALA  45  -0.189   9.228   5.120
  305    H    LYS  46           HN       LYS  46   3.308   7.520   3.911
  306    HA   LYS  46           HA       LYS  46   5.496   9.401   3.846
  307    HB2  LYS  46           HB2      LYS  46   5.315   6.425   4.011
  308    HB3  LYS  46           HB1      LYS  46   6.830   7.283   3.991
  309    HG2  LYS  46           HG2      LYS  46   6.305   8.365   6.061
  310    HG3  LYS  46           HG1      LYS  46   4.684   7.660   6.047
  311    HD2  LYS  46           HD2      LYS  46   5.804   5.402   6.001
  312    HD3  LYS  46           HD1      LYS  46   7.317   6.246   6.349
  313    HE2  LYS  46           HE2      LYS  46   4.815   6.359   8.010
  314    HE3  LYS  46           HE1      LYS  46   6.239   5.354   8.354
  315    HZ1  LYS  46           HZ1      LYS  46   6.282   7.384   9.656
  316    HZ2  LYS  46           HZ2      LYS  46   6.187   8.325   8.259
  317    HZ3  LYS  46           HZ3      LYS  46   7.560   7.382   8.549
  318    H    LEU  47           HN       LEU  47   4.033   6.969   1.809
  319    HA   LEU  47           HA       LEU  47   6.049   6.926  -0.170
  320    HB2  LEU  47           HB2      LEU  47   3.194   6.009  -0.064
  321    HB3  LEU  47           HB1      LEU  47   4.159   5.847  -1.522
  322    HG   LEU  47           HG       LEU  47   4.733   4.595   1.159
  323   HD11  LEU  47          HD11      LEU  47   4.308   2.491  -0.027
  324   HD12  LEU  47          HD12      LEU  47   3.854   3.404  -1.465
  325   HD13  LEU  47          HD13      LEU  47   2.890   3.537   0.005
  326   HD21  LEU  47          HD21      LEU  47   6.810   5.173   0.057
  327   HD22  LEU  47          HD22      LEU  47   6.253   4.425  -1.440
  328   HD23  LEU  47          HD23      LEU  47   6.556   3.431  -0.017
  329    H    ALA  48           HN       ALA  48   3.777   9.217   0.622
  330    HA   ALA  48           HA       ALA  48   2.576  10.163  -1.590
  331    HB1  ALA  48           HB1      ALA  48   2.550  11.059   0.808
  332    HB2  ALA  48           HB2      ALA  48   2.302  12.195  -0.518
  333    HB3  ALA  48           HB3      ALA  48   3.870  12.105   0.276
  334    HA   PRO  49           HA       PRO  49   6.296  12.933  -2.954
  335    HB2  PRO  49           HB2      PRO  49   8.604  11.695  -1.581
  336    HB3  PRO  49           HB1      PRO  49   8.180  13.396  -1.741
  337    HG2  PRO  49           HG2      PRO  49   7.913  12.196   0.598
  338    HG3  PRO  49           HG1      PRO  49   6.647  13.306   0.023
  339    HD2  PRO  49           HD2      PRO  49   6.738  10.317  -0.157
  340    HD3  PRO  49           HD1      PRO  49   5.445  11.341   0.482
  341    H    TYR  50           HN       TYR  50   6.537   9.549  -2.482
  342    HA   TYR  50           HA       TYR  50   8.488   9.173  -4.630
  343    HB2  TYR  50           HB2      TYR  50   7.308   7.144  -2.735
  344    HB3  TYR  50           HB1      TYR  50   8.704   6.920  -3.785
  345    HD1  TYR  50           HD1      TYR  50  10.739   8.453  -3.360
  346    HD2  TYR  50           HD2      TYR  50   7.586   7.890  -0.578
  347    HE1  TYR  50           HE1      TYR  50  12.203   9.269  -1.559
  348    HE2  TYR  50           HE2      TYR  50   9.036   8.703   1.244
  349    HH   TYR  50           HH       TYR  50  11.976  10.295   0.669
  350    H    MET  51           HN       MET  51   5.199   9.299  -4.286
  351    HA   MET  51           HA       MET  51   4.388   7.023  -5.761
  352    HB2  MET  51           HB2      MET  51   2.973   9.613  -5.202
  353    HB3  MET  51           HB1      MET  51   2.225   8.219  -5.972
  354    HG2  MET  51           HG2      MET  51   3.451   8.222  -3.236
  355    HG3  MET  51           HG1      MET  51   1.727   8.382  -3.577
  356    HE1  MET  51           HE1      MET  51   1.091   4.890  -5.331
  357    HE2  MET  51           HE2      MET  51   2.025   6.083  -6.231
  358    HE3  MET  51           HE3      MET  51   0.617   6.591  -5.296
  359    H    SER  52           HN       SER  52   3.587   6.879  -7.818
  360    HA   SER  52           HA       SER  52   5.119   8.496  -9.693
  361    HB2  SER  52           HB2      SER  52   3.540   5.982 -10.251
  362    HB3  SER  52           HB1      SER  52   4.800   6.700 -11.255
  363    HG   SER  52           HG       SER  52   5.487   4.889  -9.921
  364    H    LYS  53           HN       LYS  53   1.768   7.467  -9.138
  365    HA   LYS  53           HA       LYS  53   0.838   9.265 -11.203
  366    HB2  LYS  53           HB2      LYS  53  -0.817   7.760 -11.380
  367    HB3  LYS  53           HB1      LYS  53  -0.024   6.804 -10.148
  368    HG2  LYS  53           HG2      LYS  53  -1.994   8.972  -9.500
  369    HG3  LYS  53           HG1      LYS  53  -2.469   7.305  -9.795
  370    HD2  LYS  53           HD2      LYS  53  -0.998   6.606  -7.917
  371    HD3  LYS  53           HD1      LYS  53  -0.632   8.313  -7.605
  372    HE2  LYS  53           HE2      LYS  53  -2.852   6.743  -6.693
  373    HE3  LYS  53           HE1      LYS  53  -2.414   8.415  -6.299
  374    HZ1  LYS  53           HZ1      LYS  53  -4.438   8.770  -7.226
  375    HZ2  LYS  53           HZ2      LYS  53  -4.369   7.392  -8.210
  376    HZ3  LYS  53           HZ3      LYS  53  -3.533   8.795  -8.660
  377    H    ASN  54           HN       ASN  54  -0.072  11.230 -10.773
  378    HA   ASN  54           HA       ASN  54  -1.234  12.894  -9.758
  379    HB2  ASN  54           HB2      ASN  54  -2.863  11.092  -9.383
  380    HB3  ASN  54           HB1      ASN  54  -2.087  10.708  -7.847
  381   HD21  ASN  54          HD21      ASN  54  -4.072  12.991  -9.570
  382   HD22  ASN  54          HD22      ASN  54  -4.613  13.876  -8.183
  383    H    ALA  55           HN       ALA  55  -0.102  10.912  -7.127
  384    HA   ALA  55           HA       ALA  55  -0.264  12.735  -5.090
  385    HB1  ALA  55           HB1      ALA  55  -0.081  10.725  -4.206
  386    HB2  ALA  55           HB2      ALA  55   1.663  10.935  -4.338
  387    HB3  ALA  55           HB3      ALA  55   0.769  10.080  -5.612
  388    H    LYS  56           HN       LYS  56   1.343  13.586  -3.750
  389    HA   LYS  56           HA       LYS  56   4.045  13.911  -4.515
  390    HB2  LYS  56           HB2      LYS  56   2.942  15.558  -6.047
  391    HB3  LYS  56           HB1      LYS  56   2.325  16.392  -4.630
  392    HG2  LYS  56           HG2      LYS  56   4.279  17.527  -5.456
  393    HG3  LYS  56           HG1      LYS  56   4.628  16.803  -3.887
  394    HD2  LYS  56           HD2      LYS  56   6.497  16.438  -5.368
  395    HD3  LYS  56           HD1      LYS  56   5.703  14.898  -5.044
  396    HE2  LYS  56           HE2      LYS  56   4.525  15.079  -7.197
  397    HE3  LYS  56           HE1      LYS  56   5.361  16.597  -7.515
  398    HZ1  LYS  56           HZ1      LYS  56   6.483  14.824  -8.643
  399    HZ2  LYS  56           HZ2      LYS  56   6.604  13.920  -7.221
  400    HZ3  LYS  56           HZ3      LYS  56   7.474  15.359  -7.380
  401    H    ASN  57           HN       ASN  57   1.313  15.133  -2.647
  402    HA   ASN  57           HA       ASN  57   3.001  14.989  -0.257
  403    HB2  ASN  57           HB2      ASN  57   0.711  16.856  -0.861
  404    HB3  ASN  57           HB1      ASN  57   1.273  16.555   0.783
  405   HD21  ASN  57          HD21      ASN  57   3.328  17.277   1.385
  406   HD22  ASN  57          HD22      ASN  57   4.177  18.480   0.479
  407    H    GLU  58           HN       GLU  58   1.758  14.525   1.699
  408    HA   GLU  58           HA       GLU  58   0.378  12.124   1.517
  409    HB2  GLU  58           HB2      GLU  58   0.911  12.173   3.678
  410    HB3  GLU  58           HB1      GLU  58   1.260  13.891   3.569
  411    HG2  GLU  58           HG2      GLU  58  -1.017  14.439   3.990
  412    HG3  GLU  58           HG1      GLU  58  -1.462  12.733   4.009
  413    H    ASP  59           HN       ASP  59  -0.726  15.419   1.727
  414    HA   ASP  59           HA       ASP  59  -3.447  15.036   2.135
  415    HB2  ASP  59           HB2      ASP  59  -2.163  17.204   2.187
  416    HB3  ASP  59           HB1      ASP  59  -2.237  17.188   0.435
  417    H    GLY  60           HN       GLY  60  -1.528  14.882  -0.773
  418    HA2  GLY  60           HA2      GLY  60  -3.885  14.702  -2.451
  419    HA3  GLY  60           HA1      GLY  60  -2.224  14.767  -3.002
  420    H    ILE  61           HN       ILE  61  -1.186  12.626  -1.498
  421    HA   ILE  61           HA       ILE  61  -1.672  10.632  -3.369
  422    HB   ILE  61           HB       ILE  61   0.470  10.691  -2.343
  423   HG12  ILE  61          HG12      ILE  61   0.801   8.439  -1.734
  424   HG13  ILE  61          HG11      ILE  61  -0.851   8.267  -1.147
  425   HG21  ILE  61          HG21      ILE  61  -0.860  10.151   0.305
  426   HG22  ILE  61          HG22      ILE  61  -0.193  11.697  -0.212
  427   HG23  ILE  61          HG23      ILE  61   0.870  10.308   0.013
  428   HD11  ILE  61          HD11      ILE  61  -0.213   8.820  -4.034
  429   HD12  ILE  61          HD12      ILE  61  -1.725   8.227  -3.330
  430   HD13  ILE  61          HD13      ILE  61  -0.297   7.186  -3.375
  431    H    VAL  62           HN       VAL  62  -2.431  10.581   0.044
  432    HA   VAL  62           HA       VAL  62  -3.537   8.004  -0.078
  433    HB   VAL  62           HB       VAL  62  -3.931  10.125   2.029
  434   HG11  VAL  62          HG11      VAL  62  -4.111   7.148   2.230
  435   HG12  VAL  62          HG12      VAL  62  -5.504   8.233   2.109
  436   HG13  VAL  62          HG13      VAL  62  -4.421   8.320   3.507
  437   HG21  VAL  62          HG21      VAL  62  -1.670   8.509   1.243
  438   HG22  VAL  62          HG22      VAL  62  -2.136   8.260   2.930
  439   HG23  VAL  62          HG23      VAL  62  -1.751   9.888   2.348
  440    H    ASN  63           HN       ASN  63  -4.928  11.208  -0.012
  441    HA   ASN  63           HA       ASN  63  -7.629  10.441   0.001
  442    HB2  ASN  63           HB2      ASN  63  -6.779  12.719   0.546
  443    HB3  ASN  63           HB1      ASN  63  -6.440  12.969  -1.164
  444   HD21  ASN  63          HD21      ASN  63  -7.844  14.744  -1.192
  445   HD22  ASN  63          HD22      ASN  63  -9.562  14.541  -1.192
  446    H    SER  64           HN       SER  64  -5.290  10.742  -2.582
  447    HA   SER  64           HA       SER  64  -7.217  10.513  -4.708
  448    HB2  SER  64           HB2      SER  64  -5.094  11.683  -5.082
  449    HB3  SER  64           HB1      SER  64  -4.197  10.211  -4.719
  450    HG   SER  64           HG       SER  64  -5.902  10.733  -6.925
  451    H    LEU  65           HN       LEU  65  -5.610   8.392  -2.605
  452    HA   LEU  65           HA       LEU  65  -5.722   6.084  -4.347
  453    HB2  LEU  65           HB2      LEU  65  -4.886   6.476  -1.486
  454    HB3  LEU  65           HB1      LEU  65  -4.877   4.915  -2.283
  455    HG   LEU  65           HG       LEU  65  -3.282   7.312  -3.137
  456   HD11  LEU  65          HD11      LEU  65  -2.418   4.789  -1.750
  457   HD12  LEU  65          HD12      LEU  65  -2.591   6.362  -0.976
  458   HD13  LEU  65          HD13      LEU  65  -1.385   6.129  -2.236
  459   HD21  LEU  65          HD21      LEU  65  -2.114   5.652  -4.542
  460   HD22  LEU  65          HD22      LEU  65  -3.803   5.886  -4.998
  461   HD23  LEU  65          HD23      LEU  65  -3.328   4.459  -4.073
  462    H    ALA  66           HN       ALA  66  -6.783   4.112  -3.722
  463    HA   ALA  66           HA       ALA  66  -9.469   4.264  -3.182
  464    HB1  ALA  66           HB1      ALA  66  -8.401   2.233  -4.086
  465    HB2  ALA  66           HB2      ALA  66  -9.420   1.871  -2.681
  466    HB3  ALA  66           HB3      ALA  66  -7.662   1.936  -2.507
  467    H    LYS  67           HN       LYS  67 -10.745   4.155  -1.464
  468    HA   LYS  67           HA       LYS  67  -9.418   4.461   1.132
  469    HB2  LYS  67           HB2      LYS  67 -12.073   5.516   0.183
  470    HB3  LYS  67           HB1      LYS  67 -11.488   5.648   1.831
  471    HG2  LYS  67           HG2      LYS  67 -10.454   6.999  -0.633
  472    HG3  LYS  67           HG1      LYS  67 -11.008   7.723   0.879
  473    HD2  LYS  67           HD2      LYS  67  -9.042   6.470   1.956
  474    HD3  LYS  67           HD1      LYS  67  -8.449   6.272   0.302
  475    HE2  LYS  67           HE2      LYS  67  -7.440   8.217   1.422
  476    HE3  LYS  67           HE1      LYS  67  -8.397   8.674   0.009
  477    HZ1  LYS  67           HZ1      LYS  67  -9.389   8.805   2.808
  478    HZ2  LYS  67           HZ2      LYS  67 -10.181   9.374   1.426
  479    HZ3  LYS  67           HZ3      LYS  67  -8.762  10.123   1.954
  480    H    ASP  68           HN       ASP  68  -9.979   3.186   2.775
  481    HA   ASP  68           HA       ASP  68 -11.291   0.751   2.048
  482    HB2  ASP  68           HB2      ASP  68  -9.321   0.743   3.548
  483    HB3  ASP  68           HB1      ASP  68 -10.247   1.601   4.772
  484    H    LYS  69           HN       LYS  69 -13.101  -0.178   3.323
  485    HA   LYS  69           HA       LYS  69 -15.195   1.768   3.185
  486    HB2  LYS  69           HB2      LYS  69 -15.274  -0.671   2.433
  487    HB3  LYS  69           HB1      LYS  69 -15.535  -1.037   4.130
  488    HG2  LYS  69           HG2      LYS  69 -17.589   0.007   4.187
  489    HG3  LYS  69           HG1      LYS  69 -17.253   0.970   2.746
  490    HD2  LYS  69           HD2      LYS  69 -18.754  -0.646   2.002
  491    HD3  LYS  69           HD1      LYS  69 -17.180  -1.283   1.525
  492    HE2  LYS  69           HE2      LYS  69 -18.382  -3.094   2.473
  493    HE3  LYS  69           HE1      LYS  69 -17.183  -2.591   3.666
  494    HZ1  LYS  69           HZ1      LYS  69 -19.405  -3.013   4.613
  495    HZ2  LYS  69           HZ2      LYS  69 -20.018  -1.730   3.698
  496    HZ3  LYS  69           HZ3      LYS  69 -18.857  -1.435   4.890
  497    H    SER  70           HN       SER  70 -14.010  -0.349   5.818
  498    HA   SER  70           HA       SER  70 -15.414   1.425   7.689
  499    HB2  SER  70           HB2      SER  70 -14.400  -1.387   8.020
  500    HB3  SER  70           HB1      SER  70 -15.053  -0.426   9.345
  501    HG   SER  70           HG       SER  70 -16.987  -0.223   8.040
  502    H    GLY  71           HN       GLY  71 -12.271   0.054   6.951
  503    HA2  GLY  71           HA2      GLY  71 -10.163   0.687   7.612
  504    HA3  GLY  71           HA1      GLY  71 -10.882   2.130   8.314
  505    H    ASN  72           HN       ASN  72 -12.219  -0.847   9.326
  506    HA   ASN  72           HA       ASN  72 -11.568  -0.172  12.027
  507    HB2  ASN  72           HB2      ASN  72 -12.993  -2.077  12.651
  508    HB3  ASN  72           HB1      ASN  72 -13.789  -0.995  11.521
  509   HD21  ASN  72          HD21      ASN  72 -15.223  -2.453  10.738
  510   HD22  ASN  72          HD22      ASN  72 -14.774  -3.826   9.788
  511    H    SER  73           HN       SER  73  -9.902  -1.872   9.732
  512    HA   SER  73           HA       SER  73  -8.700  -3.714  11.660
  513    HB2  SER  73           HB2      SER  73  -9.416  -4.621   9.457
  514    HB3  SER  73           HB1      SER  73  -8.269  -3.542   8.666
  515    HG   SER  73           HG       SER  73  -6.698  -4.658  10.195
  516    H    SER  74           HN       SER  74  -8.312  -0.634  10.856
  517    HA   SER  74           HA       SER  74  -6.668   0.912  11.024
  518    HB2  SER  74           HB2      SER  74  -6.251  -0.303  13.176
  519    HB3  SER  74           HB1      SER  74  -5.047  -1.281  12.341
  520    HG   SER  74           HG       SER  74  -3.790   0.289  13.019
  521    H    THR  75           HN       THR  75  -6.334   1.118   8.818
  522    HA   THR  75           HA       THR  75  -4.456  -0.663   7.506
  523    HB   THR  75           HB       THR  75  -6.557   0.091   6.366
  524    HG1  THR  75           HG1      THR  75  -4.027   0.649   5.186
  525   HG21  THR  75          HG21      THR  75  -5.111   2.726   6.085
  526   HG22  THR  75          HG22      THR  75  -6.458   2.438   7.189
  527   HG23  THR  75          HG23      THR  75  -6.703   2.307   5.448
  528    H    SER  76           HN       SER  76  -4.198   2.012   9.387
  529    HA   SER  76           HA       SER  76  -2.434   3.300   9.980
  530    HB2  SER  76           HB2      SER  76  -1.076   1.261   9.367
  531    HB3  SER  76           HB1      SER  76  -0.839   1.980   7.775
  532    HG   SER  76           HG       SER  76   0.635   2.369   9.856
  533    H    ALA  77           HN       ALA  77  -2.850   2.993   6.476
  534    HA   ALA  77           HA       ALA  77  -2.070   5.703   5.925
  535    HB1  ALA  77           HB1      ALA  77  -3.684   3.832   4.206
  536    HB2  ALA  77           HB2      ALA  77  -1.921   3.859   4.270
  537    HB3  ALA  77           HB3      ALA  77  -2.805   5.278   3.685
  538    HA   PRO  78           HA       PRO  78  -5.688   7.598   7.572
  539    HB2  PRO  78           HB2      PRO  78  -4.922   9.593   5.497
  540    HB3  PRO  78           HB1      PRO  78  -5.349   9.866   7.187
  541    HG2  PRO  78           HG2      PRO  78  -2.828   9.956   6.462
  542    HG3  PRO  78           HG1      PRO  78  -3.275   9.063   7.922
  543    HD2  PRO  78           HD2      PRO  78  -2.590   8.017   5.218
  544    HD3  PRO  78           HD1      PRO  78  -2.144   7.385   6.816
  545    H    GLY  79           HN       GLY  79  -7.433   6.450   6.908
  546    HA2  GLY  79           HA2      GLY  79  -9.478   6.270   5.869
  547    HA3  GLY  79           HA1      GLY  79  -9.004   7.567   4.795
  548    H    SER  80           HN       SER  80  -6.539   5.553   4.290
  549    HA   SER  80           HA       SER  80  -7.707   4.849   1.725
  550    HB2  SER  80           HB2      SER  80  -5.348   5.804   2.176
  551    HB3  SER  80           HB1      SER  80  -4.907   4.145   2.563
  552    HG   SER  80           HG       SER  80  -6.292   4.717   0.178
  553    H    ALA  81           HN       ALA  81  -6.698   2.765   0.791
  554    HA   ALA  81           HA       ALA  81  -7.493   0.548   2.536
  555    HB1  ALA  81           HB1      ALA  81  -8.976   1.045   0.594
  556    HB2  ALA  81           HB2      ALA  81  -8.288  -0.583   0.561
  557    HB3  ALA  81           HB3      ALA  81  -7.621   0.683  -0.475
  558    H    HIS  82           HN       HIS  82  -4.825   1.714   2.346
  559    HA   HIS  82           HA       HIS  82  -3.458  -0.709   1.451
  560    HB2  HIS  82           HB2      HIS  82  -2.621   2.127   0.928
  561    HB3  HIS  82           HB1      HIS  82  -1.503   0.793   0.856
  562    HD1  HIS  82           HD1      HIS  82  -1.972  -1.000  -1.054
  563    HD2  HIS  82           HD2      HIS  82  -4.183   2.513  -1.292
  564    HE1  HIS  82           HE1      HIS  82  -2.881  -0.931  -3.394
  565    HE2  HIS  82           HE2      HIS  82  -4.330   1.125  -3.470
  566    H    GLN  83           HN       GLN  83  -2.280  -1.637   2.937
  567    HA   GLN  83           HA       GLN  83  -0.954  -0.042   4.999
  568    HB2  GLN  83           HB2      GLN  83  -3.048  -0.874   6.015
  569    HB3  GLN  83           HB1      GLN  83  -2.631  -2.511   5.540
  570    HG2  GLN  83           HG2      GLN  83  -0.718  -1.028   7.262
  571    HG3  GLN  83           HG1      GLN  83  -2.217  -1.606   7.985
  572   HE21  GLN  83          HE21      GLN  83   0.538  -2.417   8.492
  573   HE22  GLN  83          HE22      GLN  83   0.594  -4.121   8.198
  574    H    ILE  84           HN       ILE  84   1.150  -0.596   4.936
  575    HA   ILE  84           HA       ILE  84   1.840  -2.948   3.410
  576    HB   ILE  84           HB       ILE  84   3.147  -0.395   4.152
  577   HG12  ILE  84          HG12      ILE  84   3.509  -1.663   1.553
  578   HG13  ILE  84          HG11      ILE  84   1.826  -1.429   1.992
  579   HG21  ILE  84          HG21      ILE  84   4.838  -2.013   4.812
  580   HG22  ILE  84          HG22      ILE  84   5.317  -1.197   3.324
  581   HG23  ILE  84          HG23      ILE  84   4.679  -2.839   3.262
  582   HD11  ILE  84          HD11      ILE  84   2.418   0.979   2.430
  583   HD12  ILE  84          HD12      ILE  84   2.514   0.463   0.747
  584   HD13  ILE  84          HD13      ILE  84   3.987   0.640   1.698
  585    H    ASP  85           HN       ASP  85   2.799  -4.703   4.193
  586    HA   ASP  85           HA       ASP  85   3.045  -5.054   7.053
  587    HB2  ASP  85           HB2      ASP  85   2.176  -6.881   5.562
  588    HB3  ASP  85           HB1      ASP  85   3.760  -6.965   4.812
  589    H    THR  86           HN       THR  86   4.807  -4.393   8.065
  590    HA   THR  86           HA       THR  86   7.224  -3.937   6.551
  591    HB   THR  86           HB       THR  86   7.993  -2.929   8.730
  592    HG1  THR  86           HG1      THR  86   6.783  -3.416  10.407
  593   HG21  THR  86          HG21      THR  86   6.512  -0.976   8.457
  594   HG22  THR  86          HG22      THR  86   5.419  -1.966   7.484
  595   HG23  THR  86          HG23      THR  86   7.050  -1.620   6.902
  596    H    THR  87           HN       THR  87   5.947  -6.306   8.645
  597    HA   THR  87           HA       THR  87   8.250  -7.435   9.741
  598    HB   THR  87           HB       THR  87   5.694  -8.780   8.841
  599    HG1  THR  87           HG1      THR  87   6.489  -7.921  11.445
  600   HG21  THR  87          HG21      THR  87   7.479 -10.406   9.124
  601   HG22  THR  87          HG22      THR  87   6.298 -10.553  10.426
  602   HG23  THR  87          HG23      THR  87   7.842  -9.755  10.720
  603    H    ASN  88           HN       ASN  88   6.500  -8.373   6.779
  604    HA   ASN  88           HA       ASN  88   8.870  -9.849   5.874
  605    HB2  ASN  88           HB2      ASN  88   6.041  -9.753   4.813
  606    HB3  ASN  88           HB1      ASN  88   7.335 -10.712   4.102
  607   HD21  ASN  88          HD21      ASN  88   5.151 -10.363   6.773
  608   HD22  ASN  88          HD22      ASN  88   5.401 -11.942   7.441
  609    H    HIS  89           HN       HIS  89   7.237  -6.936   5.460
  610    HA   HIS  89           HA       HIS  89   7.718  -5.062   4.296
  611    HB2  HIS  89           HB2      HIS  89  10.039  -6.712   3.310
  612    HB3  HIS  89           HB1      HIS  89   9.718  -5.085   2.720
  613    HD1  HIS  89           HD1      HIS  89  11.772  -6.680   5.081
  614    HD2  HIS  89           HD2      HIS  89   9.365  -3.295   5.185
  615    HE1  HIS  89           HE1      HIS  89  12.649  -5.287   6.979
  616    HE2  HIS  89           HE2      HIS  89  11.041  -3.353   7.152
  617    H    LYS  90           HN       LYS  90   5.670  -6.279   3.586
  618    HA   LYS  90           HA       LYS  90   5.686  -6.628   0.664
  619    HB2  LYS  90           HB2      LYS  90   4.191  -7.830   2.912
  620    HB3  LYS  90           HB1      LYS  90   3.297  -7.608   1.426
  621    HG2  LYS  90           HG2      LYS  90   4.969  -8.952   0.237
  622    HG3  LYS  90           HG1      LYS  90   5.876  -9.146   1.740
  623    HD2  LYS  90           HD2      LYS  90   3.088 -10.143   1.154
  624    HD3  LYS  90           HD1      LYS  90   4.545 -11.119   1.365
  625    HE2  LYS  90           HE2      LYS  90   4.727 -10.333   3.677
  626    HE3  LYS  90           HE1      LYS  90   3.267  -9.376   3.471
  627    HZ1  LYS  90           HZ1      LYS  90   2.684 -11.396   4.551
  628    HZ2  LYS  90           HZ2      LYS  90   3.497 -12.334   3.405
  629    HZ3  LYS  90           HZ3      LYS  90   2.093 -11.498   2.966
  630    H    LEU  91           HN       LEU  91   4.115  -5.586  -0.546
  631    HA   LEU  91           HA       LEU  91   2.910  -3.214   0.667
  632    HB2  LEU  91           HB2      LEU  91   4.069  -3.283  -1.643
  633    HB3  LEU  91           HB1      LEU  91   2.677  -4.144  -2.162
  634    HG   LEU  91           HG       LEU  91   2.060  -2.117  -2.886
  635   HD11  LEU  91          HD11      LEU  91   0.622  -0.888  -1.280
  636   HD12  LEU  91          HD12      LEU  91   1.212  -1.953   0.007
  637   HD13  LEU  91          HD13      LEU  91   0.293  -2.619  -1.350
  638   HD21  LEU  91          HD21      LEU  91   3.507  -0.848  -0.599
  639   HD22  LEU  91          HD22      LEU  91   2.753  -0.019  -1.960
  640   HD23  LEU  91          HD23      LEU  91   4.130  -1.085  -2.231
  641    H    ILE  92           HN       ILE  92   1.187  -3.864   1.834
  642    HA   ILE  92           HA       ILE  92  -0.732  -5.697   0.639
  643    HB   ILE  92           HB       ILE  92  -0.128  -4.777   3.412
  644   HG12  ILE  92          HG12      ILE  92  -0.475  -7.353   3.723
  645   HG13  ILE  92          HG11      ILE  92  -0.334  -7.390   1.968
  646   HG21  ILE  92          HG21      ILE  92  -2.534  -4.455   3.257
  647   HG22  ILE  92          HG22      ILE  92  -2.173  -5.856   4.266
  648   HG23  ILE  92          HG23      ILE  92  -2.733  -6.085   2.613
  649   HD11  ILE  92          HD11      ILE  92   1.838  -6.383   2.088
  650   HD12  ILE  92          HD12      ILE  92   1.774  -7.844   3.077
  651   HD13  ILE  92          HD13      ILE  92   1.700  -6.257   3.838
  652    H    SER  93           HN       SER  93  -2.780  -5.105   0.214
  653    HA   SER  93           HA       SER  93  -3.551  -2.363   0.869
  654    HB2  SER  93           HB2      SER  93  -4.958  -4.141  -1.111
  655    HB3  SER  93           HB1      SER  93  -5.032  -2.387  -0.969
  656    HG   SER  93           HG       SER  93  -2.675  -3.831  -1.643
  657    H    THR  94           HN       THR  94  -5.460  -2.076   2.064
  658    HA   THR  94           HA       THR  94  -6.518  -4.573   3.181
  659    HB   THR  94           HB       THR  94  -5.685  -2.064   4.598
  660    HG1  THR  94           HG1      THR  94  -4.411  -4.154   4.278
  661   HG21  THR  94          HG21      THR  94  -7.575  -4.187   5.638
  662   HG22  THR  94          HG22      THR  94  -7.949  -2.485   5.380
  663   HG23  THR  94          HG23      THR  94  -6.800  -2.953   6.635
  664    H    PHE  95           HN       PHE  95  -8.501  -4.833   2.604
  665    HA   PHE  95           HA       PHE  95 -10.326  -2.527   2.641
  666    HB2  PHE  95           HB2      PHE  95 -10.205  -3.705   0.469
  667    HB3  PHE  95           HB1      PHE  95 -10.696  -5.175   1.294
  668    HD1  PHE  95           HD1      PHE  95 -12.974  -5.613   1.841
  669    HD2  PHE  95           HD2      PHE  95 -11.807  -1.792   0.334
  670    HE1  PHE  95           HE1      PHE  95 -15.338  -4.993   1.563
  671    HE2  PHE  95           HE2      PHE  95 -14.171  -1.180   0.062
  672    HZ   PHE  95           HZ       PHE  95 -15.938  -2.779   0.677
  673    H    THR  96           HN       THR  96 -11.475  -2.494   4.471
  674    HA   THR  96           HA       THR  96 -11.833  -4.933   5.958
  675    HB   THR  96           HB       THR  96 -13.129  -3.431   7.540
  676    HG1  THR  96           HG1      THR  96 -11.948  -1.402   5.911
  677   HG21  THR  96          HG21      THR  96 -10.334  -2.507   6.967
  678   HG22  THR  96          HG22      THR  96 -10.702  -4.118   7.625
  679   HG23  THR  96          HG23      THR  96 -11.147  -2.666   8.532
  680    HA   PRO  97           HA       PRO  97 -15.733  -5.704   3.836
  681    HB2  PRO  97           HB2      PRO  97 -16.069  -8.016   5.349
  682    HB3  PRO  97           HB1      PRO  97 -15.373  -7.936   3.731
  683    HG2  PRO  97           HG2      PRO  97 -14.056  -8.247   6.346
  684    HG3  PRO  97           HG1      PRO  97 -13.518  -8.750   4.736
  685    HD2  PRO  97           HD2      PRO  97 -12.497  -6.619   6.105
  686    HD3  PRO  97           HD1      PRO  97 -12.457  -6.792   4.345
  687    H    SER  98           HN       SER  98 -17.922  -5.988   4.694
  688    HA   SER  98           HA       SER  98 -18.476  -4.222   6.781
  689    HB2  SER  98           HB2      SER  98 -20.286  -6.383   5.702
  690    HB3  SER  98           HB1      SER  98 -20.783  -4.914   6.538
  691    HG   SER  98           HG       SER  98 -20.980  -4.662   4.295
  692    H    ASN  99           HN       ASN  99 -17.714  -7.564   6.828
  693    HA   ASN  99           HA       ASN  99 -18.844  -8.159   9.390
  694    HB2  ASN  99           HB2      ASN  99 -17.029  -9.531   7.478
  695    HB3  ASN  99           HB1      ASN  99 -17.070 -10.092   9.140
  696   HD21  ASN  99          HD21      ASN  99 -18.990 -10.995   9.946
  697   HD22  ASN  99          HD22      ASN  99 -20.227 -11.575   8.887
  698    H    GLY 100           HN       GLY 100 -15.974  -6.618   8.336
  699    HA2  GLY 100           HA2      GLY 100 -14.315  -5.606   9.602
  700    HA3  GLY 100           HA1      GLY 100 -15.060  -6.273  11.049
  701    H    GLY 101           HN       GLY 101 -14.507  -8.419   8.518
  702    HA2  GLY 101           HA2      GLY 101 -12.623  -9.909  10.157
  703    HA3  GLY 101           HA1      GLY 101 -13.461 -10.500   8.729
  704    H    GLN 102           HN       GLN 102 -11.292 -11.354   8.241
  705    HA   GLN 102           HA       GLN 102  -9.034  -9.886   7.725
  706    HB2  GLN 102           HB2      GLN 102 -10.141 -12.292   6.297
  707    HB3  GLN 102           HB1      GLN 102  -8.589 -11.581   5.875
  708    HG2  GLN 102           HG2      GLN 102  -7.800 -11.949   8.154
  709    HG3  GLN 102           HG1      GLN 102  -9.349 -12.684   8.568
  710   HE21  GLN 102          HE21      GLN 102  -9.843 -14.731   7.797
  711   HE22  GLN 102          HE22      GLN 102  -8.651 -15.767   7.091
  712    H    ALA 103           HN       ALA 103  -8.474  -8.397   6.405
  713    HA   ALA 103           HA       ALA 103 -10.398  -7.229   4.590
  714    HB1  ALA 103           HB1      ALA 103  -7.567  -6.458   5.274
  715    HB2  ALA 103           HB2      ALA 103  -9.052  -5.797   5.974
  716    HB3  ALA 103           HB3      ALA 103  -8.678  -5.519   4.269
  717    H    THR 104           HN       THR 104 -10.019  -6.690   2.539
  718    HA   THR 104           HA       THR 104  -8.970  -8.802   0.918
  719    HB   THR 104           HB       THR 104 -10.930  -6.776   0.735
  720    HG1  THR 104           HG1      THR 104 -10.165  -9.072  -0.668
  721   HG21  THR 104          HG21      THR 104 -10.523  -5.969  -1.540
  722   HG22  THR 104          HG22      THR 104  -8.911  -6.683  -1.488
  723   HG23  THR 104          HG23      THR 104  -9.335  -5.371  -0.390
  724    H    VAL 105           HN       VAL 105  -7.172  -8.663  -0.448
  725    HA   VAL 105           HA       VAL 105  -5.421  -6.384   0.146
  726    HB   VAL 105           HB       VAL 105  -4.630  -9.286   0.342
  727   HG11  VAL 105          HG11      VAL 105  -3.056  -6.779   0.875
  728   HG12  VAL 105          HG12      VAL 105  -2.781  -7.941  -0.420
  729   HG13  VAL 105          HG13      VAL 105  -2.516  -8.411   1.260
  730   HG21  VAL 105          HG21      VAL 105  -6.030  -8.645   2.223
  731   HG22  VAL 105          HG22      VAL 105  -5.038  -7.212   2.498
  732   HG23  VAL 105          HG23      VAL 105  -4.352  -8.818   2.754
  733    H    LEU 106           HN       LEU 106  -4.105  -5.737  -1.368
  734    HA   LEU 106           HA       LEU 106  -3.549  -7.403  -3.716
  735    HB2  LEU 106           HB2      LEU 106  -4.207  -4.534  -3.437
  736    HB3  LEU 106           HB1      LEU 106  -2.838  -4.877  -4.477
  737    HG   LEU 106           HG       LEU 106  -4.796  -4.672  -5.835
  738   HD11  LEU 106          HD11      LEU 106  -4.824  -6.818  -6.959
  739   HD12  LEU 106          HD12      LEU 106  -4.100  -7.593  -5.550
  740   HD13  LEU 106          HD13      LEU 106  -3.180  -6.401  -6.471
  741   HD21  LEU 106          HD21      LEU 106  -6.512  -5.089  -4.170
  742   HD22  LEU 106          HD22      LEU 106  -6.011  -6.773  -4.020
  743   HD23  LEU 106          HD23      LEU 106  -6.739  -6.197  -5.523
  744    H    THR 107           HN       THR 107  -1.550  -8.255  -3.406
  745    HA   THR 107           HA       THR 107   0.218  -6.820  -1.549
  746    HB   THR 107           HB       THR 107   0.448  -9.736  -2.249
  747    HG1  THR 107           HG1      THR 107  -1.386  -9.972  -1.224
  748   HG21  THR 107          HG21      THR 107   1.548  -9.864  -0.058
  749   HG22  THR 107          HG22      THR 107   1.314  -8.131   0.170
  750   HG23  THR 107          HG23      THR 107   2.373  -8.718  -1.113
  751    H    TYR 108           HN       TYR 108   2.384  -6.625  -1.889
  752    HA   TYR 108           HA       TYR 108   3.577  -7.665  -4.349
  753    HB2  TYR 108           HB2      TYR 108   3.302  -5.447  -5.046
  754    HB3  TYR 108           HB1      TYR 108   3.522  -4.820  -3.441
  755    HD1  TYR 108           HD1      TYR 108   5.476  -3.877  -2.824
  756    HD2  TYR 108           HD2      TYR 108   5.454  -6.528  -6.142
  757    HE1  TYR 108           HE1      TYR 108   7.789  -3.299  -3.273
  758    HE2  TYR 108           HE2      TYR 108   7.808  -5.973  -6.605
  759    HH   TYR 108           HH       TYR 108   9.384  -4.128  -6.165
  760    H    ASP 109           HN       ASP 109   5.676  -8.351  -4.071
  761    HA   ASP 109           HA       ASP 109   6.583  -8.438  -1.310
  762    HB2  ASP 109           HB2      ASP 109   7.851 -10.424  -2.096
  763    HB3  ASP 109           HB1      ASP 109   6.118 -10.605  -2.231
  764    H    TRP 110           HN       TRP 110   7.898  -6.695  -1.047
  765    HA   TRP 110           HA       TRP 110   9.863  -5.950  -2.996
  766    HB2  TRP 110           HB2      TRP 110   9.110  -4.178  -1.624
  767    HB3  TRP 110           HB1      TRP 110   9.355  -5.096  -0.149
  768    HD1  TRP 110           HD1      TRP 110  11.319  -3.160  -2.815
  769    HE1  TRP 110           HE1      TRP 110  13.609  -2.501  -1.831
  770    HE3  TRP 110           HE3      TRP 110  11.076  -5.718   1.592
  771    HZ2  TRP 110           HZ2      TRP 110  15.109  -3.015   0.508
  772    HZ3  TRP 110           HZ3      TRP 110  12.971  -5.584   3.152
  773    HH2  TRP 110           HH2      TRP 110  14.952  -4.260   2.626
  774    H    SER 111           HN       SER 111   9.974  -7.489   0.188
  775    HA   SER 111           HA       SER 111  12.771  -8.081  -0.029
  776    HB2  SER 111           HB2      SER 111  11.577  -7.600   2.135
  777    HB3  SER 111           HB1      SER 111  10.795  -9.165   1.977
  778    HG   SER 111           HG       SER 111  12.561 -10.104   2.624
  779    H    ALA 112           HN       ALA 112   9.796  -9.705  -0.695
  780    HA   ALA 112           HA       ALA 112   9.295 -11.733  -1.594
  781    HB1  ALA 112           HB1      ALA 112  10.745 -12.311  -3.482
  782    HB2  ALA 112           HB2      ALA 112  11.921 -11.126  -2.905
  783    HB3  ALA 112           HB3      ALA 112  10.324 -10.600  -3.432
  784    H    ASN 113           HN       ASN 113   9.628 -12.689   0.561
  785    HA   ASN 113           HA       ASN 113  12.097 -14.240   0.818
  786    HB2  ASN 113           HB2      ASN 113  11.400 -14.612   3.174
  787    HB3  ASN 113           HB1      ASN 113  11.602 -12.917   2.769
  788   HD21  ASN 113          HD21      ASN 113  10.326 -12.290   4.493
  789   HD22  ASN 113          HD22      ASN 113   8.606 -12.487   4.496
  790    H    GLY 114           HN       GLY 114   9.852 -14.898  -0.971
  791    HA2  GLY 114           HA2      GLY 114  10.001 -17.546  -1.093
  792    HA3  GLY 114           HA1      GLY 114   8.805 -17.348   0.177
  793    H    VAL 115           HN       VAL 115   6.945 -15.909  -0.380
  794    HA   VAL 115           HA       VAL 115   6.266 -15.945  -3.217
  795    HB   VAL 115           HB       VAL 115   5.473 -18.105  -2.284
  796   HG11  VAL 115          HG11      VAL 115   5.084 -17.397   0.010
  797   HG12  VAL 115          HG12      VAL 115   3.648 -18.156  -0.674
  798   HG13  VAL 115          HG13      VAL 115   3.728 -16.402  -0.519
  799   HG21  VAL 115          HG21      VAL 115   3.113 -17.912  -3.034
  800   HG22  VAL 115          HG22      VAL 115   4.272 -17.199  -4.155
  801   HG23  VAL 115          HG23      VAL 115   3.318 -16.159  -3.098
  802    H    ASN 116           HN       ASN 116   4.379 -14.629  -3.682
  803    HA   ASN 116           HA       ASN 116   4.322 -12.286  -1.986
  804    HB2  ASN 116           HB2      ASN 116   4.532 -12.196  -4.486
  805    HB3  ASN 116           HB1      ASN 116   2.883 -12.789  -4.594
  806   HD21  ASN 116          HD21      ASN 116   2.144 -10.966  -5.638
  807   HD22  ASN 116          HD22      ASN 116   1.959  -9.443  -4.836
  808    H    SER 117           HN       SER 117   3.179 -14.438  -0.708
  809    HA   SER 117           HA       SER 117   1.338 -15.146   0.421
  810    HB2  SER 117           HB2      SER 117   0.440 -12.295  -0.030
  811    HB3  SER 117           HB1      SER 117  -0.134 -13.385   1.234
  812    HG   SER 117           HG       SER 117   2.565 -13.242   1.241
  813    H    ASN 118           HN       ASN 118   1.207 -15.912  -2.200
  814    HA   ASN 118           HA       ASN 118  -1.678 -15.934  -2.645
  815    HB2  ASN 118           HB2      ASN 118   0.376 -14.965  -4.586
  816    HB3  ASN 118           HB1      ASN 118  -0.987 -15.886  -5.208
  817   HD21  ASN 118          HD21      ASN 118   0.014 -12.940  -3.652
  818   HD22  ASN 118          HD22      ASN 118  -1.466 -12.081  -3.902
  Start of MODEL    5
    1    H1   HIS   6           HT1      HIS   6 -20.103  -7.608  -5.253
    2    H2   HIS   6           HT2      HIS   6 -19.224  -8.476  -6.406
    3    H3   HIS   6           HT3      HIS   6 -20.887  -8.235  -6.612
    4    HA   HIS   6           HA       HIS   6 -19.710  -6.772  -8.063
    5    HB2  HIS   6           HB2      HIS   6 -21.033  -5.465  -5.691
    6    HB3  HIS   6           HB1      HIS   6 -20.482  -4.538  -7.081
    7    HD1  HIS   6           HD1      HIS   6 -23.382  -6.243  -5.819
    8    HD2  HIS   6           HD2      HIS   6 -21.758  -5.550  -9.583
    9    HE1  HIS   6           HE1      HIS   6 -25.258  -6.623  -7.445
   10    HE2  HIS   6           HE2      HIS   6 -24.209  -6.362  -9.719
   11    H    GLN   7           HN       GLN   7 -19.026  -5.677  -4.727
   12    HA   GLN   7           HA       GLN   7 -16.823  -4.111  -5.417
   13    HB2  GLN   7           HB2      GLN   7 -17.846  -3.801  -3.287
   14    HB3  GLN   7           HB1      GLN   7 -17.503  -5.460  -2.835
   15    HG2  GLN   7           HG2      GLN   7 -15.903  -4.211  -1.700
   16    HG3  GLN   7           HG1      GLN   7 -15.055  -4.873  -3.098
   17   HE21  GLN   7          HE21      GLN   7 -17.304  -2.166  -3.123
   18   HE22  GLN   7          HE22      GLN   7 -16.139  -0.969  -3.557
   19    H    ASP   8           HN       ASP   8 -17.087  -7.533  -4.930
   20    HA   ASP   8           HA       ASP   8 -14.414  -8.082  -4.323
   21    HB2  ASP   8           HB2      ASP   8 -14.903 -10.369  -5.114
   22    HB3  ASP   8           HB1      ASP   8 -16.143  -9.743  -4.031
   23    H    ASN   9           HN       ASN   9 -15.951  -7.294  -7.328
   24    HA   ASN   9           HA       ASN   9 -13.553  -7.861  -8.859
   25    HB2  ASN   9           HB2      ASN   9 -16.204  -6.602  -9.522
   26    HB3  ASN   9           HB1      ASN   9 -14.854  -6.557 -10.649
   27   HD21  ASN   9          HD21      ASN   9 -17.470  -7.847 -10.858
   28   HD22  ASN   9          HD22      ASN   9 -17.146  -9.519 -11.160
   29    H    ALA  10           HN       ALA  10 -15.259  -5.192  -7.437
   30    HA   ALA  10           HA       ALA  10 -13.833  -3.063  -8.601
   31    HB1  ALA  10           HB1      ALA  10 -14.680  -1.743  -6.700
   32    HB2  ALA  10           HB2      ALA  10 -15.290  -3.235  -5.968
   33    HB3  ALA  10           HB3      ALA  10 -15.942  -2.675  -7.514
   34    H    ARG  11           HN       ARG  11 -13.525  -4.553  -5.390
   35    HA   ARG  11           HA       ARG  11 -11.490  -3.019  -4.359
   36    HB2  ARG  11           HB2      ARG  11 -10.878  -5.026  -2.985
   37    HB3  ARG  11           HB1      ARG  11 -12.588  -4.618  -2.952
   38    HG2  ARG  11           HG2      ARG  11 -12.770  -6.859  -3.222
   39    HG3  ARG  11           HG1      ARG  11 -12.691  -6.375  -4.912
   40    HD2  ARG  11           HD2      ARG  11 -10.273  -6.855  -4.910
   41    HD3  ARG  11           HD1      ARG  11 -10.407  -7.418  -3.252
   42    HE   ARG  11           HE       ARG  11 -11.942  -8.695  -5.413
   43   HH11  ARG  11          HH11      ARG  11  -9.654  -8.897  -2.761
   44   HH12  ARG  11          HH12      ARG  11  -9.566 -10.624  -2.800
   45   HH21  ARG  11          HH21      ARG  11 -11.820 -10.970  -5.461
   46   HH22  ARG  11          HH22      ARG  11 -10.801 -11.805  -4.330
   47    H    LYS  12           HN       LYS  12 -11.302  -5.787  -6.444
   48    HA   LYS  12           HA       LYS  12  -8.537  -6.131  -6.348
   49    HB2  LYS  12           HB2      LYS  12 -10.335  -7.736  -7.204
   50    HB3  LYS  12           HB1      LYS  12 -10.293  -6.815  -8.704
   51    HG2  LYS  12           HG2      LYS  12  -8.913  -8.667  -9.029
   52    HG3  LYS  12           HG1      LYS  12  -7.816  -7.319  -8.741
   53    HD2  LYS  12           HD2      LYS  12  -7.802  -8.025  -6.314
   54    HD3  LYS  12           HD1      LYS  12  -8.619  -9.501  -6.835
   55    HE2  LYS  12           HE2      LYS  12  -6.764  -9.963  -8.366
   56    HE3  LYS  12           HE1      LYS  12  -5.966  -8.499  -7.797
   57    HZ1  LYS  12           HZ1      LYS  12  -5.869  -9.458  -5.581
   58    HZ2  LYS  12           HZ2      LYS  12  -5.093 -10.459  -6.699
   59    HZ3  LYS  12           HZ3      LYS  12  -6.634 -10.861  -6.132
   60    H    SER  13           HN       SER  13 -10.648  -4.237  -8.432
   61    HA   SER  13           HA       SER  13  -8.429  -3.535 -10.184
   62    HB2  SER  13           HB2      SER  13 -11.375  -2.810 -10.196
   63    HB3  SER  13           HB1      SER  13 -10.224  -2.352 -11.462
   64    HG   SER  13           HG       SER  13 -11.343  -4.835 -10.857
   65    H    ARG  14           HN       ARG  14 -10.655  -1.918  -7.952
   66    HA   ARG  14           HA       ARG  14  -9.808   0.711  -8.388
   67    HB2  ARG  14           HB2      ARG  14 -10.917   1.259  -6.302
   68    HB3  ARG  14           HB1      ARG  14 -11.899   0.095  -7.185
   69    HG2  ARG  14           HG2      ARG  14 -11.248  -1.672  -5.759
   70    HG3  ARG  14           HG1      ARG  14  -9.964  -0.695  -5.047
   71    HD2  ARG  14           HD2      ARG  14 -11.743  -0.805  -3.472
   72    HD3  ARG  14           HD1      ARG  14 -11.726   0.817  -4.148
   73    HE   ARG  14           HE       ARG  14 -13.677  -1.276  -4.816
   74   HH11  ARG  14          HH11      ARG  14 -12.738   2.098  -4.687
   75   HH12  ARG  14          HH12      ARG  14 -14.297   2.680  -5.169
   76   HH21  ARG  14          HH21      ARG  14 -15.744  -0.497  -5.450
   77   HH22  ARG  14          HH22      ARG  14 -16.006   1.212  -5.585
   78    H    ILE  15           HN       ILE  15  -8.596  -1.799  -6.251
   79    HA   ILE  15           HA       ILE  15  -6.788  -0.019  -4.902
   80    HB   ILE  15           HB       ILE  15  -6.835  -3.035  -5.044
   81   HG12  ILE  15          HG12      ILE  15  -7.760  -1.241  -2.782
   82   HG13  ILE  15          HG11      ILE  15  -8.853  -1.900  -3.997
   83   HG21  ILE  15          HG21      ILE  15  -5.383  -2.942  -3.089
   84   HG22  ILE  15          HG22      ILE  15  -5.400  -1.174  -3.150
   85   HG23  ILE  15          HG23      ILE  15  -4.646  -2.097  -4.454
   86   HD11  ILE  15          HD11      ILE  15  -8.752  -3.162  -1.851
   87   HD12  ILE  15          HD12      ILE  15  -7.088  -3.597  -2.268
   88   HD13  ILE  15          HD13      ILE  15  -8.427  -4.119  -3.312
   89    H    GLN  16           HN       GLN  16  -6.685  -2.493  -7.382
   90    HA   GLN  16           HA       GLN  16  -3.992  -2.832  -7.688
   91    HB2  GLN  16           HB2      GLN  16  -6.373  -3.518  -9.033
   92    HB3  GLN  16           HB1      GLN  16  -5.190  -3.027 -10.233
   93    HG2  GLN  16           HG2      GLN  16  -3.577  -4.588  -9.139
   94    HG3  GLN  16           HG1      GLN  16  -4.918  -5.132  -8.122
   95   HE21  GLN  16          HE21      GLN  16  -6.604  -6.275  -9.063
   96   HE22  GLN  16          HE22      GLN  16  -6.432  -7.090 -10.579
   97    H    SER  17           HN       SER  17  -6.046  -0.409  -9.304
   98    HA   SER  17           HA       SER  17  -4.131   0.543 -11.103
   99    HB2  SER  17           HB2      SER  17  -6.240   2.227  -9.735
  100    HB3  SER  17           HB1      SER  17  -5.520   2.500 -11.323
  101    HG   SER  17           HG       SER  17  -6.509   0.072 -11.381
  102    H    GLU  18           HN       GLU  18  -4.791   1.360  -7.772
  103    HA   GLU  18           HA       GLU  18  -2.722   3.372  -7.628
  104    HB2  GLU  18           HB2      GLU  18  -4.226   2.056  -5.375
  105    HB3  GLU  18           HB1      GLU  18  -3.427   3.616  -5.380
  106    HG2  GLU  18           HG2      GLU  18  -5.906   2.858  -6.867
  107    HG3  GLU  18           HG1      GLU  18  -5.773   3.954  -5.507
  108    H    HIS  19           HN       HIS  19  -3.254   0.046  -6.578
  109    HA   HIS  19           HA       HIS  19  -1.241  -0.348  -4.765
  110    HB2  HIS  19           HB2      HIS  19  -2.761  -2.106  -4.982
  111    HB3  HIS  19           HB1      HIS  19  -2.596  -2.201  -6.719
  112    HD1  HIS  19           HD1      HIS  19  -0.333  -2.831  -3.700
  113    HD2  HIS  19           HD2      HIS  19  -1.234  -4.379  -7.448
  114    HE1  HIS  19           HE1      HIS  19   1.061  -4.910  -3.923
  115    HE2  HIS  19           HE2      HIS  19   0.395  -5.905  -6.142
  116    H    ARG  20           HN       ARG  20  -0.951  -0.835  -8.299
  117    HA   ARG  20           HA       ARG  20   1.739  -1.570  -8.337
  118    HB2  ARG  20           HB2      ARG  20   0.299   0.137 -10.379
  119    HB3  ARG  20           HB1      ARG  20   1.782  -0.765 -10.649
  120    HG2  ARG  20           HG2      ARG  20   0.320  -2.815  -9.947
  121    HG3  ARG  20           HG1      ARG  20  -1.018  -1.747 -10.384
  122    HD2  ARG  20           HD2      ARG  20  -0.123  -1.449 -12.597
  123    HD3  ARG  20           HD1      ARG  20   1.321  -2.366 -12.179
  124    HE   ARG  20           HE       ARG  20  -1.071  -3.885 -11.818
  125   HH11  ARG  20          HH11      ARG  20   1.193  -2.751 -14.225
  126   HH12  ARG  20          HH12      ARG  20   0.922  -4.085 -15.299
  127   HH21  ARG  20          HH21      ARG  20  -1.449  -5.646 -13.247
  128   HH22  ARG  20          HH22      ARG  20  -0.584  -5.720 -14.750
  129    H    GLU  21           HN       GLU  21   0.310   1.687  -8.471
  130    HA   GLU  21           HA       GLU  21   2.672   3.160  -8.608
  131    HB2  GLU  21           HB2      GLU  21   0.137   3.905  -7.146
  132    HB3  GLU  21           HB1      GLU  21   1.384   5.011  -7.688
  133    HG2  GLU  21           HG2      GLU  21  -0.280   3.319  -9.508
  134    HG3  GLU  21           HG1      GLU  21  -0.649   4.988  -9.082
  135    H    LEU  22           HN       LEU  22   0.857   2.035  -5.735
  136    HA   LEU  22           HA       LEU  22   2.422   3.345  -3.822
  137    HB2  LEU  22           HB2      LEU  22   0.724   0.880  -3.640
  138    HB3  LEU  22           HB1      LEU  22   1.703   1.392  -2.284
  139    HG   LEU  22           HG       LEU  22  -0.369   2.279  -1.778
  140   HD11  LEU  22          HD11      LEU  22   1.044   4.468  -3.302
  141   HD12  LEU  22          HD12      LEU  22   1.388   3.972  -1.648
  142   HD13  LEU  22          HD13      LEU  22  -0.172   4.690  -2.051
  143   HD21  LEU  22          HD21      LEU  22  -0.729   3.403  -4.530
  144   HD22  LEU  22          HD22      LEU  22  -1.926   3.137  -3.258
  145   HD23  LEU  22          HD23      LEU  22  -1.233   1.764  -4.114
  146    H    VAL  23           HN       VAL  23   2.884   0.178  -5.336
  147    HA   VAL  23           HA       VAL  23   5.123  -0.349  -3.621
  148    HB   VAL  23           HB       VAL  23   4.770  -2.426  -4.140
  149   HG11  VAL  23          HG11      VAL  23   2.446  -1.671  -4.653
  150   HG12  VAL  23          HG12      VAL  23   2.932  -3.170  -5.449
  151   HG13  VAL  23          HG13      VAL  23   2.897  -1.658  -6.358
  152   HG21  VAL  23          HG21      VAL  23   6.498  -2.164  -5.786
  153   HG22  VAL  23          HG22      VAL  23   5.287  -1.686  -6.994
  154   HG23  VAL  23          HG23      VAL  23   5.284  -3.325  -6.339
  155    H    SER  24           HN       SER  24   4.617   0.801  -6.904
  156    HA   SER  24           HA       SER  24   7.296   0.982  -7.700
  157    HB2  SER  24           HB2      SER  24   5.191   1.537  -9.061
  158    HB3  SER  24           HB1      SER  24   5.211   3.103  -8.244
  159    HG   SER  24           HG       SER  24   7.532   2.157  -9.530
  160    H    ALA  25           HN       ALA  25   5.401   2.715  -5.422
  161    HA   ALA  25           HA       ALA  25   7.331   4.854  -5.027
  162    HB1  ALA  25           HB1      ALA  25   4.974   4.182  -3.280
  163    HB2  ALA  25           HB2      ALA  25   4.793   5.081  -4.791
  164    HB3  ALA  25           HB3      ALA  25   5.779   5.743  -3.473
  165    H    ILE  26           HN       ILE  26   6.360   1.797  -3.491
  166    HA   ILE  26           HA       ILE  26   7.871   2.080  -1.167
  167    HB   ILE  26           HB       ILE  26   6.539  -0.139  -2.539
  168   HG12  ILE  26          HG12      ILE  26   7.136   0.622   0.307
  169   HG13  ILE  26          HG11      ILE  26   5.609   0.775  -0.559
  170   HG21  ILE  26          HG21      ILE  26   8.797  -1.070  -2.637
  171   HG22  ILE  26          HG22      ILE  26   7.787  -1.946  -1.481
  172   HG23  ILE  26          HG23      ILE  26   8.980  -0.783  -0.906
  173   HD11  ILE  26          HD11      ILE  26   5.339  -1.581  -0.622
  174   HD12  ILE  26          HD12      ILE  26   5.679  -1.097   1.051
  175   HD13  ILE  26          HD13      ILE  26   6.943  -1.836   0.061
  176    H    GLN  27           HN       GLN  27   8.685   0.695  -4.311
  177    HA   GLN  27           HA       GLN  27  11.300  -0.077  -3.725
  178    HB2  GLN  27           HB2      GLN  27  10.096   0.842  -6.349
  179    HB3  GLN  27           HB1      GLN  27  11.621  -0.025  -6.187
  180    HG2  GLN  27           HG2      GLN  27  10.390  -1.909  -5.189
  181    HG3  GLN  27           HG1      GLN  27   8.891  -1.033  -5.437
  182   HE21  GLN  27          HE21      GLN  27  11.535  -2.674  -7.002
  183   HE22  GLN  27          HE22      GLN  27  10.756  -2.894  -8.529
  184    H    SER  28           HN       SER  28   9.897   2.972  -4.546
  185    HA   SER  28           HA       SER  28  12.329   4.395  -4.973
  186    HB2  SER  28           HB2      SER  28   9.481   5.261  -4.448
  187    HB3  SER  28           HB1      SER  28  10.770   6.358  -4.901
  188    HG   SER  28           HG       SER  28   9.394   4.494  -6.430
  189    H    TYR  29           HN       TYR  29   9.923   4.370  -2.331
  190    HA   TYR  29           HA       TYR  29  11.221   5.960  -0.460
  191    HB2  TYR  29           HB2      TYR  29   8.886   5.125  -0.334
  192    HB3  TYR  29           HB1      TYR  29   9.492   3.512   0.002
  193    HD1  TYR  29           HD1      TYR  29   7.486   4.782   1.668
  194    HD2  TYR  29           HD2      TYR  29  11.731   5.018   1.961
  195    HE1  TYR  29           HE1      TYR  29   7.289   5.176   4.090
  196    HE2  TYR  29           HE2      TYR  29  11.528   5.418   4.372
  197    HH   TYR  29           HH       TYR  29   8.707   4.899   6.115
  198    H    ILE  30           HN       ILE  30  11.280   2.417  -0.733
  199    HA   ILE  30           HA       ILE  30  12.932   1.953   1.466
  200    HB   ILE  30           HB       ILE  30  12.430   0.284  -0.986
  201   HG12  ILE  30          HG12      ILE  30  11.184   0.387   1.762
  202   HG13  ILE  30          HG11      ILE  30  10.424   0.799   0.232
  203   HG21  ILE  30          HG21      ILE  30  14.456  -0.482   0.025
  204   HG22  ILE  30          HG22      ILE  30  13.164  -1.616   0.425
  205   HG23  ILE  30          HG23      ILE  30  13.722  -0.454   1.628
  206   HD11  ILE  30          HD11      ILE  30  10.640  -1.543  -0.466
  207   HD12  ILE  30          HD12      ILE  30   9.632  -1.317   0.970
  208   HD13  ILE  30          HD13      ILE  30  11.280  -1.929   1.134
  209    H    GLY  31           HN       GLY  31  13.747   2.400  -1.948
  210    HA2  GLY  31           HA2      GLY  31  16.495   1.702  -1.636
  211    HA3  GLY  31           HA1      GLY  31  15.798   2.584  -2.994
  212    H    ALA  32           HN       ALA  32  14.693   4.394  -0.720
  213    HA   ALA  32           HA       ALA  32  16.964   6.230  -0.720
  214    HB1  ALA  32           HB1      ALA  32  14.674   6.960  -1.425
  215    HB2  ALA  32           HB2      ALA  32  15.385   7.919  -0.123
  216    HB3  ALA  32           HB3      ALA  32  14.156   6.706   0.244
  217    H    GLN  33           HN       GLN  33  15.254   4.078   1.340
  218    HA   GLN  33           HA       GLN  33  15.449   5.358   3.775
  219    HB2  GLN  33           HB2      GLN  33  15.247   2.503   2.974
  220    HB3  GLN  33           HB1      GLN  33  15.432   2.963   4.668
  221    HG2  GLN  33           HG2      GLN  33  13.407   4.410   3.116
  222    HG3  GLN  33           HG1      GLN  33  13.078   2.731   3.477
  223   HE21  GLN  33          HE21      GLN  33  13.598   5.899   4.782
  224   HE22  GLN  33          HE22      GLN  33  13.016   5.567   6.377
  225    H    ASP  34           HN       ASP  34  16.726   4.893   5.580
  226    HA   ASP  34           HA       ASP  34  19.499   4.931   5.225
  227    HB2  ASP  34           HB2      ASP  34  18.158   5.744   7.201
  228    HB3  ASP  34           HB1      ASP  34  18.028   4.066   7.693
  229    H    ASP  35           HN       ASP  35  17.217   2.422   5.853
  230    HA   ASP  35           HA       ASP  35  19.205   0.450   4.989
  231    HB2  ASP  35           HB2      ASP  35  17.246  -0.228   7.183
  232    HB3  ASP  35           HB1      ASP  35  18.561  -1.210   6.573
  233    HA   PRO  36           HA       PRO  36  15.529  -0.183   2.419
  234    HB2  PRO  36           HB2      PRO  36  16.827  -1.335   0.395
  235    HB3  PRO  36           HB1      PRO  36  17.074   0.378   0.714
  236    HG2  PRO  36           HG2      PRO  36  18.704  -1.927   1.741
  237    HG3  PRO  36           HG1      PRO  36  19.272  -0.583   0.735
  238    HD2  PRO  36           HD2      PRO  36  19.543  -0.413   3.340
  239    HD3  PRO  36           HD1      PRO  36  18.905   0.978   2.438
  240    H    THR  37           HN       THR  37  17.472  -2.100   4.216
  241    HA   THR  37           HA       THR  37  16.787  -4.664   3.171
  242    HB   THR  37           HB       THR  37  18.211  -5.516   4.907
  243    HG1  THR  37           HG1      THR  37  17.646  -4.480   6.757
  244   HG21  THR  37          HG21      THR  37  19.257  -2.804   4.056
  245   HG22  THR  37          HG22      THR  37  19.358  -4.284   3.093
  246   HG23  THR  37          HG23      THR  37  20.234  -4.165   4.622
  247    H    ASN  38           HN       ASN  38  15.768  -2.593   5.754
  248    HA   ASN  38           HA       ASN  38  13.298  -4.054   6.027
  249    HB2  ASN  38           HB2      ASN  38  14.871  -3.488   8.537
  250    HB3  ASN  38           HB1      ASN  38  13.385  -4.410   8.343
  251   HD21  ASN  38          HD21      ASN  38  13.511  -6.558   8.085
  252   HD22  ASN  38          HD22      ASN  38  14.980  -7.442   7.888
  253    HA   PRO  39           HA       PRO  39  13.393   0.683   6.281
  254    HB2  PRO  39           HB2      PRO  39  11.175   0.873   4.629
  255    HB3  PRO  39           HB1      PRO  39  12.856   1.055   4.121
  256    HG2  PRO  39           HG2      PRO  39  11.087  -1.334   3.954
  257    HG3  PRO  39           HG1      PRO  39  12.266  -0.729   2.794
  258    HD2  PRO  39           HD2      PRO  39  12.823  -2.815   4.319
  259    HD3  PRO  39           HD1      PRO  39  14.057  -1.602   3.955
  260    H    SER  40           HN       SER  40  11.833   2.044   7.243
  261    HA   SER  40           HA       SER  40  10.263   0.962   9.295
  262    HB2  SER  40           HB2      SER  40   9.934   3.649   7.939
  263    HB3  SER  40           HB1      SER  40   9.392   3.223   9.561
  264    HG   SER  40           HG       SER  40  11.586   2.926  10.135
  265    H    GLU  41           HN       GLU  41   7.868   1.226   9.539
  266    HA   GLU  41           HA       GLU  41   6.516  -0.131   7.515
  267    HB2  GLU  41           HB2      GLU  41   5.548  -0.356   9.593
  268    HB3  GLU  41           HB1      GLU  41   5.687   1.354   9.962
  269    HG2  GLU  41           HG2      GLU  41   3.927   1.876   8.468
  270    HG3  GLU  41           HG1      GLU  41   3.796   0.204   7.937
  271    H    ILE  42           HN       ILE  42   6.030   0.499   5.687
  272    HA   ILE  42           HA       ILE  42   6.189   3.264   4.957
  273    HB   ILE  42           HB       ILE  42   5.975   0.686   3.444
  274   HG12  ILE  42          HG12      ILE  42   8.075   2.791   3.897
  275   HG13  ILE  42          HG11      ILE  42   8.154   1.070   4.245
  276   HG21  ILE  42          HG21      ILE  42   6.047   1.903   1.382
  277   HG22  ILE  42          HG22      ILE  42   6.064   3.439   2.247
  278   HG23  ILE  42          HG23      ILE  42   4.635   2.407   2.309
  279   HD11  ILE  42          HD11      ILE  42   8.095   2.290   1.514
  280   HD12  ILE  42          HD12      ILE  42   8.260   0.572   1.893
  281   HD13  ILE  42          HD13      ILE  42   9.533   1.704   2.351
  282    H    THR  43           HN       THR  43   4.513   4.561   4.536
  283    HA   THR  43           HA       THR  43   1.882   3.310   4.197
  284    HB   THR  43           HB       THR  43   0.848   5.178   5.419
  285    HG1  THR  43           HG1      THR  43   2.145   6.610   6.565
  286   HG21  THR  43          HG21      THR  43   1.346   3.081   6.585
  287   HG22  THR  43          HG22      THR  43   1.499   4.465   7.669
  288   HG23  THR  43          HG23      THR  43   2.944   3.696   7.011
  289    H    LEU  44           HN       LEU  44   0.291   4.916   3.395
  290    HA   LEU  44           HA       LEU  44   1.148   5.714   0.837
  291    HB2  LEU  44           HB2      LEU  44  -1.353   6.478   2.271
  292    HB3  LEU  44           HB1      LEU  44  -1.106   6.424   0.551
  293    HG   LEU  44           HG       LEU  44  -1.359   4.156   2.456
  294   HD11  LEU  44          HD11      LEU  44  -3.199   5.441   0.950
  295   HD12  LEU  44          HD12      LEU  44  -3.342   3.790   1.543
  296   HD13  LEU  44          HD13      LEU  44  -2.749   4.090  -0.091
  297   HD21  LEU  44          HD21      LEU  44   0.617   3.836   0.966
  298   HD22  LEU  44          HD22      LEU  44  -0.490   3.909  -0.402
  299   HD23  LEU  44          HD23      LEU  44  -0.642   2.622   0.786
  300    H    ALA  45           HN       ALA  45   0.491   7.369   3.800
  301    HA   ALA  45           HA       ALA  45   0.710  10.008   2.830
  302    HB1  ALA  45           HB1      ALA  45   0.875  10.603   5.204
  303    HB2  ALA  45           HB2      ALA  45   1.103   8.896   5.608
  304    HB3  ALA  45           HB3      ALA  45  -0.434   9.446   4.904
  305    H    LYS  46           HN       LYS  46   3.015   7.591   3.742
  306    HA   LYS  46           HA       LYS  46   5.276   9.394   3.802
  307    HB2  LYS  46           HB2      LYS  46   4.999   6.422   3.987
  308    HB3  LYS  46           HB1      LYS  46   6.529   7.249   4.075
  309    HG2  LYS  46           HG2      LYS  46   5.852   8.373   6.092
  310    HG3  LYS  46           HG1      LYS  46   4.240   7.661   5.968
  311    HD2  LYS  46           HD2      LYS  46   5.395   5.405   6.019
  312    HD3  LYS  46           HD1      LYS  46   6.853   6.277   6.506
  313    HE2  LYS  46           HE2      LYS  46   4.205   6.351   7.927
  314    HE3  LYS  46           HE1      LYS  46   5.601   5.377   8.409
  315    HZ1  LYS  46           HZ1      LYS  46   6.859   7.431   8.711
  316    HZ2  LYS  46           HZ2      LYS  46   5.484   7.409   9.694
  317    HZ3  LYS  46           HZ3      LYS  46   5.501   8.344   8.286
  318    H    LEU  47           HN       LEU  47   3.764   7.094   1.662
  319    HA   LEU  47           HA       LEU  47   5.903   6.995  -0.216
  320    HB2  LEU  47           HB2      LEU  47   3.048   6.063  -0.215
  321    HB3  LEU  47           HB1      LEU  47   4.069   5.905  -1.634
  322    HG   LEU  47           HG       LEU  47   4.599   4.673   1.065
  323   HD11  LEU  47          HD11      LEU  47   4.161   2.555  -0.099
  324   HD12  LEU  47          HD12      LEU  47   3.701   3.459  -1.542
  325   HD13  LEU  47          HD13      LEU  47   2.747   3.608  -0.067
  326   HD21  LEU  47          HD21      LEU  47   6.417   3.499  -0.088
  327   HD22  LEU  47          HD22      LEU  47   6.663   5.243  -0.074
  328   HD23  LEU  47          HD23      LEU  47   6.098   4.446  -1.540
  329    H    ALA  48           HN       ALA  48   3.571   9.274   0.471
  330    HA   ALA  48           HA       ALA  48   2.513  10.243  -1.814
  331    HB1  ALA  48           HB1      ALA  48   2.221  12.292  -0.753
  332    HB2  ALA  48           HB2      ALA  48   3.723  12.147   0.150
  333    HB3  ALA  48           HB3      ALA  48   2.341  11.137   0.576
  334    HA   PRO  49           HA       PRO  49   6.442  12.926  -2.850
  335    HB2  PRO  49           HB2      PRO  49   8.554  11.374  -1.472
  336    HB3  PRO  49           HB1      PRO  49   8.347  13.112  -1.599
  337    HG2  PRO  49           HG2      PRO  49   7.852  11.919   0.692
  338    HG3  PRO  49           HG1      PRO  49   6.732  13.166   0.097
  339    HD2  PRO  49           HD2      PRO  49   6.515  10.186  -0.120
  340    HD3  PRO  49           HD1      PRO  49   5.303  11.344   0.455
  341    H    TYR  50           HN       TYR  50   6.284   9.513  -2.734
  342    HA   TYR  50           HA       TYR  50   8.239   9.218  -4.900
  343    HB2  TYR  50           HB2      TYR  50   7.108   7.115  -3.052
  344    HB3  TYR  50           HB1      TYR  50   8.383   6.882  -4.238
  345    HD1  TYR  50           HD1      TYR  50  10.577   8.096  -3.907
  346    HD2  TYR  50           HD2      TYR  50   7.588   7.889  -0.893
  347    HE1  TYR  50           HE1      TYR  50  12.255   8.695  -2.218
  348    HE2  TYR  50           HE2      TYR  50   9.261   8.492   0.812
  349    HH   TYR  50           HH       TYR  50  11.657   8.456   1.145
  350    H    MET  51           HN       MET  51   4.966   9.527  -4.565
  351    HA   MET  51           HA       MET  51   4.239   7.354  -6.332
  352    HB2  MET  51           HB2      MET  51   2.419   9.592  -5.487
  353    HB3  MET  51           HB1      MET  51   1.983   8.029  -6.133
  354    HG2  MET  51           HG2      MET  51   3.443   8.370  -3.563
  355    HG3  MET  51           HG1      MET  51   1.687   8.311  -3.675
  356    HE1  MET  51           HE1      MET  51   1.409   4.684  -5.356
  357    HE2  MET  51           HE2      MET  51   1.806   6.144  -6.254
  358    HE3  MET  51           HE3      MET  51   0.527   6.178  -5.041
  359    H    SER  52           HN       SER  52   3.925   7.402  -8.336
  360    HA   SER  52           HA       SER  52   5.102   9.563  -9.819
  361    HB2  SER  52           HB2      SER  52   4.299   7.783 -11.716
  362    HB3  SER  52           HB1      SER  52   5.818   7.671 -10.828
  363    HG   SER  52           HG       SER  52   3.394   6.264 -10.404
  364    H    LYS  53           HN       LYS  53   1.950   7.909  -9.970
  365    HA   LYS  53           HA       LYS  53   0.841   9.757 -11.815
  366    HB2  LYS  53           HB2      LYS  53  -0.989   8.380 -11.777
  367    HB3  LYS  53           HB1      LYS  53   0.194   7.275 -11.115
  368    HG2  LYS  53           HG2      LYS  53  -1.859   8.847  -9.579
  369    HG3  LYS  53           HG1      LYS  53  -1.832   7.108  -9.857
  370    HD2  LYS  53           HD2      LYS  53   0.355   7.052  -8.620
  371    HD3  LYS  53           HD1      LYS  53   0.071   8.744  -8.196
  372    HE2  LYS  53           HE2      LYS  53  -0.635   7.351  -6.375
  373    HE3  LYS  53           HE1      LYS  53  -2.051   8.088  -7.137
  374    HZ1  LYS  53           HZ1      LYS  53  -1.183   5.282  -7.243
  375    HZ2  LYS  53           HZ2      LYS  53  -2.123   5.920  -8.488
  376    HZ3  LYS  53           HZ3      LYS  53  -2.722   5.916  -6.908
  377    H    ASN  54           HN       ASN  54  -1.139  11.031 -11.300
  378    HA   ASN  54           HA       ASN  54  -2.208  12.722 -10.137
  379    HB2  ASN  54           HB2      ASN  54  -3.269  10.404  -9.785
  380    HB3  ASN  54           HB1      ASN  54  -2.650  10.512  -8.144
  381   HD21  ASN  54          HD21      ASN  54  -5.394  10.379  -8.962
  382   HD22  ASN  54          HD22      ASN  54  -6.161  11.822  -8.396
  383    H    ALA  55           HN       ALA  55  -0.979  10.826  -7.468
  384    HA   ALA  55           HA       ALA  55  -1.086  12.585  -5.426
  385    HB1  ALA  55           HB1      ALA  55   0.741  11.170  -4.445
  386    HB2  ALA  55           HB2      ALA  55   0.817  10.345  -6.009
  387    HB3  ALA  55           HB3      ALA  55  -0.668  10.311  -5.060
  388    H    LYS  56           HN       LYS  56   0.371  13.821  -4.292
  389    HA   LYS  56           HA       LYS  56   2.978  14.388  -5.370
  390    HB2  LYS  56           HB2      LYS  56   1.431  16.056  -6.432
  391    HB3  LYS  56           HB1      LYS  56   1.061  16.651  -4.822
  392    HG2  LYS  56           HG2      LYS  56   2.707  18.060  -5.906
  393    HG3  LYS  56           HG1      LYS  56   3.400  17.255  -4.498
  394    HD2  LYS  56           HD2      LYS  56   4.961  17.230  -6.373
  395    HD3  LYS  56           HD1      LYS  56   4.449  15.597  -5.955
  396    HE2  LYS  56           HE2      LYS  56   2.847  15.626  -7.807
  397    HE3  LYS  56           HE1      LYS  56   3.352  17.263  -8.217
  398    HZ1  LYS  56           HZ1      LYS  56   4.436  15.674  -9.642
  399    HZ2  LYS  56           HZ2      LYS  56   5.054  14.834  -8.311
  400    HZ3  LYS  56           HZ3      LYS  56   5.585  16.405  -8.640
  401    H    ASN  57           HN       ASN  57   0.613  15.475  -2.930
  402    HA   ASN  57           HA       ASN  57   2.690  15.070  -0.900
  403    HB2  ASN  57           HB2      ASN  57   0.413  17.047  -0.972
  404    HB3  ASN  57           HB1      ASN  57   1.279  16.650   0.508
  405   HD21  ASN  57          HD21      ASN  57   1.060  19.180  -0.958
  406   HD22  ASN  57          HD22      ASN  57   2.683  19.662  -1.305
  407    H    GLU  58           HN       GLU  58   1.513  14.793   1.332
  408    HA   GLU  58           HA       GLU  58   0.370  12.233   1.225
  409    HB2  GLU  58           HB2      GLU  58   0.970  12.211   3.361
  410    HB3  GLU  58           HB1      GLU  58   1.510  13.865   3.151
  411    HG2  GLU  58           HG2      GLU  58  -0.745  14.621   3.745
  412    HG3  GLU  58           HG1      GLU  58  -1.157  12.950   4.126
  413    H    ASP  59           HN       ASP  59  -1.019  15.389   1.576
  414    HA   ASP  59           HA       ASP  59  -3.642  14.655   2.252
  415    HB2  ASP  59           HB2      ASP  59  -3.066  16.901   2.575
  416    HB3  ASP  59           HB1      ASP  59  -2.417  17.061   0.955
  417    H    GLY  60           HN       GLY  60  -1.961  14.850  -0.791
  418    HA2  GLY  60           HA2      GLY  60  -4.394  14.529  -2.328
  419    HA3  GLY  60           HA1      GLY  60  -2.772  14.688  -2.972
  420    H    ILE  61           HN       ILE  61  -1.432  12.633  -1.800
  421    HA   ILE  61           HA       ILE  61  -1.925  10.591  -3.560
  422    HB   ILE  61           HB       ILE  61   0.224  10.748  -2.588
  423   HG12  ILE  61          HG12      ILE  61   0.695   8.547  -1.872
  424   HG13  ILE  61          HG11      ILE  61  -0.946   8.302  -1.279
  425   HG21  ILE  61          HG21      ILE  61  -0.414  11.802  -0.484
  426   HG22  ILE  61          HG22      ILE  61   0.704  10.460  -0.234
  427   HG23  ILE  61          HG23      ILE  61  -1.009  10.253   0.109
  428   HD11  ILE  61          HD11      ILE  61  -0.352   7.149  -3.441
  429   HD12  ILE  61          HD12      ILE  61  -0.297   8.746  -4.188
  430   HD13  ILE  61          HD13      ILE  61  -1.805   8.150  -3.476
  431    H    VAL  62           HN       VAL  62  -2.590  10.543  -0.134
  432    HA   VAL  62           HA       VAL  62  -3.607   7.943  -0.049
  433    HB   VAL  62           HB       VAL  62  -4.004  10.288   1.797
  434   HG11  VAL  62          HG11      VAL  62  -5.711   8.565   2.117
  435   HG12  VAL  62          HG12      VAL  62  -4.607   8.704   3.494
  436   HG13  VAL  62          HG13      VAL  62  -4.424   7.368   2.356
  437   HG21  VAL  62          HG21      VAL  62  -2.306   8.193   2.721
  438   HG22  VAL  62          HG22      VAL  62  -1.949   9.912   2.495
  439   HG23  VAL  62          HG23      VAL  62  -1.759   8.783   1.144
  440    H    ASN  63           HN       ASN  63  -5.079  11.038  -0.495
  441    HA   ASN  63           HA       ASN  63  -7.776  10.149  -0.250
  442    HB2  ASN  63           HB2      ASN  63  -7.067  12.454   0.216
  443    HB3  ASN  63           HB1      ASN  63  -6.653  12.675  -1.480
  444   HD21  ASN  63          HD21      ASN  63  -9.219  12.409   0.835
  445   HD22  ASN  63          HD22      ASN  63 -10.491  12.935  -0.213
  446    H    SER  64           HN       SER  64  -5.477  10.381  -2.846
  447    HA   SER  64           HA       SER  64  -7.412  10.007  -4.958
  448    HB2  SER  64           HB2      SER  64  -4.386   9.801  -4.985
  449    HB3  SER  64           HB1      SER  64  -5.428   9.832  -6.411
  450    HG   SER  64           HG       SER  64  -5.974  11.907  -4.765
  451    H    LEU  65           HN       LEU  65  -5.659   8.072  -2.799
  452    HA   LEU  65           HA       LEU  65  -5.760   5.656  -4.394
  453    HB2  LEU  65           HB2      LEU  65  -4.967   6.045  -1.514
  454    HB3  LEU  65           HB1      LEU  65  -4.701   4.607  -2.479
  455    HG   LEU  65           HG       LEU  65  -3.463   7.279  -3.076
  456   HD11  LEU  65          HD11      LEU  65  -1.464   6.425  -2.064
  457   HD12  LEU  65          HD12      LEU  65  -2.236   4.877  -1.747
  458   HD13  LEU  65          HD13      LEU  65  -2.770   6.321  -0.888
  459   HD21  LEU  65          HD21      LEU  65  -2.812   4.509  -4.009
  460   HD22  LEU  65          HD22      LEU  65  -2.017   6.000  -4.514
  461   HD23  LEU  65          HD23      LEU  65  -3.699   5.699  -4.957
  462    H    ALA  66           HN       ALA  66  -6.807   3.701  -3.548
  463    HA   ALA  66           HA       ALA  66  -9.465   3.942  -2.926
  464    HB1  ALA  66           HB1      ALA  66  -8.539   1.802  -3.631
  465    HB2  ALA  66           HB2      ALA  66  -9.419   1.629  -2.106
  466    HB3  ALA  66           HB3      ALA  66  -7.653   1.675  -2.107
  467    H    LYS  67           HN       LYS  67 -10.675   4.104  -1.198
  468    HA   LYS  67           HA       LYS  67  -9.307   4.482   1.362
  469    HB2  LYS  67           HB2      LYS  67 -11.897   5.758   0.510
  470    HB3  LYS  67           HB1      LYS  67 -10.962   6.109   1.951
  471    HG2  LYS  67           HG2      LYS  67 -10.226   6.738  -0.887
  472    HG3  LYS  67           HG1      LYS  67 -10.668   7.876   0.380
  473    HD2  LYS  67           HD2      LYS  67  -8.288   6.066   0.580
  474    HD3  LYS  67           HD1      LYS  67  -8.202   7.662  -0.163
  475    HE2  LYS  67           HE2      LYS  67  -8.916   7.001   2.688
  476    HE3  LYS  67           HE1      LYS  67  -7.474   7.844   2.115
  477    HZ1  LYS  67           HZ1      LYS  67 -10.266   8.855   1.915
  478    HZ2  LYS  67           HZ2      LYS  67  -8.881   9.666   1.389
  479    HZ3  LYS  67           HZ3      LYS  67  -9.108   9.369   3.033
  480    H    ASP  68           HN       ASP  68 -10.091   3.382   3.091
  481    HA   ASP  68           HA       ASP  68 -12.532   1.862   2.545
  482    HB2  ASP  68           HB2      ASP  68 -10.353   0.518   2.860
  483    HB3  ASP  68           HB1      ASP  68 -10.553   0.867   4.584
  484    H    LYS  69           HN       LYS  69 -13.929   1.432   4.368
  485    HA   LYS  69           HA       LYS  69 -14.408   4.086   5.374
  486    HB2  LYS  69           HB2      LYS  69 -16.657   3.544   5.445
  487    HB3  LYS  69           HB1      LYS  69 -16.046   2.671   4.059
  488    HG2  LYS  69           HG2      LYS  69 -16.553   1.474   6.767
  489    HG3  LYS  69           HG1      LYS  69 -17.650   1.375   5.393
  490    HD2  LYS  69           HD2      LYS  69 -14.834   0.305   5.446
  491    HD3  LYS  69           HD1      LYS  69 -16.283  -0.666   5.703
  492    HE2  LYS  69           HE2      LYS  69 -17.046  -0.178   3.462
  493    HE3  LYS  69           HE1      LYS  69 -15.685   0.914   3.206
  494    HZ1  LYS  69           HZ1      LYS  69 -15.565  -2.026   3.582
  495    HZ2  LYS  69           HZ2      LYS  69 -14.199  -1.030   3.555
  496    HZ3  LYS  69           HZ3      LYS  69 -15.184  -1.160   2.180
  497    H    SER  70           HN       SER  70 -13.916   0.890   6.783
  498    HA   SER  70           HA       SER  70 -14.641   2.014   9.386
  499    HB2  SER  70           HB2      SER  70 -14.500  -0.477  10.053
  500    HB3  SER  70           HB1      SER  70 -15.838   0.030   9.021
  501    HG   SER  70           HG       SER  70 -14.265  -1.901   8.500
  502    H    GLY  71           HN       GLY  71 -12.025   0.455   7.653
  503    HA2  GLY  71           HA2      GLY  71  -9.765   0.370   8.102
  504    HA3  GLY  71           HA1      GLY  71 -10.031   1.697   9.222
  505    H    ASN  72           HN       ASN  72 -11.571  -1.447   9.490
  506    HA   ASN  72           HA       ASN  72 -11.315  -1.719  12.196
  507    HB2  ASN  72           HB2      ASN  72 -11.335  -3.945  10.153
  508    HB3  ASN  72           HB1      ASN  72 -11.610  -4.169  11.875
  509   HD21  ASN  72          HD21      ASN  72 -13.517  -3.364  12.800
  510   HD22  ASN  72          HD22      ASN  72 -14.901  -2.998  11.827
  511    H    SER  73           HN       SER  73  -8.990  -2.867   9.777
  512    HA   SER  73           HA       SER  73  -7.393  -4.138  11.820
  513    HB2  SER  73           HB2      SER  73  -7.688  -5.196   9.608
  514    HB3  SER  73           HB1      SER  73  -6.857  -3.836   8.857
  515    HG   SER  73           HG       SER  73  -5.200  -4.564  10.657
  516    H    SER  74           HN       SER  74  -7.698  -1.013  10.898
  517    HA   SER  74           HA       SER  74  -6.439   0.865  11.011
  518    HB2  SER  74           HB2      SER  74  -5.931  -0.109  13.286
  519    HB3  SER  74           HB1      SER  74  -4.445  -0.760  12.599
  520    HG   SER  74           HG       SER  74  -3.670   1.121  13.152
  521    H    THR  75           HN       THR  75  -5.948   1.034   8.860
  522    HA   THR  75           HA       THR  75  -3.905  -0.625   7.682
  523    HB   THR  75           HB       THR  75  -6.057  -0.019   6.534
  524    HG1  THR  75           HG1      THR  75  -3.591   0.623   5.254
  525   HG21  THR  75          HG21      THR  75  -6.200   2.151   5.433
  526   HG22  THR  75          HG22      THR  75  -4.692   2.650   6.199
  527   HG23  THR  75          HG23      THR  75  -6.121   2.340   7.183
  528    H    SER  76           HN       SER  76  -3.663   2.028   9.521
  529    HA   SER  76           HA       SER  76  -2.012   3.506   9.963
  530    HB2  SER  76           HB2      SER  76  -0.518   2.059   7.766
  531    HB3  SER  76           HB1      SER  76   0.186   3.288   8.814
  532    HG   SER  76           HG       SER  76   0.622   1.629  10.033
  533    H    ALA  77           HN       ALA  77  -2.642   3.095   6.497
  534    HA   ALA  77           HA       ALA  77  -2.036   5.837   5.861
  535    HB1  ALA  77           HB1      ALA  77  -1.881   4.016   4.192
  536    HB2  ALA  77           HB2      ALA  77  -2.916   5.357   3.668
  537    HB3  ALA  77           HB3      ALA  77  -3.636   3.851   4.254
  538    HA   PRO  78           HA       PRO  78  -5.599   7.651   7.686
  539    HB2  PRO  78           HB2      PRO  78  -5.132   9.554   5.440
  540    HB3  PRO  78           HB1      PRO  78  -5.431   9.904   7.142
  541    HG2  PRO  78           HG2      PRO  78  -2.986  10.078   6.197
  542    HG3  PRO  78           HG1      PRO  78  -3.269   9.255   7.742
  543    HD2  PRO  78           HD2      PRO  78  -2.730   8.076   5.063
  544    HD3  PRO  78           HD1      PRO  78  -2.142   7.568   6.658
  545    H    GLY  79           HN       GLY  79  -7.354   6.445   7.296
  546    HA2  GLY  79           HA2      GLY  79  -9.352   5.800   6.399
  547    HA3  GLY  79           HA1      GLY  79  -9.286   7.271   5.451
  548    H    SER  80           HN       SER  80  -6.610   5.307   4.766
  549    HA   SER  80           HA       SER  80  -7.765   4.790   2.127
  550    HB2  SER  80           HB2      SER  80  -5.311   5.699   2.942
  551    HB3  SER  80           HB1      SER  80  -4.981   4.009   2.563
  552    HG   SER  80           HG       SER  80  -6.558   5.129   0.668
  553    H    ALA  81           HN       ALA  81  -6.717   2.798   1.053
  554    HA   ALA  81           HA       ALA  81  -7.252   0.466   2.740
  555    HB1  ALA  81           HB1      ALA  81  -8.064  -0.623   0.738
  556    HB2  ALA  81           HB2      ALA  81  -7.596   0.778  -0.234
  557    HB3  ALA  81           HB3      ALA  81  -8.893   0.926   0.956
  558    H    HIS  82           HN       HIS  82  -4.643   1.677   2.546
  559    HA   HIS  82           HA       HIS  82  -3.281  -0.654   1.463
  560    HB2  HIS  82           HB2      HIS  82  -2.495   2.200   0.967
  561    HB3  HIS  82           HB1      HIS  82  -1.382   0.876   0.806
  562    HD1  HIS  82           HD1      HIS  82  -1.934  -0.847  -1.155
  563    HD2  HIS  82           HD2      HIS  82  -4.147   2.674  -1.172
  564    HE1  HIS  82           HE1      HIS  82  -2.934  -0.683  -3.452
  565    HE2  HIS  82           HE2      HIS  82  -4.420   1.343  -3.368
  566    H    GLN  83           HN       GLN  83  -1.968  -1.582   2.839
  567    HA   GLN  83           HA       GLN  83  -0.611  -0.046   4.915
  568    HB2  GLN  83           HB2      GLN  83  -2.622  -0.766   6.057
  569    HB3  GLN  83           HB1      GLN  83  -2.442  -2.393   5.423
  570    HG2  GLN  83           HG2      GLN  83  -0.342  -2.608   6.730
  571    HG3  GLN  83           HG1      GLN  83  -0.693  -1.039   7.457
  572   HE21  GLN  83          HE21      GLN  83  -0.819  -1.953   9.504
  573   HE22  GLN  83          HE22      GLN  83  -2.185  -2.881  10.004
  574    H    ILE  84           HN       ILE  84   1.464  -0.661   4.787
  575    HA   ILE  84           HA       ILE  84   2.078  -3.062   3.338
  576    HB   ILE  84           HB       ILE  84   3.520  -0.609   4.153
  577   HG12  ILE  84          HG12      ILE  84   3.966  -1.601   1.517
  578   HG13  ILE  84          HG11      ILE  84   2.257  -1.723   1.887
  579   HG21  ILE  84          HG21      ILE  84   5.645  -1.527   3.319
  580   HG22  ILE  84          HG22      ILE  84   4.902  -3.122   3.207
  581   HG23  ILE  84          HG23      ILE  84   5.103  -2.352   4.781
  582   HD11  ILE  84          HD11      ILE  84   2.366   0.691   2.579
  583   HD12  ILE  84          HD12      ILE  84   2.582   0.364   0.861
  584   HD13  ILE  84          HD13      ILE  84   3.980   0.725   1.872
  585    H    ASP  85           HN       ASP  85   3.202  -4.790   4.041
  586    HA   ASP  85           HA       ASP  85   3.394  -5.144   6.941
  587    HB2  ASP  85           HB2      ASP  85   2.164  -6.912   5.829
  588    HB3  ASP  85           HB1      ASP  85   3.463  -7.142   4.651
  589    H    THR  86           HN       THR  86   5.247  -4.730   7.821
  590    HA   THR  86           HA       THR  86   7.632  -4.650   6.202
  591    HB   THR  86           HB       THR  86   8.645  -3.822   8.375
  592    HG1  THR  86           HG1      THR  86   6.087  -3.272   9.315
  593   HG21  THR  86          HG21      THR  86   6.262  -2.381   7.227
  594   HG22  THR  86          HG22      THR  86   7.903  -2.357   6.569
  595   HG23  THR  86          HG23      THR  86   7.574  -1.632   8.146
  596    H    THR  87           HN       THR  87   6.045  -6.852   8.187
  597    HA   THR  87           HA       THR  87   8.109  -8.320   9.344
  598    HB   THR  87           HB       THR  87   5.642  -9.606   8.204
  599    HG1  THR  87           HG1      THR  87   4.525  -8.163   9.273
  600   HG21  THR  87          HG21      THR  87   7.173  -9.985  10.774
  601   HG22  THR  87          HG22      THR  87   7.268 -11.022   9.351
  602   HG23  THR  87          HG23      THR  87   5.763 -10.916  10.267
  603    H    ASN  88           HN       ASN  88   6.360  -9.005   6.303
  604    HA   ASN  88           HA       ASN  88   8.616 -10.675   5.433
  605    HB2  ASN  88           HB2      ASN  88   5.878 -10.347   4.188
  606    HB3  ASN  88           HB1      ASN  88   7.099 -11.516   3.708
  607   HD21  ASN  88          HD21      ASN  88   4.761 -10.626   6.127
  608   HD22  ASN  88          HD22      ASN  88   4.717 -12.167   6.926
  609    H    HIS  89           HN       HIS  89   7.576  -7.577   5.218
  610    HA   HIS  89           HA       HIS  89   8.226  -5.761   4.027
  611    HB2  HIS  89           HB2      HIS  89  10.044  -7.691   2.564
  612    HB3  HIS  89           HB1      HIS  89  10.087  -5.942   2.399
  613    HD1  HIS  89           HD1      HIS  89  12.082  -8.311   3.802
  614    HD2  HIS  89           HD2      HIS  89  10.210  -4.993   5.471
  615    HE1  HIS  89           HE1      HIS  89  13.399  -7.752   5.863
  616    HE2  HIS  89           HE2      HIS  89  12.107  -5.887   6.957
  617    H    LYS  90           HN       LYS  90   5.856  -6.795   3.363
  618    HA   LYS  90           HA       LYS  90   5.842  -6.763   0.411
  619    HB2  LYS  90           HB2      LYS  90   3.531  -7.856   2.038
  620    HB3  LYS  90           HB1      LYS  90   3.930  -8.108   0.363
  621    HG2  LYS  90           HG2      LYS  90   5.790  -9.492   0.869
  622    HG3  LYS  90           HG1      LYS  90   5.660  -9.120   2.586
  623    HD2  LYS  90           HD2      LYS  90   3.517 -10.521   0.995
  624    HD3  LYS  90           HD1      LYS  90   4.757 -11.357   1.934
  625    HE2  LYS  90           HE2      LYS  90   3.975 -10.124   3.946
  626    HE3  LYS  90           HE1      LYS  90   2.671  -9.457   2.974
  627    HZ1  LYS  90           HZ1      LYS  90   1.895 -11.362   4.195
  628    HZ2  LYS  90           HZ2      LYS  90   3.122 -12.331   3.553
  629    HZ3  LYS  90           HZ3      LYS  90   1.910 -11.730   2.547
  630    H    LEU  91           HN       LEU  91   4.298  -5.595  -0.673
  631    HA   LEU  91           HA       LEU  91   3.150  -3.321   0.748
  632    HB2  LEU  91           HB2      LEU  91   4.386  -3.015  -1.370
  633    HB3  LEU  91           HB1      LEU  91   3.239  -4.014  -2.192
  634    HG   LEU  91           HG       LEU  91   2.286  -2.118  -2.823
  635   HD11  LEU  91          HD11      LEU  91   0.549  -2.654  -1.283
  636   HD12  LEU  91          HD12      LEU  91   0.805  -0.907  -1.236
  637   HD13  LEU  91          HD13      LEU  91   1.441  -1.930   0.058
  638   HD21  LEU  91          HD21      LEU  91   2.883   0.035  -2.047
  639   HD22  LEU  91          HD22      LEU  91   4.327  -0.966  -2.143
  640   HD23  LEU  91          HD23      LEU  91   3.584  -0.635  -0.578
  641    H    ILE  92           HN       ILE  92   1.410  -3.972   1.803
  642    HA   ILE  92           HA       ILE  92  -0.567  -5.693   0.546
  643    HB   ILE  92           HB       ILE  92  -0.016  -4.761   3.340
  644   HG12  ILE  92          HG12      ILE  92  -0.340  -7.307   3.704
  645   HG13  ILE  92          HG11      ILE  92  -0.187  -7.412   1.956
  646   HG21  ILE  92          HG21      ILE  92  -2.424  -4.460   3.041
  647   HG22  ILE  92          HG22      ILE  92  -2.070  -5.781   4.154
  648   HG23  ILE  92          HG23      ILE  92  -2.570  -6.133   2.502
  649   HD11  ILE  92          HD11      ILE  92   1.837  -6.161   3.761
  650   HD12  ILE  92          HD12      ILE  92   1.992  -6.461   2.029
  651   HD13  ILE  92          HD13      ILE  92   1.901  -7.811   3.158
  652    H    SER  93           HN       SER  93  -2.587  -4.990   0.073
  653    HA   SER  93           HA       SER  93  -3.229  -2.219   0.743
  654    HB2  SER  93           HB2      SER  93  -4.601  -3.817  -1.391
  655    HB3  SER  93           HB1      SER  93  -4.528  -2.068  -1.203
  656    HG   SER  93           HG       SER  93  -2.361  -3.789  -1.881
  657    H    THR  94           HN       THR  94  -4.641  -2.080   2.399
  658    HA   THR  94           HA       THR  94  -6.020  -4.539   3.147
  659    HB   THR  94           HB       THR  94  -5.322  -2.072   4.737
  660    HG1  THR  94           HG1      THR  94  -3.871  -3.423   5.738
  661   HG21  THR  94          HG21      THR  94  -6.225  -3.304   6.690
  662   HG22  THR  94          HG22      THR  94  -6.842  -4.540   5.588
  663   HG23  THR  94          HG23      THR  94  -7.470  -2.895   5.508
  664    H    PHE  95           HN       PHE  95  -7.958  -4.711   2.464
  665    HA   PHE  95           HA       PHE  95  -9.746  -2.391   2.343
  666    HB2  PHE  95           HB2      PHE  95  -9.468  -3.853   0.331
  667    HB3  PHE  95           HB1      PHE  95 -10.098  -5.185   1.286
  668    HD1  PHE  95           HD1      PHE  95 -12.467  -5.235   1.965
  669    HD2  PHE  95           HD2      PHE  95 -10.917  -2.171  -0.562
  670    HE1  PHE  95           HE1      PHE  95 -14.753  -4.621   1.308
  671    HE2  PHE  95           HE2      PHE  95 -13.205  -1.555  -1.214
  672    HZ   PHE  95           HZ       PHE  95 -15.125  -2.778  -0.278
  673    H    THR  96           HN       THR  96 -10.666  -2.209   4.403
  674    HA   THR  96           HA       THR  96 -11.318  -4.621   5.839
  675    HB   THR  96           HB       THR  96 -12.430  -2.852   7.429
  676    HG1  THR  96           HG1      THR  96 -12.076  -1.132   5.809
  677   HG21  THR  96          HG21      THR  96 -10.279  -2.564   8.518
  678   HG22  THR  96          HG22      THR  96  -9.460  -3.080   7.044
  679   HG23  THR  96          HG23      THR  96 -10.488  -4.217   7.931
  680    HA   PRO  97           HA       PRO  97 -15.316  -4.786   3.796
  681    HB2  PRO  97           HB2      PRO  97 -16.056  -6.989   5.328
  682    HB3  PRO  97           HB1      PRO  97 -15.335  -7.054   3.719
  683    HG2  PRO  97           HG2      PRO  97 -14.122  -7.524   6.365
  684    HG3  PRO  97           HG1      PRO  97 -13.669  -8.171   4.782
  685    HD2  PRO  97           HD2      PRO  97 -12.294  -6.221   6.091
  686    HD3  PRO  97           HD1      PRO  97 -12.283  -6.421   4.333
  687    H    SER  98           HN       SER  98 -17.395  -4.284   4.541
  688    HA   SER  98           HA       SER  98 -17.515  -2.794   6.934
  689    HB2  SER  98           HB2      SER  98 -19.823  -3.804   5.263
  690    HB3  SER  98           HB1      SER  98 -19.842  -2.438   6.381
  691    HG   SER  98           HG       SER  98 -19.517  -2.041   4.001
  692    H    ASN  99           HN       ASN  99 -17.587  -6.063   6.435
  693    HA   ASN  99           HA       ASN  99 -19.273  -6.823   8.630
  694    HB2  ASN  99           HB2      ASN  99 -18.669  -8.235   6.571
  695    HB3  ASN  99           HB1      ASN  99 -17.129  -8.506   7.367
  696   HD21  ASN  99          HD21      ASN  99 -17.045  -9.802   9.209
  697   HD22  ASN  99          HD22      ASN  99 -18.358 -10.823   9.670
  698    H    GLY 100           HN       GLY 100 -16.075  -5.629   8.293
  699    HA2  GLY 100           HA2      GLY 100 -14.542  -5.130   9.952
  700    HA3  GLY 100           HA1      GLY 100 -15.578  -5.942  11.117
  701    H    GLY 101           HN       GLY 101 -14.927  -7.716   8.338
  702    HA2  GLY 101           HA2      GLY 101 -13.427  -9.638   9.934
  703    HA3  GLY 101           HA1      GLY 101 -14.192  -9.945   8.385
  704    H    GLN 102           HN       GLN 102 -12.093 -11.038   8.017
  705    HA   GLN 102           HA       GLN 102  -9.651  -9.725   7.860
  706    HB2  GLN 102           HB2      GLN 102  -8.930 -11.525   6.388
  707    HB3  GLN 102           HB1      GLN 102  -9.889 -12.163   7.719
  708    HG2  GLN 102           HG2      GLN 102 -11.817 -12.347   6.276
  709    HG3  GLN 102           HG1      GLN 102 -10.906 -11.635   4.947
  710   HE21  GLN 102          HE21      GLN 102  -9.515 -13.920   7.196
  711   HE22  GLN 102          HE22      GLN 102  -9.358 -15.219   6.067
  712    H    ALA 103           HN       ALA 103  -8.588  -8.623   6.300
  713    HA   ALA 103           HA       ALA 103 -10.323  -7.098   4.537
  714    HB1  ALA 103           HB1      ALA 103  -7.405  -6.755   5.197
  715    HB2  ALA 103           HB2      ALA 103  -8.759  -5.922   5.967
  716    HB3  ALA 103           HB3      ALA 103  -8.401  -5.637   4.260
  717    H    THR 104           HN       THR 104 -10.054  -6.743   2.502
  718    HA   THR 104           HA       THR 104  -9.053  -8.887   0.865
  719    HB   THR 104           HB       THR 104 -10.892  -6.625   0.675
  720    HG1  THR 104           HG1      THR 104 -11.307  -8.997   0.609
  721   HG21  THR 104          HG21      THR 104 -10.770  -6.422  -1.768
  722   HG22  THR 104          HG22      THR 104  -9.275  -7.366  -1.752
  723   HG23  THR 104          HG23      THR 104  -9.336  -5.793  -0.959
  724    H    VAL 105           HN       VAL 105  -7.143  -8.804  -0.328
  725    HA   VAL 105           HA       VAL 105  -5.576  -6.347   0.078
  726    HB   VAL 105           HB       VAL 105  -4.643  -9.154   0.651
  727   HG11  VAL 105          HG11      VAL 105  -2.845  -7.909  -0.355
  728   HG12  VAL 105          HG12      VAL 105  -2.540  -8.087   1.373
  729   HG13  VAL 105          HG13      VAL 105  -3.135  -6.558   0.736
  730   HG21  VAL 105          HG21      VAL 105  -5.987  -8.292   2.459
  731   HG22  VAL 105          HG22      VAL 105  -5.085  -6.776   2.449
  732   HG23  VAL 105          HG23      VAL 105  -4.287  -8.269   2.941
  733    H    LEU 106           HN       LEU 106  -4.539  -5.637  -1.578
  734    HA   LEU 106           HA       LEU 106  -3.648  -7.400  -3.744
  735    HB2  LEU 106           HB2      LEU 106  -4.136  -4.473  -3.470
  736    HB3  LEU 106           HB1      LEU 106  -2.827  -4.962  -4.530
  737    HG   LEU 106           HG       LEU 106  -4.743  -4.593  -5.880
  738   HD11  LEU 106          HD11      LEU 106  -3.403  -6.534  -6.483
  739   HD12  LEU 106          HD12      LEU 106  -5.100  -6.781  -6.892
  740   HD13  LEU 106          HD13      LEU 106  -4.413  -7.566  -5.471
  741   HD21  LEU 106          HD21      LEU 106  -6.463  -4.733  -4.133
  742   HD22  LEU 106          HD22      LEU 106  -6.243  -6.479  -4.034
  743   HD23  LEU 106          HD23      LEU 106  -6.885  -5.750  -5.507
  744    H    THR 107           HN       THR 107  -1.675  -8.320  -3.274
  745    HA   THR 107           HA       THR 107   0.172  -6.716  -1.625
  746    HB   THR 107           HB       THR 107   0.483  -9.676  -1.912
  747    HG1  THR 107           HG1      THR 107  -1.443  -9.831  -1.032
  748   HG21  THR 107          HG21      THR 107   2.288  -8.383  -0.850
  749   HG22  THR 107          HG22      THR 107   1.514  -9.452   0.316
  750   HG23  THR 107          HG23      THR 107   1.143  -7.731   0.320
  751    H    TYR 108           HN       TYR 108   2.194  -6.404  -2.185
  752    HA   TYR 108           HA       TYR 108   3.357  -7.863  -4.462
  753    HB2  TYR 108           HB2      TYR 108   3.272  -5.774  -5.447
  754    HB3  TYR 108           HB1      TYR 108   3.219  -4.943  -3.904
  755    HD1  TYR 108           HD1      TYR 108   5.179  -4.142  -2.862
  756    HD2  TYR 108           HD2      TYR 108   5.470  -6.519  -6.376
  757    HE1  TYR 108           HE1      TYR 108   7.531  -3.500  -3.081
  758    HE2  TYR 108           HE2      TYR 108   7.841  -5.901  -6.601
  759    HH   TYR 108           HH       TYR 108   9.612  -4.483  -4.149
  760    H    ASP 109           HN       ASP 109   5.555  -8.504  -4.086
  761    HA   ASP 109           HA       ASP 109   6.368  -8.126  -1.283
  762    HB2  ASP 109           HB2      ASP 109   5.916 -10.497  -2.285
  763    HB3  ASP 109           HB1      ASP 109   7.500 -10.287  -3.024
  764    H    TRP 110           HN       TRP 110   8.089  -6.912  -0.916
  765    HA   TRP 110           HA       TRP 110   9.635  -5.936  -3.145
  766    HB2  TRP 110           HB2      TRP 110   9.228  -4.213  -1.663
  767    HB3  TRP 110           HB1      TRP 110   9.404  -5.231  -0.246
  768    HD1  TRP 110           HD1      TRP 110  11.733  -5.255   0.925
  769    HE1  TRP 110           HE1      TRP 110  13.977  -4.070   0.492
  770    HE3  TRP 110           HE3      TRP 110  10.762  -3.334  -3.716
  771    HZ2  TRP 110           HZ2      TRP 110  15.170  -2.530  -1.544
  772    HZ3  TRP 110           HZ3      TRP 110  12.512  -2.018  -4.836
  773    HH2  TRP 110           HH2      TRP 110  14.669  -1.624  -3.770
  774    H    SER 111           HN       SER 111   9.967  -8.335  -0.680
  775    HA   SER 111           HA       SER 111  12.824  -8.600  -1.292
  776    HB2  SER 111           HB2      SER 111  12.233  -8.390   1.097
  777    HB3  SER 111           HB1      SER 111  11.235  -9.831   0.962
  778    HG   SER 111           HG       SER 111  13.256 -10.380   1.786
  779    H    ALA 112           HN       ALA 112   9.773 -10.238  -1.325
  780    HA   ALA 112           HA       ALA 112   8.964 -11.985  -2.471
  781    HB1  ALA 112           HB1      ALA 112   9.872 -10.637  -4.277
  782    HB2  ALA 112           HB2      ALA 112   9.878 -12.362  -4.654
  783    HB3  ALA 112           HB3      ALA 112  11.373 -11.551  -4.184
  784    H    ASN 113           HN       ASN 113  11.116 -12.409  -0.392
  785    HA   ASN 113           HA       ASN 113  12.270 -14.948  -1.159
  786    HB2  ASN 113           HB2      ASN 113  13.419 -13.309   0.387
  787    HB3  ASN 113           HB1      ASN 113  12.209 -13.707   1.601
  788   HD21  ASN 113          HD21      ASN 113  15.061 -14.063   1.740
  789   HD22  ASN 113          HD22      ASN 113  15.342 -15.753   1.980
  790    H    GLY 114           HN       GLY 114  10.238 -15.913  -1.690
  791    HA2  GLY 114           HA2      GLY 114   9.289 -17.919  -0.386
  792    HA3  GLY 114           HA1      GLY 114   8.593 -16.662   0.627
  793    H    VAL 115           HN       VAL 115   6.481 -16.626   0.212
  794    HA   VAL 115           HA       VAL 115   5.634 -16.075  -2.516
  795    HB   VAL 115           HB       VAL 115   5.498 -18.568  -2.209
  796   HG11  VAL 115          HG11      VAL 115   4.909 -18.656   0.137
  797   HG12  VAL 115          HG12      VAL 115   3.667 -19.456  -0.825
  798   HG13  VAL 115          HG13      VAL 115   3.383 -17.836  -0.189
  799   HG21  VAL 115          HG21      VAL 115   4.143 -17.508  -3.879
  800   HG22  VAL 115          HG22      VAL 115   2.945 -17.032  -2.675
  801   HG23  VAL 115          HG23      VAL 115   3.169 -18.738  -3.073
  802    H    ASN 116           HN       ASN 116   3.594 -15.082  -2.633
  803    HA   ASN 116           HA       ASN 116   2.684 -13.901  -0.111
  804    HB2  ASN 116           HB2      ASN 116   2.425 -13.107  -2.998
  805    HB3  ASN 116           HB1      ASN 116   1.382 -12.404  -1.773
  806   HD21  ASN 116          HD21      ASN 116   4.661 -13.295  -1.046
  807   HD22  ASN 116          HD22      ASN 116   5.289 -11.687  -0.922
  808    H    SER 117           HN       SER 117   0.101 -13.250  -0.630
  809    HA   SER 117           HA       SER 117  -1.287 -15.704  -0.398
  810    HB2  SER 117           HB2      SER 117  -2.385 -12.942  -0.968
  811    HB3  SER 117           HB1      SER 117  -3.314 -14.323  -0.386
  812    HG   SER 117           HG       SER 117  -2.162 -14.267   1.531
  813    H    ASN 118           HN       ASN 118  -0.499 -13.639  -3.047
  814    HA   ASN 118           HA       ASN 118  -0.620 -13.868  -5.296
  815    HB2  ASN 118           HB2      ASN 118  -1.411 -16.714  -4.653
  816    HB3  ASN 118           HB1      ASN 118  -1.060 -16.118  -6.266
  817   HD21  ASN 118          HD21      ASN 118   1.113 -14.399  -5.358
  818   HD22  ASN 118          HD22      ASN 118   2.433 -15.457  -5.003
  Start of MODEL    6
    1    H1   HIS   6           HT1      HIS   6 -20.349  -7.066  -5.692
    2    H2   HIS   6           HT2      HIS   6 -19.487  -8.140  -6.673
    3    H3   HIS   6           HT3      HIS   6 -21.125  -7.836  -6.984
    4    HA   HIS   6           HA       HIS   6 -19.795  -6.663  -8.572
    5    HB2  HIS   6           HB2      HIS   6 -21.100  -4.932  -6.471
    6    HB3  HIS   6           HB1      HIS   6 -20.466  -4.275  -7.973
    7    HD1  HIS   6           HD1      HIS   6 -23.466  -5.664  -6.524
    8    HD2  HIS   6           HD2      HIS   6 -21.792  -5.479 -10.321
    9    HE1  HIS   6           HE1      HIS   6 -25.352  -6.132  -8.116
   10    HE2  HIS   6           HE2      HIS   6 -24.353  -5.814 -10.405
   11    H    GLN   7           HN       GLN   7 -19.177  -5.140  -5.395
   12    HA   GLN   7           HA       GLN   7 -16.817  -3.848  -6.149
   13    HB2  GLN   7           HB2      GLN   7 -17.894  -3.119  -4.176
   14    HB3  GLN   7           HB1      GLN   7 -17.866  -4.733  -3.501
   15    HG2  GLN   7           HG2      GLN   7 -15.512  -4.633  -3.094
   16    HG3  GLN   7           HG1      GLN   7 -15.384  -3.108  -3.986
   17   HE21  GLN   7          HE21      GLN   7 -16.590  -4.627  -1.081
   18   HE22  GLN   7          HE22      GLN   7 -16.763  -3.173  -0.162
   19    H    ASP   8           HN       ASP   8 -17.399  -7.132  -5.275
   20    HA   ASP   8           HA       ASP   8 -14.873  -7.817  -4.348
   21    HB2  ASP   8           HB2      ASP   8 -15.445 -10.121  -4.935
   22    HB3  ASP   8           HB1      ASP   8 -16.796  -9.305  -4.157
   23    H    ASN   9           HN       ASN   9 -16.053  -7.336  -7.596
   24    HA   ASN   9           HA       ASN   9 -13.501  -8.103  -8.743
   25    HB2  ASN   9           HB2      ASN   9 -16.041  -6.967  -9.890
   26    HB3  ASN   9           HB1      ASN   9 -14.563  -7.063 -10.839
   27   HD21  ASN   9          HD21      ASN   9 -17.090  -8.408 -11.282
   28   HD22  ASN   9          HD22      ASN   9 -16.754 -10.102 -11.260
   29    H    ALA  10           HN       ALA  10 -15.280  -5.247  -7.850
   30    HA   ALA  10           HA       ALA  10 -13.741  -3.337  -9.233
   31    HB1  ALA  10           HB1      ALA  10 -15.273  -2.982  -6.672
   32    HB2  ALA  10           HB2      ALA  10 -15.926  -2.810  -8.306
   33    HB3  ALA  10           HB3      ALA  10 -14.678  -1.694  -7.725
   34    H    ARG  11           HN       ARG  11 -13.641  -4.425  -5.878
   35    HA   ARG  11           HA       ARG  11 -11.694  -2.737  -4.890
   36    HB2  ARG  11           HB2      ARG  11 -11.219  -4.463  -3.231
   37    HB3  ARG  11           HB1      ARG  11 -12.958  -4.281  -3.468
   38    HG2  ARG  11           HG2      ARG  11 -12.762  -6.229  -5.103
   39    HG3  ARG  11           HG1      ARG  11 -11.165  -6.494  -4.407
   40    HD2  ARG  11           HD2      ARG  11 -12.271  -6.578  -2.163
   41    HD3  ARG  11           HD1      ARG  11 -13.812  -6.568  -3.032
   42    HE   ARG  11           HE       ARG  11 -12.223  -8.610  -4.101
   43   HH11  ARG  11          HH11      ARG  11 -13.895  -7.853  -1.129
   44   HH12  ARG  11          HH12      ARG  11 -14.169  -9.514  -0.708
   45   HH21  ARG  11          HH21      ARG  11 -12.594 -10.803  -3.555
   46   HH22  ARG  11          HH22      ARG  11 -13.442 -11.186  -2.090
   47    H    LYS  12           HN       LYS  12 -11.287  -5.936  -6.321
   48    HA   LYS  12           HA       LYS  12  -8.583  -6.135  -6.492
   49    HB2  LYS  12           HB2      LYS  12  -9.990  -7.888  -7.392
   50    HB3  LYS  12           HB1      LYS  12 -10.611  -6.796  -8.630
   51    HG2  LYS  12           HG2      LYS  12  -8.678  -6.867  -9.869
   52    HG3  LYS  12           HG1      LYS  12  -7.681  -7.322  -8.490
   53    HD2  LYS  12           HD2      LYS  12  -9.768  -9.212  -9.453
   54    HD3  LYS  12           HD1      LYS  12  -8.254  -9.060 -10.351
   55    HE2  LYS  12           HE2      LYS  12  -7.776 -10.754  -8.851
   56    HE3  LYS  12           HE1      LYS  12  -7.131  -9.326  -8.043
   57    HZ1  LYS  12           HZ1      LYS  12  -9.028  -9.244  -6.629
   58    HZ2  LYS  12           HZ2      LYS  12  -8.436 -10.827  -6.587
   59    HZ3  LYS  12           HZ3      LYS  12  -9.816 -10.465  -7.492
   60    H    SER  13           HN       SER  13 -10.654  -4.487  -8.898
   61    HA   SER  13           HA       SER  13  -8.377  -3.732 -10.452
   62    HB2  SER  13           HB2      SER  13 -11.279  -2.886 -10.563
   63    HB3  SER  13           HB1      SER  13 -10.077  -2.493 -11.797
   64    HG   SER  13           HG       SER  13  -9.798  -4.764 -12.094
   65    H    ARG  14           HN       ARG  14 -10.635  -1.936  -8.380
   66    HA   ARG  14           HA       ARG  14  -9.581   0.612  -8.866
   67    HB2  ARG  14           HB2      ARG  14 -10.774   1.307  -6.832
   68    HB3  ARG  14           HB1      ARG  14 -11.792   0.308  -7.864
   69    HG2  ARG  14           HG2      ARG  14 -12.207  -0.996  -6.131
   70    HG3  ARG  14           HG1      ARG  14 -10.495  -1.437  -6.113
   71    HD2  ARG  14           HD2      ARG  14 -11.610  -0.509  -3.975
   72    HD3  ARG  14           HD1      ARG  14  -9.992   0.021  -4.411
   73    HE   ARG  14           HE       ARG  14 -11.384   1.973  -5.497
   74   HH11  ARG  14          HH11      ARG  14 -12.033   0.370  -2.457
   75   HH12  ARG  14          HH12      ARG  14 -12.674   1.792  -1.703
   76   HH21  ARG  14          HH21      ARG  14 -12.199   3.856  -4.492
   77   HH22  ARG  14          HH22      ARG  14 -12.782   3.763  -2.857
   78    H    ILE  15           HN       ILE  15  -8.666  -1.870  -6.540
   79    HA   ILE  15           HA       ILE  15  -6.820  -0.098  -5.239
   80    HB   ILE  15           HB       ILE  15  -7.154  -3.082  -5.030
   81   HG12  ILE  15          HG12      ILE  15  -7.997  -0.895  -3.098
   82   HG13  ILE  15          HG11      ILE  15  -9.086  -1.646  -4.258
   83   HG21  ILE  15          HG21      ILE  15  -4.888  -2.262  -4.453
   84   HG22  ILE  15          HG22      ILE  15  -5.744  -2.904  -3.047
   85   HG23  ILE  15          HG23      ILE  15  -5.608  -1.158  -3.277
   86   HD11  ILE  15          HD11      ILE  15  -7.592  -3.262  -2.240
   87   HD12  ILE  15          HD12      ILE  15  -9.044  -3.695  -3.157
   88   HD13  ILE  15          HD13      ILE  15  -9.129  -2.483  -1.863
   89    H    GLN  16           HN       GLN  16  -6.691  -2.958  -7.333
   90    HA   GLN  16           HA       GLN  16  -4.031  -3.398  -7.666
   91    HB2  GLN  16           HB2      GLN  16  -6.443  -3.919  -9.063
   92    HB3  GLN  16           HB1      GLN  16  -5.201  -3.508 -10.233
   93    HG2  GLN  16           HG2      GLN  16  -3.754  -5.248  -9.128
   94    HG3  GLN  16           HG1      GLN  16  -5.187  -5.719  -8.209
   95   HE21  GLN  16          HE21      GLN  16  -6.930  -5.090 -10.502
   96   HE22  GLN  16          HE22      GLN  16  -6.749  -6.411 -11.597
   97    H    SER  17           HN       SER  17  -5.999  -1.056  -9.453
   98    HA   SER  17           HA       SER  17  -4.172  -0.085 -11.252
   99    HB2  SER  17           HB2      SER  17  -6.513   0.591 -11.251
  100    HB3  SER  17           HB1      SER  17  -6.301   1.423  -9.713
  101    HG   SER  17           HG       SER  17  -5.058   2.955 -10.702
  102    H    GLU  18           HN       GLU  18  -4.760   1.130  -7.976
  103    HA   GLU  18           HA       GLU  18  -2.485   2.892  -8.189
  104    HB2  GLU  18           HB2      GLU  18  -4.081   2.512  -5.705
  105    HB3  GLU  18           HB1      GLU  18  -3.250   3.942  -6.287
  106    HG2  GLU  18           HG2      GLU  18  -5.709   2.751  -7.516
  107    HG3  GLU  18           HG1      GLU  18  -5.667   4.134  -6.433
  108    H    HIS  19           HN       HIS  19  -3.277  -0.180  -6.817
  109    HA   HIS  19           HA       HIS  19  -1.377  -0.552  -4.855
  110    HB2  HIS  19           HB2      HIS  19  -2.674  -2.428  -4.995
  111    HB3  HIS  19           HB1      HIS  19  -2.851  -2.317  -6.732
  112    HD1  HIS  19           HD1      HIS  19  -0.168  -3.410  -4.228
  113    HD2  HIS  19           HD2      HIS  19  -1.569  -4.260  -8.042
  114    HE1  HIS  19           HE1      HIS  19   1.164  -5.390  -5.008
  115    HE2  HIS  19           HE2      HIS  19   0.220  -5.963  -7.269
  116    H    ARG  20           HN       ARG  20  -0.976  -1.065  -8.358
  117    HA   ARG  20           HA       ARG  20   1.736  -1.683  -8.368
  118    HB2  ARG  20           HB2      ARG  20   0.177  -0.071 -10.410
  119    HB3  ARG  20           HB1      ARG  20   1.722  -0.862 -10.696
  120    HG2  ARG  20           HG2      ARG  20  -0.317  -2.663  -9.651
  121    HG3  ARG  20           HG1      ARG  20  -0.748  -1.934 -11.200
  122    HD2  ARG  20           HD2      ARG  20   0.481  -4.118 -11.346
  123    HD3  ARG  20           HD1      ARG  20   1.206  -2.787 -12.242
  124    HE   ARG  20           HE       ARG  20   2.825  -2.587 -10.413
  125   HH11  ARG  20          HH11      ARG  20   1.018  -5.578 -10.635
  126   HH12  ARG  20          HH12      ARG  20   2.253  -6.527  -9.878
  127   HH21  ARG  20          HH21      ARG  20   4.454  -3.829  -9.421
  128   HH22  ARG  20          HH22      ARG  20   4.209  -5.530  -9.179
  129    H    GLU  21           HN       GLU  21   0.138   1.470  -8.369
  130    HA   GLU  21           HA       GLU  21   2.383   3.121  -8.599
  131    HB2  GLU  21           HB2      GLU  21  -0.078   3.737  -6.961
  132    HB3  GLU  21           HB1      GLU  21   0.968   4.885  -7.784
  133    HG2  GLU  21           HG2      GLU  21  -0.814   2.868  -9.115
  134    HG3  GLU  21           HG1      GLU  21  -1.189   4.582  -8.916
  135    H    LEU  22           HN       LEU  22   0.705   1.973  -5.662
  136    HA   LEU  22           HA       LEU  22   2.307   3.350  -3.835
  137    HB2  LEU  22           HB2      LEU  22   0.642   0.873  -3.556
  138    HB3  LEU  22           HB1      LEU  22   1.630   1.441  -2.228
  139    HG   LEU  22           HG       LEU  22  -0.412   2.353  -1.718
  140   HD11  LEU  22          HD11      LEU  22   1.396   4.067  -1.877
  141   HD12  LEU  22          HD12      LEU  22  -0.234   4.715  -2.034
  142   HD13  LEU  22          HD13      LEU  22   0.772   4.512  -3.466
  143   HD21  LEU  22          HD21      LEU  22  -1.956   3.316  -3.312
  144   HD22  LEU  22          HD22      LEU  22  -1.540   1.664  -3.764
  145   HD23  LEU  22          HD23      LEU  22  -0.817   3.022  -4.624
  146    H    VAL  23           HN       VAL  23   2.780   0.148  -5.270
  147    HA   VAL  23           HA       VAL  23   5.042  -0.325  -3.573
  148    HB   VAL  23           HB       VAL  23   4.724  -2.414  -4.069
  149   HG11  VAL  23          HG11      VAL  23   2.372  -1.720  -4.509
  150   HG12  VAL  23          HG12      VAL  23   2.863  -3.198  -5.337
  151   HG13  VAL  23          HG13      VAL  23   2.769  -1.682  -6.228
  152   HG21  VAL  23          HG21      VAL  23   5.142  -3.317  -6.312
  153   HG22  VAL  23          HG22      VAL  23   6.402  -2.219  -5.727
  154   HG23  VAL  23          HG23      VAL  23   5.212  -1.659  -6.918
  155    H    SER  24           HN       SER  24   4.505   0.777  -6.871
  156    HA   SER  24           HA       SER  24   7.163   0.998  -7.698
  157    HB2  SER  24           HB2      SER  24   5.184   1.521  -9.122
  158    HB3  SER  24           HB1      SER  24   4.911   2.978  -8.168
  159    HG   SER  24           HG       SER  24   6.344   3.940  -9.338
  160    H    ALA  25           HN       ALA  25   5.248   2.770  -5.427
  161    HA   ALA  25           HA       ALA  25   7.170   4.897  -5.020
  162    HB1  ALA  25           HB1      ALA  25   4.936   4.143  -3.166
  163    HB2  ALA  25           HB2      ALA  25   4.652   5.065  -4.649
  164    HB3  ALA  25           HB3      ALA  25   5.702   5.720  -3.376
  165    H    ILE  26           HN       ILE  26   6.298   1.831  -3.429
  166    HA   ILE  26           HA       ILE  26   7.950   2.131  -1.207
  167    HB   ILE  26           HB       ILE  26   6.628  -0.157  -2.528
  168   HG12  ILE  26          HG12      ILE  26   7.177   0.724   0.293
  169   HG13  ILE  26          HG11      ILE  26   5.661   0.855  -0.595
  170   HG21  ILE  26          HG21      ILE  26   9.055  -0.649  -0.815
  171   HG22  ILE  26          HG22      ILE  26   8.933  -1.002  -2.539
  172   HG23  ILE  26          HG23      ILE  26   7.920  -1.873  -1.382
  173   HD11  ILE  26          HD11      ILE  26   5.448  -1.538  -0.614
  174   HD12  ILE  26          HD12      ILE  26   5.625  -0.946   1.049
  175   HD13  ILE  26          HD13      ILE  26   6.990  -1.708   0.222
  176    H    GLN  27           HN       GLN  27   8.587   0.756  -4.390
  177    HA   GLN  27           HA       GLN  27  11.271   0.090  -3.987
  178    HB2  GLN  27           HB2      GLN  27   9.874   0.955  -6.529
  179    HB3  GLN  27           HB1      GLN  27  11.418   0.108  -6.452
  180    HG2  GLN  27           HG2      GLN  27  10.285  -1.785  -5.373
  181    HG3  GLN  27           HG1      GLN  27   8.759  -0.928  -5.512
  182   HE21  GLN  27          HE21      GLN  27  11.262  -2.603  -7.231
  183   HE22  GLN  27          HE22      GLN  27  10.388  -2.818  -8.708
  184    H    SER  28           HN       SER  28   9.708   3.100  -4.766
  185    HA   SER  28           HA       SER  28  12.061   4.592  -5.346
  186    HB2  SER  28           HB2      SER  28   9.244   5.379  -4.595
  187    HB3  SER  28           HB1      SER  28  10.476   6.530  -5.083
  188    HG   SER  28           HG       SER  28   9.282   4.466  -6.606
  189    H    TYR  29           HN       TYR  29   9.846   4.603  -2.539
  190    HA   TYR  29           HA       TYR  29  11.237   6.191  -0.767
  191    HB2  TYR  29           HB2      TYR  29   8.954   5.239  -0.463
  192    HB3  TYR  29           HB1      TYR  29   9.675   3.671  -0.145
  193    HD1  TYR  29           HD1      TYR  29   7.765   4.729   1.675
  194    HD2  TYR  29           HD2      TYR  29  11.965   5.483   1.563
  195    HE1  TYR  29           HE1      TYR  29   7.737   5.182   4.090
  196    HE2  TYR  29           HE2      TYR  29  11.929   5.940   3.974
  197    HH   TYR  29           HH       TYR  29  10.340   6.647   5.703
  198    H    ILE  30           HN       ILE  30  11.413   2.661  -1.074
  199    HA   ILE  30           HA       ILE  30  13.355   2.276   0.902
  200    HB   ILE  30           HB       ILE  30  12.538   0.580  -1.444
  201   HG12  ILE  30          HG12      ILE  30  11.788   0.610   1.484
  202   HG13  ILE  30          HG11      ILE  30  10.764   1.051   0.129
  203   HG21  ILE  30          HG21      ILE  30  14.297  -0.112   0.897
  204   HG22  ILE  30          HG22      ILE  30  14.735  -0.120  -0.811
  205   HG23  ILE  30          HG23      ILE  30  13.574  -1.296  -0.192
  206   HD11  ILE  30          HD11      ILE  30  10.131  -1.093   0.922
  207   HD12  ILE  30          HD12      ILE  30  11.791  -1.686   0.795
  208   HD13  ILE  30          HD13      ILE  30  10.886  -1.274  -0.665
  209    H    GLY  31           HN       GLY  31  13.650   2.751  -2.590
  210    HA2  GLY  31           HA2      GLY  31  16.461   2.267  -2.671
  211    HA3  GLY  31           HA1      GLY  31  15.510   3.067  -3.916
  212    H    ALA  32           HN       ALA  32  14.535   4.864  -1.643
  213    HA   ALA  32           HA       ALA  32  16.613   6.872  -1.907
  214    HB1  ALA  32           HB1      ALA  32  13.954   7.073  -0.520
  215    HB2  ALA  32           HB2      ALA  32  14.198   7.394  -2.238
  216    HB3  ALA  32           HB3      ALA  32  14.995   8.402  -1.029
  217    H    GLN  33           HN       GLN  33  15.337   4.666   0.444
  218    HA   GLN  33           HA       GLN  33  15.951   6.007   2.784
  219    HB2  GLN  33           HB2      GLN  33  15.766   3.091   2.156
  220    HB3  GLN  33           HB1      GLN  33  16.118   3.689   3.772
  221    HG2  GLN  33           HG2      GLN  33  13.818   4.962   2.540
  222    HG3  GLN  33           HG1      GLN  33  13.640   3.230   2.742
  223   HE21  GLN  33          HE21      GLN  33  15.525   5.314   4.827
  224   HE22  GLN  33          HE22      GLN  33  14.529   5.139   6.224
  225    H    ASP  34           HN       ASP  34  17.656   5.704   4.270
  226    HA   ASP  34           HA       ASP  34  20.276   5.531   3.251
  227    HB2  ASP  34           HB2      ASP  34  19.495   6.675   5.368
  228    HB3  ASP  34           HB1      ASP  34  19.441   5.080   6.098
  229    H    ASP  35           HN       ASP  35  18.081   3.323   4.701
  230    HA   ASP  35           HA       ASP  35  19.816   1.114   3.904
  231    HB2  ASP  35           HB2      ASP  35  18.273  -0.174   5.601
  232    HB3  ASP  35           HB1      ASP  35  19.701   0.676   6.135
  233    HA   PRO  36           HA       PRO  36  16.173   0.417   1.277
  234    HB2  PRO  36           HB2      PRO  36  17.535  -0.549  -0.780
  235    HB3  PRO  36           HB1      PRO  36  17.525   1.187  -0.468
  236    HG2  PRO  36           HG2      PRO  36  19.584  -0.829   0.389
  237    HG3  PRO  36           HG1      PRO  36  19.845   0.667  -0.527
  238    HD2  PRO  36           HD2      PRO  36  20.193   0.618   2.116
  239    HD3  PRO  36           HD1      PRO  36  19.435   2.018   1.324
  240    H    THR  37           HN       THR  37  18.421  -1.150   2.968
  241    HA   THR  37           HA       THR  37  17.880  -3.841   2.106
  242    HB   THR  37           HB       THR  37  19.651  -4.458   3.616
  243    HG1  THR  37           HG1      THR  37  20.345  -3.123   5.231
  244   HG21  THR  37          HG21      THR  37  20.363  -3.307   1.547
  245   HG22  THR  37          HG22      THR  37  21.476  -3.011   2.885
  246   HG23  THR  37          HG23      THR  37  20.313  -1.767   2.413
  247    H    ASN  38           HN       ASN  38  17.088  -1.655   4.636
  248    HA   ASN  38           HA       ASN  38  14.913  -3.305   5.530
  249    HB2  ASN  38           HB2      ASN  38  16.984  -4.132   6.698
  250    HB3  ASN  38           HB1      ASN  38  17.071  -2.568   7.509
  251   HD21  ASN  38          HD21      ASN  38  16.717  -5.231   8.646
  252   HD22  ASN  38          HD22      ASN  38  15.233  -5.185   9.531
  253    HA   PRO  39           HA       PRO  39  14.480   1.379   5.802
  254    HB2  PRO  39           HB2      PRO  39  12.161   1.401   4.336
  255    HB3  PRO  39           HB1      PRO  39  13.776   1.698   3.691
  256    HG2  PRO  39           HG2      PRO  39  12.150  -0.785   3.616
  257    HG3  PRO  39           HG1      PRO  39  13.210  -0.100   2.393
  258    HD2  PRO  39           HD2      PRO  39  13.953  -2.174   3.894
  259    HD3  PRO  39           HD1      PRO  39  15.099  -0.957   3.334
  260    H    SER  40           HN       SER  40  12.388   2.537   6.374
  261    HA   SER  40           HA       SER  40  11.419   1.380   8.804
  262    HB2  SER  40           HB2      SER  40  10.609   3.926   7.378
  263    HB3  SER  40           HB1      SER  40  10.199   3.509   9.041
  264    HG   SER  40           HG       SER  40  12.889   3.359   8.427
  265    H    GLU  41           HN       GLU  41   8.943   1.749   9.256
  266    HA   GLU  41           HA       GLU  41   7.432   0.091   7.529
  267    HB2  GLU  41           HB2      GLU  41   6.709   0.055   9.750
  268    HB3  GLU  41           HB1      GLU  41   6.822   1.796   9.918
  269    HG2  GLU  41           HG2      GLU  41   4.892   2.124   8.621
  270    HG3  GLU  41           HG1      GLU  41   4.793   0.419   8.193
  271    H    ILE  42           HN       ILE  42   6.378   0.581   5.807
  272    HA   ILE  42           HA       ILE  42   6.530   3.335   4.908
  273    HB   ILE  42           HB       ILE  42   6.310   0.699   3.502
  274   HG12  ILE  42          HG12      ILE  42   8.368   2.872   3.762
  275   HG13  ILE  42          HG11      ILE  42   8.523   1.158   4.123
  276   HG21  ILE  42          HG21      ILE  42   6.159   3.441   2.275
  277   HG22  ILE  42          HG22      ILE  42   4.834   2.282   2.392
  278   HG23  ILE  42          HG23      ILE  42   6.245   1.913   1.405
  279   HD11  ILE  42          HD11      ILE  42   9.744   1.763   2.135
  280   HD12  ILE  42          HD12      ILE  42   8.257   2.369   1.401
  281   HD13  ILE  42          HD13      ILE  42   8.430   0.646   1.761
  282    H    THR  43           HN       THR  43   4.774   4.526   4.507
  283    HA   THR  43           HA       THR  43   2.189   3.164   4.289
  284    HB   THR  43           HB       THR  43   1.107   4.975   5.571
  285    HG1  THR  43           HG1      THR  43   2.418   6.392   6.777
  286   HG21  THR  43          HG21      THR  43   1.816   4.224   7.790
  287   HG22  THR  43          HG22      THR  43   3.285   3.535   7.093
  288   HG23  THR  43          HG23      THR  43   1.707   2.861   6.673
  289    H    LEU  44           HN       LEU  44   0.496   4.681   3.465
  290    HA   LEU  44           HA       LEU  44   1.326   5.546   0.932
  291    HB2  LEU  44           HB2      LEU  44  -1.190   6.277   2.363
  292    HB3  LEU  44           HB1      LEU  44  -0.924   6.273   0.649
  293    HG   LEU  44           HG       LEU  44  -1.222   3.957   2.481
  294   HD11  LEU  44          HD11      LEU  44  -3.156   3.578   1.445
  295   HD12  LEU  44          HD12      LEU  44  -2.521   4.034  -0.133
  296   HD13  LEU  44          HD13      LEU  44  -3.033   5.281   1.005
  297   HD21  LEU  44          HD21      LEU  44  -0.640   2.519   0.531
  298   HD22  LEU  44          HD22      LEU  44   0.718   3.408   1.212
  299   HD23  LEU  44          HD23      LEU  44  -0.040   3.964  -0.278
  300    H    ALA  45           HN       ALA  45   0.635   7.177   3.903
  301    HA   ALA  45           HA       ALA  45   0.773   9.825   2.985
  302    HB1  ALA  45           HB1      ALA  45  -0.260   9.224   5.093
  303    HB2  ALA  45           HB2      ALA  45   1.058  10.375   5.372
  304    HB3  ALA  45           HB3      ALA  45   1.302   8.657   5.719
  305    H    LYS  46           HN       LYS  46   3.210   7.492   3.864
  306    HA   LYS  46           HA       LYS  46   5.401   9.363   3.857
  307    HB2  LYS  46           HB2      LYS  46   5.223   6.381   3.966
  308    HB3  LYS  46           HB1      LYS  46   6.732   7.250   4.020
  309    HG2  LYS  46           HG2      LYS  46   6.109   8.298   6.083
  310    HG3  LYS  46           HG1      LYS  46   4.505   7.562   6.001
  311    HD2  LYS  46           HD2      LYS  46   5.653   5.327   5.995
  312    HD3  LYS  46           HD1      LYS  46   7.155   6.185   6.365
  313    HE2  LYS  46           HE2      LYS  46   4.625   6.268   7.988
  314    HE3  LYS  46           HE1      LYS  46   6.062   5.298   8.360
  315    HZ1  LYS  46           HZ1      LYS  46   7.337   7.361   8.552
  316    HZ2  LYS  46           HZ2      LYS  46   6.051   7.333   9.650
  317    HZ3  LYS  46           HZ3      LYS  46   5.942   8.268   8.246
  318    H    LEU  47           HN       LEU  47   3.883   7.084   1.724
  319    HA   LEU  47           HA       LEU  47   5.964   7.029  -0.208
  320    HB2  LEU  47           HB2      LEU  47   3.106   6.105  -0.167
  321    HB3  LEU  47           HB1      LEU  47   4.115   5.944  -1.595
  322    HG   LEU  47           HG       LEU  47   4.639   4.705   1.102
  323   HD11  LEU  47          HD11      LEU  47   2.794   3.653  -0.079
  324   HD12  LEU  47          HD12      LEU  47   4.202   2.592  -0.047
  325   HD13  LEU  47          HD13      LEU  47   3.798   3.476  -1.518
  326   HD21  LEU  47          HD21      LEU  47   6.726   5.269   0.009
  327   HD22  LEU  47          HD22      LEU  47   6.180   4.509  -1.483
  328   HD23  LEU  47          HD23      LEU  47   6.470   3.526  -0.050
  329    H    ALA  48           HN       ALA  48   3.682   9.324   0.580
  330    HA   ALA  48           HA       ALA  48   2.578  10.315  -1.688
  331    HB1  ALA  48           HB1      ALA  48   2.339  12.391  -0.621
  332    HB2  ALA  48           HB2      ALA  48   3.787  12.150   0.349
  333    HB3  ALA  48           HB3      ALA  48   2.343  11.189   0.672
  334    HA   PRO  49           HA       PRO  49   6.453  13.061  -2.730
  335    HB2  PRO  49           HB2      PRO  49   8.621  11.558  -1.384
  336    HB3  PRO  49           HB1      PRO  49   8.356  13.294  -1.480
  337    HG2  PRO  49           HG2      PRO  49   7.916  12.046   0.795
  338    HG3  PRO  49           HG1      PRO  49   6.753  13.265   0.227
  339    HD2  PRO  49           HD2      PRO  49   6.630  10.284  -0.050
  340    HD3  PRO  49           HD1      PRO  49   5.389  11.386   0.571
  341    H    TYR  50           HN       TYR  50   6.449   9.635  -2.542
  342    HA   TYR  50           HA       TYR  50   8.301   9.353  -4.792
  343    HB2  TYR  50           HB2      TYR  50   7.167   7.211  -2.991
  344    HB3  TYR  50           HB1      TYR  50   8.485   7.039  -4.142
  345    HD1  TYR  50           HD1      TYR  50  10.570   8.525  -3.746
  346    HD2  TYR  50           HD2      TYR  50   7.625   7.745  -0.788
  347    HE1  TYR  50           HE1      TYR  50  12.166   9.189  -2.000
  348    HE2  TYR  50           HE2      TYR  50   9.212   8.406   0.977
  349    HH   TYR  50           HH       TYR  50  11.736   8.527   1.241
  350    H    MET  51           HN       MET  51   5.098   9.744  -4.316
  351    HA   MET  51           HA       MET  51   4.253   7.902  -6.417
  352    HB2  MET  51           HB2      MET  51   2.608   9.951  -4.936
  353    HB3  MET  51           HB1      MET  51   2.002   8.667  -5.971
  354    HG2  MET  51           HG2      MET  51   3.409   8.304  -3.348
  355    HG3  MET  51           HG1      MET  51   1.676   8.165  -3.634
  356    HE1  MET  51           HE1      MET  51   0.576   6.086  -5.015
  357    HE2  MET  51           HE2      MET  51   1.599   4.992  -5.948
  358    HE3  MET  51           HE3      MET  51   1.534   6.706  -6.361
  359    H    SER  52           HN       SER  52   2.825   8.873  -8.132
  360    HA   SER  52           HA       SER  52   3.385  11.642  -8.820
  361    HB2  SER  52           HB2      SER  52   4.171   9.400 -10.704
  362    HB3  SER  52           HB1      SER  52   4.310  11.129 -11.023
  363    HG   SER  52           HG       SER  52   5.557  10.727  -8.757
  364    H    LYS  53           HN       LYS  53   1.772   8.628  -9.476
  365    HA   LYS  53           HA       LYS  53   0.203   9.119 -11.592
  366    HB2  LYS  53           HB2      LYS  53  -1.512   7.635 -10.291
  367    HB3  LYS  53           HB1      LYS  53  -0.003   6.974 -10.874
  368    HG2  LYS  53           HG2      LYS  53  -0.053   6.130  -8.760
  369    HG3  LYS  53           HG1      LYS  53   0.851   7.601  -8.478
  370    HD2  LYS  53           HD2      LYS  53  -0.669   7.451  -6.716
  371    HD3  LYS  53           HD1      LYS  53  -1.348   8.659  -7.799
  372    HE2  LYS  53           HE2      LYS  53  -2.227   5.779  -7.478
  373    HE3  LYS  53           HE1      LYS  53  -3.116   7.225  -7.000
  374    HZ1  LYS  53           HZ1      LYS  53  -2.520   6.345  -9.777
  375    HZ2  LYS  53           HZ2      LYS  53  -3.229   7.832  -9.390
  376    HZ3  LYS  53           HZ3      LYS  53  -4.033   6.388  -9.016
  377    H    ASN  54           HN       ASN  54  -0.639   9.960  -8.362
  378    HA   ASN  54           HA       ASN  54  -2.661  11.845  -9.192
  379    HB2  ASN  54           HB2      ASN  54  -3.174   9.147  -8.026
  380    HB3  ASN  54           HB1      ASN  54  -4.162  10.496  -7.505
  381   HD21  ASN  54          HD21      ASN  54  -5.624  11.423  -8.958
  382   HD22  ASN  54          HD22      ASN  54  -6.042  10.656 -10.450
  383    H    ALA  55           HN       ALA  55  -0.255  12.118  -7.794
  384    HA   ALA  55           HA       ALA  55  -1.061  12.630  -5.054
  385    HB1  ALA  55           HB1      ALA  55   0.709  11.178  -4.171
  386    HB2  ALA  55           HB2      ALA  55   1.008  10.594  -5.808
  387    HB3  ALA  55           HB3      ALA  55  -0.547  10.291  -5.036
  388    H    LYS  56           HN       LYS  56   0.083  14.211  -4.124
  389    HA   LYS  56           HA       LYS  56   2.748  14.833  -5.112
  390    HB2  LYS  56           HB2      LYS  56   0.575  16.872  -4.622
  391    HB3  LYS  56           HB1      LYS  56   2.267  17.269  -4.884
  392    HG2  LYS  56           HG2      LYS  56   0.578  15.772  -6.864
  393    HG3  LYS  56           HG1      LYS  56   0.823  17.520  -6.890
  394    HD2  LYS  56           HD2      LYS  56   3.030  17.339  -7.488
  395    HD3  LYS  56           HD1      LYS  56   3.204  15.740  -6.771
  396    HE2  LYS  56           HE2      LYS  56   3.288  15.655  -9.217
  397    HE3  LYS  56           HE1      LYS  56   1.915  14.760  -8.571
  398    HZ1  LYS  56           HZ1      LYS  56   1.307  16.091 -10.496
  399    HZ2  LYS  56           HZ2      LYS  56   1.795  17.502  -9.706
  400    HZ3  LYS  56           HZ3      LYS  56   0.482  16.614  -9.117
  401    H    ASN  57           HN       ASN  57   0.327  15.439  -2.595
  402    HA   ASN  57           HA       ASN  57   2.474  15.245  -0.599
  403    HB2  ASN  57           HB2      ASN  57  -0.095  16.835  -0.453
  404    HB3  ASN  57           HB1      ASN  57   1.009  16.603   0.896
  405   HD21  ASN  57          HD21      ASN  57   0.497  18.167  -2.159
  406   HD22  ASN  57          HD22      ASN  57   1.799  19.297  -2.025
  407    H    GLU  58           HN       GLU  58   1.184  14.816   1.637
  408    HA   GLU  58           HA       GLU  58   0.343  12.141   1.469
  409    HB2  GLU  58           HB2      GLU  58   0.890  12.277   3.618
  410    HB3  GLU  58           HB1      GLU  58   0.940  14.029   3.503
  411    HG2  GLU  58           HG2      GLU  58  -1.418  14.150   3.974
  412    HG3  GLU  58           HG1      GLU  58  -1.495  12.391   4.085
  413    H    ASP  59           HN       ASP  59  -1.440  15.136   1.913
  414    HA   ASP  59           HA       ASP  59  -4.013  13.932   1.985
  415    HB2  ASP  59           HB2      ASP  59  -3.605  16.131   2.928
  416    HB3  ASP  59           HB1      ASP  59  -3.150  16.746   1.353
  417    H    GLY  60           HN       GLY  60  -1.796  14.616  -0.463
  418    HA2  GLY  60           HA2      GLY  60  -3.696  14.702  -2.629
  419    HA3  GLY  60           HA1      GLY  60  -1.946  14.621  -2.773
  420    H    ILE  61           HN       ILE  61  -1.216  12.382  -1.571
  421    HA   ILE  61           HA       ILE  61  -1.840  10.458  -3.501
  422    HB   ILE  61           HB       ILE  61   0.330  10.438  -2.551
  423   HG12  ILE  61          HG12      ILE  61   0.615   8.190  -1.919
  424   HG13  ILE  61          HG11      ILE  61  -1.037   8.062  -1.319
  425   HG21  ILE  61          HG21      ILE  61  -0.904  10.011   0.151
  426   HG22  ILE  61          HG22      ILE  61  -0.134  11.489  -0.419
  427   HG23  ILE  61          HG23      ILE  61   0.819  10.021  -0.210
  428   HD11  ILE  61          HD11      ILE  61  -0.376   8.615  -4.203
  429   HD12  ILE  61          HD12      ILE  61  -1.924   8.113  -3.505
  430   HD13  ILE  61          HD13      ILE  61  -0.565   6.986  -3.557
  431    H    VAL  62           HN       VAL  62  -2.457  10.492  -0.068
  432    HA   VAL  62           HA       VAL  62  -3.622   7.945   0.014
  433    HB   VAL  62           HB       VAL  62  -3.738  10.254   1.945
  434   HG11  VAL  62          HG11      VAL  62  -5.525   8.605   2.319
  435   HG12  VAL  62          HG12      VAL  62  -4.338   8.675   3.633
  436   HG13  VAL  62          HG13      VAL  62  -4.281   7.353   2.466
  437   HG21  VAL  62          HG21      VAL  62  -1.683   8.515   1.126
  438   HG22  VAL  62          HG22      VAL  62  -2.142   8.091   2.783
  439   HG23  VAL  62          HG23      VAL  62  -1.647   9.746   2.396
  440    H    ASN  63           HN       ASN  63  -4.918  11.133  -0.302
  441    HA   ASN  63           HA       ASN  63  -7.649  10.394   0.063
  442    HB2  ASN  63           HB2      ASN  63  -6.763  12.653   0.526
  443    HB3  ASN  63           HB1      ASN  63  -6.482  12.883  -1.193
  444   HD21  ASN  63          HD21      ASN  63  -7.832  14.605  -1.395
  445   HD22  ASN  63          HD22      ASN  63  -9.553  14.488  -1.252
  446    H    SER  64           HN       SER  64  -5.481  10.478  -2.650
  447    HA   SER  64           HA       SER  64  -7.644  10.353  -4.596
  448    HB2  SER  64           HB2      SER  64  -5.331  11.535  -4.889
  449    HB3  SER  64           HB1      SER  64  -4.749   9.909  -5.273
  450    HG   SER  64           HG       SER  64  -6.775  10.007  -6.743
  451    H    LEU  65           HN       LEU  65  -5.809   8.273  -2.697
  452    HA   LEU  65           HA       LEU  65  -5.973   5.971  -4.434
  453    HB2  LEU  65           HB2      LEU  65  -5.073   6.344  -1.589
  454    HB3  LEU  65           HB1      LEU  65  -5.104   4.786  -2.392
  455    HG   LEU  65           HG       LEU  65  -3.481   7.155  -3.270
  456   HD11  LEU  65          HD11      LEU  65  -2.612   4.618  -1.915
  457   HD12  LEU  65          HD12      LEU  65  -2.830   6.159  -1.089
  458   HD13  LEU  65          HD13      LEU  65  -1.606   5.997  -2.343
  459   HD21  LEU  65          HD21      LEU  65  -3.556   4.288  -4.183
  460   HD22  LEU  65          HD22      LEU  65  -2.353   5.481  -4.682
  461   HD23  LEU  65          HD23      LEU  65  -4.049   5.703  -5.116
  462    H    ALA  66           HN       ALA  66  -7.008   3.989  -3.748
  463    HA   ALA  66           HA       ALA  66  -9.631   4.050  -2.947
  464    HB1  ALA  66           HB1      ALA  66  -7.632   1.883  -2.313
  465    HB2  ALA  66           HB2      ALA  66  -8.549   2.022  -3.820
  466    HB3  ALA  66           HB3      ALA  66  -9.389   1.715  -2.292
  467    H    LYS  67           HN       LYS  67 -10.702   4.002  -1.037
  468    HA   LYS  67           HA       LYS  67  -9.064   4.537   1.327
  469    HB2  LYS  67           HB2      LYS  67 -11.897   5.443   0.845
  470    HB3  LYS  67           HB1      LYS  67 -10.857   5.899   2.182
  471    HG2  LYS  67           HG2      LYS  67 -10.611   6.695  -0.698
  472    HG3  LYS  67           HG1      LYS  67 -10.929   7.728   0.691
  473    HD2  LYS  67           HD2      LYS  67  -8.380   6.166   0.458
  474    HD3  LYS  67           HD1      LYS  67  -8.567   7.724  -0.335
  475    HE2  LYS  67           HE2      LYS  67  -8.787   7.172   2.622
  476    HE3  LYS  67           HE1      LYS  67  -7.452   7.995   1.804
  477    HZ1  LYS  67           HZ1      LYS  67  -8.829   9.651   2.742
  478    HZ2  LYS  67           HZ2      LYS  67 -10.243   8.948   2.144
  479    HZ3  LYS  67           HZ3      LYS  67  -9.150   9.675   1.083
  480    H    ASP  68           HN       ASP  68  -9.453   3.431   3.180
  481    HA   ASP  68           HA       ASP  68 -10.852   0.942   2.858
  482    HB2  ASP  68           HB2      ASP  68  -8.729   1.001   4.063
  483    HB3  ASP  68           HB1      ASP  68  -9.396   2.119   5.240
  484    H    LYS  69           HN       LYS  69 -12.751   0.300   4.025
  485    HA   LYS  69           HA       LYS  69 -14.609   2.405   3.920
  486    HB2  LYS  69           HB2      LYS  69 -15.176   0.109   3.342
  487    HB3  LYS  69           HB1      LYS  69 -14.950  -0.361   5.013
  488    HG2  LYS  69           HG2      LYS  69 -17.267  -0.207   4.739
  489    HG3  LYS  69           HG1      LYS  69 -16.808   1.274   5.577
  490    HD2  LYS  69           HD2      LYS  69 -16.882   1.348   2.612
  491    HD3  LYS  69           HD1      LYS  69 -18.424   1.273   3.463
  492    HE2  LYS  69           HE2      LYS  69 -16.269   3.307   3.999
  493    HE3  LYS  69           HE1      LYS  69 -17.665   3.586   2.963
  494    HZ1  LYS  69           HZ1      LYS  69 -17.696   3.014   5.876
  495    HZ2  LYS  69           HZ2      LYS  69 -19.081   3.119   4.913
  496    HZ3  LYS  69           HZ3      LYS  69 -18.094   4.475   5.123
  497    H    SER  70           HN       SER  70 -13.404   0.544   6.691
  498    HA   SER  70           HA       SER  70 -14.848   2.412   8.440
  499    HB2  SER  70           HB2      SER  70 -14.559   0.593  10.179
  500    HB3  SER  70           HB1      SER  70 -15.620   0.200   8.824
  501    HG   SER  70           HG       SER  70 -13.705  -0.827   7.866
  502    H    GLY  71           HN       GLY  71 -11.693   1.214   7.641
  503    HA2  GLY  71           HA2      GLY  71  -9.616   1.858   8.406
  504    HA3  GLY  71           HA1      GLY  71 -10.403   3.044   9.441
  505    H    ASN  72           HN       ASN  72 -11.682  -0.086   9.715
  506    HA   ASN  72           HA       ASN  72 -10.985  -0.135  12.499
  507    HB2  ASN  72           HB2      ASN  72 -13.194  -0.853  11.568
  508    HB3  ASN  72           HB1      ASN  72 -12.394  -2.243  10.846
  509   HD21  ASN  72          HD21      ASN  72 -13.667  -3.670  12.004
  510   HD22  ASN  72          HD22      ASN  72 -13.442  -3.945  13.696
  511    H    SER  73           HN       SER  73  -9.345  -1.064   9.804
  512    HA   SER  73           HA       SER  73  -8.204  -3.514  10.875
  513    HB2  SER  73           HB2      SER  73  -6.974  -3.393   8.619
  514    HB3  SER  73           HB1      SER  73  -8.722  -3.645   8.581
  515    HG   SER  73           HG       SER  73  -8.424  -1.996   7.185
  516    H    SER  74           HN       SER  74  -7.607  -0.259  11.157
  517    HA   SER  74           HA       SER  74  -5.844   1.055  11.699
  518    HB2  SER  74           HB2      SER  74  -5.528  -0.575  13.525
  519    HB3  SER  74           HB1      SER  74  -4.526  -1.566  12.468
  520    HG   SER  74           HG       SER  74  -3.058   0.186  12.345
  521    H    THR  75           HN       THR  75  -6.071   0.852   9.165
  522    HA   THR  75           HA       THR  75  -4.093  -0.484   7.677
  523    HB   THR  75           HB       THR  75  -6.318   0.282   6.822
  524    HG1  THR  75           HG1      THR  75  -5.415   1.057   4.764
  525   HG21  THR  75          HG21      THR  75  -6.112   2.571   7.852
  526   HG22  THR  75          HG22      THR  75  -6.685   2.531   6.185
  527   HG23  THR  75          HG23      THR  75  -5.010   2.977   6.529
  528    H    SER  76           HN       SER  76  -3.903   2.325   9.551
  529    HA   SER  76           HA       SER  76  -2.161   3.683  10.067
  530    HB2  SER  76           HB2      SER  76  -0.557   2.180   7.985
  531    HB3  SER  76           HB1      SER  76   0.080   3.203   9.274
  532    HG   SER  76           HG       SER  76  -1.536   0.939   9.808
  533    H    ALA  77           HN       ALA  77  -2.657   3.135   6.609
  534    HA   ALA  77           HA       ALA  77  -1.922   5.807   5.838
  535    HB1  ALA  77           HB1      ALA  77  -3.663   3.807   4.400
  536    HB2  ALA  77           HB2      ALA  77  -1.906   3.920   4.248
  537    HB3  ALA  77           HB3      ALA  77  -2.928   5.260   3.699
  538    HA   PRO  78           HA       PRO  78  -5.413   7.770   7.677
  539    HB2  PRO  78           HB2      PRO  78  -4.910   9.685   5.456
  540    HB3  PRO  78           HB1      PRO  78  -5.135  10.012   7.172
  541    HG2  PRO  78           HG2      PRO  78  -2.720  10.107   6.129
  542    HG3  PRO  78           HG1      PRO  78  -2.974   9.302   7.683
  543    HD2  PRO  78           HD2      PRO  78  -2.579   8.097   4.990
  544    HD3  PRO  78           HD1      PRO  78  -1.943   7.578   6.563
  545    H    GLY  79           HN       GLY  79  -7.182   6.595   7.252
  546    HA2  GLY  79           HA2      GLY  79  -9.142   5.928   6.298
  547    HA3  GLY  79           HA1      GLY  79  -9.070   7.408   5.365
  548    H    SER  80           HN       SER  80  -6.377   5.357   4.761
  549    HA   SER  80           HA       SER  80  -7.499   4.892   2.072
  550    HB2  SER  80           HB2      SER  80  -4.954   5.691   3.072
  551    HB3  SER  80           HB1      SER  80  -4.779   4.182   2.178
  552    HG   SER  80           HG       SER  80  -5.977   6.583   1.240
  553    H    ALA  81           HN       ALA  81  -6.901   3.031   0.904
  554    HA   ALA  81           HA       ALA  81  -7.348   0.646   2.529
  555    HB1  ALA  81           HB1      ALA  81  -8.063  -0.364   0.379
  556    HB2  ALA  81           HB2      ALA  81  -7.705   1.179  -0.409
  557    HB3  ALA  81           HB3      ALA  81  -8.969   1.091   0.820
  558    H    HIS  82           HN       HIS  82  -4.691   1.696   2.459
  559    HA   HIS  82           HA       HIS  82  -3.445  -0.742   1.503
  560    HB2  HIS  82           HB2      HIS  82  -2.719   1.996   0.632
  561    HB3  HIS  82           HB1      HIS  82  -1.414   0.875   0.933
  562    HD1  HIS  82           HD1      HIS  82  -1.433  -1.323  -0.584
  563    HD2  HIS  82           HD2      HIS  82  -3.981   1.749  -1.770
  564    HE1  HIS  82           HE1      HIS  82  -2.026  -1.818  -2.979
  565    HE2  HIS  82           HE2      HIS  82  -3.697  -0.040  -3.615
  566    H    GLN  83           HN       GLN  83  -2.308  -1.660   3.022
  567    HA   GLN  83           HA       GLN  83  -0.861  -0.014   4.942
  568    HB2  GLN  83           HB2      GLN  83  -1.660  -1.171   6.842
  569    HB3  GLN  83           HB1      GLN  83  -3.094  -0.838   5.904
  570    HG2  GLN  83           HG2      GLN  83  -3.263  -3.080   5.197
  571    HG3  GLN  83           HG1      GLN  83  -1.647  -3.464   5.786
  572   HE21  GLN  83          HE21      GLN  83  -2.421  -5.149   7.059
  573   HE22  GLN  83          HE22      GLN  83  -3.302  -4.869   8.517
  574    H    ILE  84           HN       ILE  84   1.208  -0.662   4.991
  575    HA   ILE  84           HA       ILE  84   1.867  -3.039   3.507
  576    HB   ILE  84           HB       ILE  84   3.272  -0.582   4.383
  577   HG12  ILE  84          HG12      ILE  84   3.766  -1.707   1.764
  578   HG13  ILE  84          HG11      ILE  84   2.048  -1.564   2.097
  579   HG21  ILE  84          HG21      ILE  84   5.436  -1.480   3.662
  580   HG22  ILE  84          HG22      ILE  84   4.710  -3.077   3.481
  581   HG23  ILE  84          HG23      ILE  84   4.821  -2.336   5.076
  582   HD11  ILE  84          HD11      ILE  84   2.493   0.834   2.706
  583   HD12  ILE  84          HD12      ILE  84   2.737   0.423   1.009
  584   HD13  ILE  84          HD13      ILE  84   4.126   0.606   2.079
  585    H    ASP  85           HN       ASP  85   2.647  -4.854   4.286
  586    HA   ASP  85           HA       ASP  85   2.714  -5.293   7.140
  587    HB2  ASP  85           HB2      ASP  85   1.802  -7.016   5.562
  588    HB3  ASP  85           HB1      ASP  85   3.407  -7.177   4.871
  589    H    THR  86           HN       THR  86   4.459  -4.806   8.269
  590    HA   THR  86           HA       THR  86   6.985  -4.484   6.905
  591    HB   THR  86           HB       THR  86   7.697  -3.605   9.154
  592    HG1  THR  86           HG1      THR  86   5.746  -3.072  10.479
  593   HG21  THR  86          HG21      THR  86   6.403  -1.538   8.860
  594   HG22  THR  86          HG22      THR  86   5.275  -2.405   7.816
  595   HG23  THR  86          HG23      THR  86   6.953  -2.183   7.312
  596    H    THR  87           HN       THR  87   5.414  -6.832   8.794
  597    HA   THR  87           HA       THR  87   7.579  -8.127  10.003
  598    HB   THR  87           HB       THR  87   5.001  -9.318   8.963
  599    HG1  THR  87           HG1      THR  87   4.138  -8.329  10.621
  600   HG21  THR  87          HG21      THR  87   5.393 -11.086  10.606
  601   HG22  THR  87          HG22      THR  87   6.934 -10.348  11.040
  602   HG23  THR  87          HG23      THR  87   6.701 -11.016   9.424
  603    H    ASN  88           HN       ASN  88   5.916  -8.946   6.936
  604    HA   ASN  88           HA       ASN  88   8.277 -10.496   6.140
  605    HB2  ASN  88           HB2      ASN  88   5.513 -10.292   4.939
  606    HB3  ASN  88           HB1      ASN  88   6.816 -11.236   4.231
  607   HD21  ASN  88          HD21      ASN  88   5.666 -13.146   4.432
  608   HD22  ASN  88          HD22      ASN  88   5.412 -13.916   5.957
  609    H    HIS  89           HN       HIS  89   6.870  -7.489   5.728
  610    HA   HIS  89           HA       HIS  89   7.521  -5.617   4.679
  611    HB2  HIS  89           HB2      HIS  89   9.747  -7.383   3.678
  612    HB3  HIS  89           HB1      HIS  89   9.523  -5.731   3.141
  613    HD1  HIS  89           HD1      HIS  89  11.634  -7.369   5.284
  614    HD2  HIS  89           HD2      HIS  89   9.144  -4.084   5.801
  615    HE1  HIS  89           HE1      HIS  89  12.609  -6.079   7.210
  616    HE2  HIS  89           HE2      HIS  89  10.943  -4.245   7.655
  617    H    LYS  90           HN       LYS  90   5.406  -6.664   3.830
  618    HA   LYS  90           HA       LYS  90   5.523  -6.921   0.902
  619    HB2  LYS  90           HB2      LYS  90   3.781  -8.000   3.050
  620    HB3  LYS  90           HB1      LYS  90   3.078  -7.780   1.470
  621    HG2  LYS  90           HG2      LYS  90   4.810  -9.262   0.528
  622    HG3  LYS  90           HG1      LYS  90   5.471  -9.484   2.152
  623    HD2  LYS  90           HD2      LYS  90   2.721 -10.268   1.185
  624    HD3  LYS  90           HD1      LYS  90   4.041 -11.354   1.632
  625    HE2  LYS  90           HE2      LYS  90   3.941 -10.552   3.927
  626    HE3  LYS  90           HE1      LYS  90   2.668  -9.420   3.497
  627    HZ1  LYS  90           HZ1      LYS  90   1.215 -11.250   2.992
  628    HZ2  LYS  90           HZ2      LYS  90   1.822 -11.442   4.559
  629    HZ3  LYS  90           HZ3      LYS  90   2.442 -12.371   3.292
  630    H    LEU  91           HN       LEU  91   4.162  -5.675  -0.346
  631    HA   LEU  91           HA       LEU  91   2.914  -3.373   0.952
  632    HB2  LEU  91           HB2      LEU  91   4.345  -2.983  -0.991
  633    HB3  LEU  91           HB1      LEU  91   3.350  -4.010  -1.965
  634    HG   LEU  91           HG       LEU  91   2.241  -2.221  -2.651
  635   HD11  LEU  91          HD11      LEU  91   1.493  -1.782   0.236
  636   HD12  LEU  91          HD12      LEU  91   0.551  -2.622  -0.998
  637   HD13  LEU  91          HD13      LEU  91   0.813  -0.882  -1.122
  638   HD21  LEU  91          HD21      LEU  91   3.601  -0.584  -0.545
  639   HD22  LEU  91          HD22      LEU  91   2.875  -0.015  -2.048
  640   HD23  LEU  91          HD23      LEU  91   4.311  -1.031  -2.091
  641    H    ILE  92           HN       ILE  92   1.085  -3.893   1.795
  642    HA   ILE  92           HA       ILE  92  -0.801  -5.664   0.446
  643    HB   ILE  92           HB       ILE  92  -0.304  -4.774   3.252
  644   HG12  ILE  92          HG12      ILE  92  -0.802  -7.340   3.523
  645   HG13  ILE  92          HG11      ILE  92  -0.523  -7.366   1.785
  646   HG21  ILE  92          HG21      ILE  92  -2.686  -4.367   2.969
  647   HG22  ILE  92          HG22      ILE  92  -2.412  -5.754   4.023
  648   HG23  ILE  92          HG23      ILE  92  -2.912  -6.003   2.352
  649   HD11  ILE  92          HD11      ILE  92   1.398  -6.309   3.815
  650   HD12  ILE  92          HD12      ILE  92   1.668  -6.464   2.081
  651   HD13  ILE  92          HD13      ILE  92   1.464  -7.907   3.076
  652    H    SER  93           HN       SER  93  -2.853  -4.959  -0.117
  653    HA   SER  93           HA       SER  93  -3.544  -2.221   0.636
  654    HB2  SER  93           HB2      SER  93  -5.263  -2.265  -1.008
  655    HB3  SER  93           HB1      SER  93  -3.837  -2.960  -1.776
  656    HG   SER  93           HG       SER  93  -5.969  -4.432  -0.600
  657    H    THR  94           HN       THR  94  -5.122  -1.901   2.187
  658    HA   THR  94           HA       THR  94  -6.504  -4.344   2.998
  659    HB   THR  94           HB       THR  94  -5.347  -2.177   4.732
  660    HG1  THR  94           HG1      THR  94  -4.652  -4.586   4.084
  661   HG21  THR  94          HG21      THR  94  -7.684  -2.333   5.421
  662   HG22  THR  94          HG22      THR  94  -6.665  -3.148   6.608
  663   HG23  THR  94          HG23      THR  94  -7.595  -4.093   5.443
  664    H    PHE  95           HN       PHE  95  -8.441  -4.335   2.378
  665    HA   PHE  95           HA       PHE  95 -10.018  -1.862   2.450
  666    HB2  PHE  95           HB2      PHE  95  -9.818  -3.055   0.236
  667    HB3  PHE  95           HB1      PHE  95 -10.654  -4.418   0.989
  668    HD1  PHE  95           HD1      PHE  95 -13.009  -4.354   1.461
  669    HD2  PHE  95           HD2      PHE  95 -10.996  -0.932  -0.111
  670    HE1  PHE  95           HE1      PHE  95 -15.168  -3.269   1.027
  671    HE2  PHE  95           HE2      PHE  95 -13.163   0.145  -0.544
  672    HZ   PHE  95           HZ       PHE  95 -15.250  -1.022   0.032
  673    H    THR  96           HN       THR  96 -11.124  -1.859   4.407
  674    HA   THR  96           HA       THR  96 -11.993  -4.350   5.494
  675    HB   THR  96           HB       THR  96 -13.197  -2.978   7.190
  676    HG1  THR  96           HG1      THR  96 -11.818  -0.708   6.295
  677   HG21  THR  96          HG21      THR  96 -11.245  -2.442   8.364
  678   HG22  THR  96          HG22      THR  96 -10.347  -2.108   6.877
  679   HG23  THR  96          HG23      THR  96 -10.808  -3.778   7.287
  680    HA   PRO  97           HA       PRO  97 -15.815  -4.381   3.103
  681    HB2  PRO  97           HB2      PRO  97 -16.575  -6.698   4.468
  682    HB3  PRO  97           HB1      PRO  97 -15.816  -6.625   2.877
  683    HG2  PRO  97           HG2      PRO  97 -14.652  -7.312   5.491
  684    HG3  PRO  97           HG1      PRO  97 -14.133  -7.763   3.861
  685    HD2  PRO  97           HD2      PRO  97 -12.870  -5.915   5.430
  686    HD3  PRO  97           HD1      PRO  97 -12.779  -5.961   3.665
  687    H    SER  98           HN       SER  98 -18.054  -4.350   3.803
  688    HA   SER  98           HA       SER  98 -18.478  -2.590   5.918
  689    HB2  SER  98           HB2      SER  98 -19.995  -2.733   4.020
  690    HB3  SER  98           HB1      SER  98 -20.456  -4.369   4.482
  691    HG   SER  98           HG       SER  98 -21.085  -3.268   6.568
  692    H    ASN  99           HN       ASN  99 -18.189  -5.987   5.912
  693    HA   ASN  99           HA       ASN  99 -19.630  -6.484   8.348
  694    HB2  ASN  99           HB2      ASN  99 -17.759  -8.064   6.625
  695    HB3  ASN  99           HB1      ASN  99 -18.279  -8.669   8.184
  696   HD21  ASN  99          HD21      ASN  99 -18.743  -9.696   5.502
  697   HD22  ASN  99          HD22      ASN  99 -20.460  -9.790   5.314
  698    H    GLY 100           HN       GLY 100 -16.497  -5.389   7.550
  699    HA2  GLY 100           HA2      GLY 100 -14.741  -4.749   8.947
  700    HA3  GLY 100           HA1      GLY 100 -15.637  -5.411  10.312
  701    H    GLY 101           HN       GLY 101 -15.399  -7.377   7.596
  702    HA2  GLY 101           HA2      GLY 101 -13.954  -9.379   9.089
  703    HA3  GLY 101           HA1      GLY 101 -14.710  -9.587   7.518
  704    H    GLN 102           HN       GLN 102 -12.704 -10.784   7.100
  705    HA   GLN 102           HA       GLN 102 -10.169  -9.709   7.004
  706    HB2  GLN 102           HB2      GLN 102  -9.625 -11.404   5.388
  707    HB3  GLN 102           HB1      GLN 102 -10.746 -12.086   6.557
  708    HG2  GLN 102           HG2      GLN 102 -12.583 -11.654   4.949
  709    HG3  GLN 102           HG1      GLN 102 -11.369 -11.152   3.776
  710   HE21  GLN 102          HE21      GLN 102 -12.748 -13.806   5.518
  711   HE22  GLN 102          HE22      GLN 102 -12.013 -15.069   4.592
  712    H    ALA 103           HN       ALA 103  -9.078  -8.397   5.676
  713    HA   ALA 103           HA       ALA 103 -10.721  -6.711   3.945
  714    HB1  ALA 103           HB1      ALA 103  -7.918  -6.375   5.003
  715    HB2  ALA 103           HB2      ALA 103  -9.387  -5.578   5.582
  716    HB3  ALA 103           HB3      ALA 103  -8.763  -5.218   3.970
  717    H    THR 104           HN       THR 104 -10.129  -6.086   1.978
  718    HA   THR 104           HA       THR 104  -9.166  -8.227   0.343
  719    HB   THR 104           HB       THR 104 -10.762  -5.818   0.041
  720    HG1  THR 104           HG1      THR 104 -11.432  -8.093   0.105
  721   HG21  THR 104          HG21      THR 104  -8.983  -6.750  -2.193
  722   HG22  THR 104          HG22      THR 104  -9.281  -5.100  -1.631
  723   HG23  THR 104          HG23      THR 104 -10.539  -5.978  -2.501
  724    H    VAL 105           HN       VAL 105  -7.238  -8.407  -0.594
  725    HA   VAL 105           HA       VAL 105  -5.371  -6.187  -0.128
  726    HB   VAL 105           HB       VAL 105  -4.853  -9.122   0.380
  727   HG11  VAL 105          HG11      VAL 105  -2.704  -8.270   1.345
  728   HG12  VAL 105          HG12      VAL 105  -3.067  -6.713   0.600
  729   HG13  VAL 105          HG13      VAL 105  -2.840  -8.139  -0.407
  730   HG21  VAL 105          HG21      VAL 105  -6.269  -8.059   2.093
  731   HG22  VAL 105          HG22      VAL 105  -5.028  -6.825   2.325
  732   HG23  VAL 105          HG23      VAL 105  -4.679  -8.507   2.721
  733    H    LEU 106           HN       LEU 106  -4.448  -5.528  -1.884
  734    HA   LEU 106           HA       LEU 106  -3.588  -7.426  -3.949
  735    HB2  LEU 106           HB2      LEU 106  -3.940  -4.444  -3.850
  736    HB3  LEU 106           HB1      LEU 106  -2.855  -5.152  -5.029
  737    HG   LEU 106           HG       LEU 106  -4.901  -4.751  -6.123
  738   HD11  LEU 106          HD11      LEU 106  -3.871  -6.876  -6.688
  739   HD12  LEU 106          HD12      LEU 106  -5.628  -7.006  -6.776
  740   HD13  LEU 106          HD13      LEU 106  -4.764  -7.681  -5.397
  741   HD21  LEU 106          HD21      LEU 106  -6.346  -6.323  -3.975
  742   HD22  LEU 106          HD22      LEU 106  -7.073  -5.489  -5.347
  743   HD23  LEU 106          HD23      LEU 106  -6.304  -4.566  -4.059
  744    H    THR 107           HN       THR 107  -1.639  -8.291  -3.529
  745    HA   THR 107           HA       THR 107   0.093  -6.836  -1.658
  746    HB   THR 107           HB       THR 107   0.289  -9.762  -2.343
  747    HG1  THR 107           HG1      THR 107  -0.831  -9.350   0.049
  748   HG21  THR 107          HG21      THR 107   2.238  -8.731  -1.220
  749   HG22  THR 107          HG22      THR 107   1.430  -9.922  -0.199
  750   HG23  THR 107          HG23      THR 107   1.181  -8.201   0.092
  751    H    TYR 108           HN       TYR 108   2.269  -6.661  -1.932
  752    HA   TYR 108           HA       TYR 108   3.540  -7.756  -4.321
  753    HB2  TYR 108           HB2      TYR 108   3.318  -5.602  -5.146
  754    HB3  TYR 108           HB1      TYR 108   3.350  -4.880  -3.554
  755    HD1  TYR 108           HD1      TYR 108   5.296  -3.951  -2.700
  756    HD2  TYR 108           HD2      TYR 108   5.534  -6.486  -6.105
  757    HE1  TYR 108           HE1      TYR 108   7.634  -3.289  -3.010
  758    HE2  TYR 108           HE2      TYR 108   7.891  -5.852  -6.420
  759    HH   TYR 108           HH       TYR 108   9.678  -4.167  -4.064
  760    H    ASP 109           HN       ASP 109   5.723  -8.297  -3.977
  761    HA   ASP 109           HA       ASP 109   6.506  -8.239  -1.137
  762    HB2  ASP 109           HB2      ASP 109   5.970 -10.486  -2.212
  763    HB3  ASP 109           HB1      ASP 109   7.417 -10.261  -3.186
  764    H    TRP 110           HN       TRP 110   8.045  -6.776  -0.806
  765    HA   TRP 110           HA       TRP 110   9.836  -5.956  -2.902
  766    HB2  TRP 110           HB2      TRP 110   9.336  -4.165  -1.533
  767    HB3  TRP 110           HB1      TRP 110   9.365  -5.129  -0.066
  768    HD1  TRP 110           HD1      TRP 110  11.810  -3.540  -2.595
  769    HE1  TRP 110           HE1      TRP 110  14.029  -3.057  -1.373
  770    HE3  TRP 110           HE3      TRP 110  10.744  -5.704   1.887
  771    HZ2  TRP 110           HZ2      TRP 110  15.159  -3.538   1.174
  772    HZ3  TRP 110           HZ3      TRP 110  12.434  -5.655   3.673
  773    HH2  TRP 110           HH2      TRP 110  14.607  -4.591   3.325
  774    H    SER 111           HN       SER 111   9.941  -8.069  -0.154
  775    HA   SER 111           HA       SER 111  12.707  -8.370   0.140
  776    HB2  SER 111           HB2      SER 111  11.065  -9.143   1.788
  777    HB3  SER 111           HB1      SER 111  10.503 -10.366   0.663
  778    HG   SER 111           HG       SER 111  13.223 -10.274   1.392
  779    H    ALA 112           HN       ALA 112  10.422  -9.823  -2.070
  780    HA   ALA 112           HA       ALA 112  12.199 -11.773  -3.136
  781    HB1  ALA 112           HB1      ALA 112   9.764 -12.002  -3.273
  782    HB2  ALA 112           HB2      ALA 112  10.518 -12.094  -4.865
  783    HB3  ALA 112           HB3      ALA 112   9.706 -10.613  -4.358
  784    H    ASN 113           HN       ASN 113  12.298  -8.550  -3.329
  785    HA   ASN 113           HA       ASN 113  13.686  -8.578  -5.927
  786    HB2  ASN 113           HB2      ASN 113  12.132  -6.363  -4.586
  787    HB3  ASN 113           HB1      ASN 113  13.264  -6.055  -5.898
  788   HD21  ASN 113          HD21      ASN 113  10.206  -7.464  -5.016
  789   HD22  ASN 113          HD22      ASN 113   9.616  -7.670  -6.626
  790    H    GLY 114           HN       GLY 114  13.719  -7.460  -2.602
  791    HA2  GLY 114           HA2      GLY 114  16.465  -6.552  -2.840
  792    HA3  GLY 114           HA1      GLY 114  15.487  -6.548  -1.377
  793    H    VAL 115           HN       VAL 115  15.959  -8.038   0.117
  794    HA   VAL 115           HA       VAL 115  17.089 -10.595  -0.783
  795    HB   VAL 115           HB       VAL 115  18.007  -9.157   1.718
  796   HG11  VAL 115          HG11      VAL 115  19.587 -10.920   1.965
  797   HG12  VAL 115          HG12      VAL 115  19.198 -11.574   0.375
  798   HG13  VAL 115          HG13      VAL 115  18.013 -11.679   1.681
  799   HG21  VAL 115          HG21      VAL 115  19.469  -9.506  -0.899
  800   HG22  VAL 115          HG22      VAL 115  20.136  -8.801   0.573
  801   HG23  VAL 115          HG23      VAL 115  18.819  -7.991  -0.275
  802    H    ASN 116           HN       ASN 116  16.622 -12.370   0.637
  803    HA   ASN 116           HA       ASN 116  14.260 -11.887   2.321
  804    HB2  ASN 116           HB2      ASN 116  14.002 -13.325   0.276
  805    HB3  ASN 116           HB1      ASN 116  15.126 -14.460   1.012
  806   HD21  ASN 116          HD21      ASN 116  11.950 -13.031   1.214
  807   HD22  ASN 116          HD22      ASN 116  11.262 -14.224   2.263
  808    H    SER 117           HN       SER 117  16.279 -11.271   3.749
  809    HA   SER 117           HA       SER 117  17.471 -11.673   5.636
  810    HB2  SER 117           HB2      SER 117  15.625 -14.067   5.839
  811    HB3  SER 117           HB1      SER 117  16.587 -13.397   7.158
  812    HG   SER 117           HG       SER 117  15.354 -11.571   7.139
  813    H    ASN 118           HN       ASN 118  18.762 -12.497   3.361
  814    HA   ASN 118           HA       ASN 118  19.864 -15.146   3.970
  815    HB2  ASN 118           HB2      ASN 118  20.193 -13.468   1.473
  816    HB3  ASN 118           HB1      ASN 118  20.810 -15.098   1.706
  817   HD21  ASN 118          HD21      ASN 118  19.326 -16.829   1.825
  818   HD22  ASN 118          HD22      ASN 118  17.739 -16.686   1.160
  Start of MODEL    7
    1    H1   HIS   6           HT1      HIS   6 -19.308  -8.850  -5.339
    2    H2   HIS   6           HT2      HIS   6 -20.891  -8.660  -5.892
    3    H3   HIS   6           HT3      HIS   6 -20.202  -7.494  -4.885
    4    HA   HIS   6           HA       HIS   6 -19.281  -8.155  -7.617
    5    HB2  HIS   6           HB2      HIS   6 -20.909  -5.833  -6.572
    6    HB3  HIS   6           HB1      HIS   6 -20.073  -5.797  -8.119
    7    HD1  HIS   6           HD1      HIS   6 -20.935  -7.540  -9.940
    8    HD2  HIS   6           HD2      HIS   6 -23.359  -7.037  -6.600
    9    HE1  HIS   6           HE1      HIS   6 -23.168  -8.521 -10.563
   10    HE2  HIS   6           HE2      HIS   6 -24.652  -8.085  -8.576
   11    H    GLN   7           HN       GLN   7 -19.069  -5.890  -4.876
   12    HA   GLN   7           HA       GLN   7 -16.974  -4.366  -5.913
   13    HB2  GLN   7           HB2      GLN   7 -18.243  -3.467  -4.120
   14    HB3  GLN   7           HB1      GLN   7 -17.855  -4.841  -3.100
   15    HG2  GLN   7           HG2      GLN   7 -15.570  -4.177  -2.920
   16    HG3  GLN   7           HG1      GLN   7 -15.818  -2.863  -4.079
   17   HE21  GLN   7          HE21      GLN   7 -16.945  -1.010  -3.413
   18   HE22  GLN   7          HE22      GLN   7 -17.208  -0.657  -1.741
   19    H    ASP   8           HN       ASP   8 -16.907  -7.442  -4.255
   20    HA   ASP   8           HA       ASP   8 -14.291  -7.392  -3.334
   21    HB2  ASP   8           HB2      ASP   8 -15.741  -9.203  -2.724
   22    HB3  ASP   8           HB1      ASP   8 -15.909  -9.703  -4.401
   23    H    ASN   9           HN       ASN   9 -15.554  -8.075  -6.532
   24    HA   ASN   9           HA       ASN   9 -13.005  -8.585  -7.729
   25    HB2  ASN   9           HB2      ASN   9 -15.299  -9.322  -8.592
   26    HB3  ASN   9           HB1      ASN   9 -15.463  -7.667  -9.152
   27   HD21  ASN   9          HD21      ASN   9 -13.777 -10.668  -9.575
   28   HD22  ASN   9          HD22      ASN   9 -13.069 -10.286 -11.104
   29    H    ALA  10           HN       ALA  10 -15.115  -5.831  -7.304
   30    HA   ALA  10           HA       ALA  10 -13.805  -4.022  -9.030
   31    HB1  ALA  10           HB1      ALA  10 -15.450  -3.516  -6.559
   32    HB2  ALA  10           HB2      ALA  10 -16.004  -3.503  -8.240
   33    HB3  ALA  10           HB3      ALA  10 -14.876  -2.259  -7.664
   34    H    ARG  11           HN       ARG  11 -13.634  -4.398  -5.509
   35    HA   ARG  11           HA       ARG  11 -11.723  -2.579  -4.821
   36    HB2  ARG  11           HB2      ARG  11 -11.964  -5.424  -3.890
   37    HB3  ARG  11           HB1      ARG  11 -10.959  -4.209  -3.112
   38    HG2  ARG  11           HG2      ARG  11 -12.797  -3.042  -2.317
   39    HG3  ARG  11           HG1      ARG  11 -13.899  -3.822  -3.459
   40    HD2  ARG  11           HD2      ARG  11 -13.406  -5.989  -2.327
   41    HD3  ARG  11           HD1      ARG  11 -12.501  -5.093  -1.113
   42    HE   ARG  11           HE       ARG  11 -15.023  -3.954  -1.209
   43   HH11  ARG  11          HH11      ARG  11 -13.599  -7.045  -0.352
   44   HH12  ARG  11          HH12      ARG  11 -14.892  -7.473   0.726
   45   HH21  ARG  11          HH21      ARG  11 -16.702  -4.511   0.207
   46   HH22  ARG  11          HH22      ARG  11 -16.659  -6.032   1.046
   47    H    LYS  12           HN       LYS  12 -11.154  -5.932  -5.773
   48    HA   LYS  12           HA       LYS  12  -8.447  -5.968  -5.920
   49    HB2  LYS  12           HB2      LYS  12  -9.518  -7.991  -6.436
   50    HB3  LYS  12           HB1      LYS  12 -10.473  -7.261  -7.718
   51    HG2  LYS  12           HG2      LYS  12  -8.724  -7.245  -9.206
   52    HG3  LYS  12           HG1      LYS  12  -7.504  -7.291  -7.942
   53    HD2  LYS  12           HD2      LYS  12  -9.338  -9.612  -8.377
   54    HD3  LYS  12           HD1      LYS  12  -7.898  -9.399  -9.377
   55    HE2  LYS  12           HE2      LYS  12  -6.597  -9.191  -7.214
   56    HE3  LYS  12           HE1      LYS  12  -8.056  -9.757  -6.393
   57    HZ1  LYS  12           HZ1      LYS  12  -6.507 -11.224  -8.456
   58    HZ2  LYS  12           HZ2      LYS  12  -7.974 -11.757  -7.804
   59    HZ3  LYS  12           HZ3      LYS  12  -6.615 -11.604  -6.810
   60    H    SER  13           HN       SER  13 -10.611  -4.782  -8.495
   61    HA   SER  13           HA       SER  13  -8.383  -4.140 -10.208
   62    HB2  SER  13           HB2      SER  13 -10.536  -4.794 -11.161
   63    HB3  SER  13           HB1      SER  13 -11.319  -3.405 -10.405
   64    HG   SER  13           HG       SER  13  -9.156  -2.677 -11.891
   65    H    ARG  14           HN       ARG  14 -10.589  -2.329  -8.152
   66    HA   ARG  14           HA       ARG  14  -9.776   0.237  -9.037
   67    HB2  ARG  14           HB2      ARG  14 -11.181   1.086  -7.259
   68    HB3  ARG  14           HB1      ARG  14 -12.000  -0.279  -8.018
   69    HG2  ARG  14           HG2      ARG  14 -12.209  -1.223  -6.039
   70    HG3  ARG  14           HG1      ARG  14 -10.450  -1.320  -5.924
   71    HD2  ARG  14           HD2      ARG  14 -12.320   0.692  -4.784
   72    HD3  ARG  14           HD1      ARG  14 -10.968  -0.148  -4.026
   73    HE   ARG  14           HE       ARG  14  -9.487   1.315  -5.355
   74   HH11  ARG  14          HH11      ARG  14 -12.802   2.321  -4.837
   75   HH12  ARG  14          HH12      ARG  14 -12.457   4.005  -5.056
   76   HH21  ARG  14          HH21      ARG  14  -9.022   3.539  -5.643
   77   HH22  ARG  14          HH22      ARG  14 -10.319   4.697  -5.510
   78    H    ILE  15           HN       ILE  15  -8.701  -1.894  -6.464
   79    HA   ILE  15           HA       ILE  15  -6.970   0.080  -5.279
   80    HB   ILE  15           HB       ILE  15  -7.059  -2.918  -4.961
   81   HG12  ILE  15          HG12      ILE  15  -8.158  -0.787  -3.104
   82   HG13  ILE  15          HG11      ILE  15  -9.145  -1.676  -4.262
   83   HG21  ILE  15          HG21      ILE  15  -5.766  -0.825  -3.216
   84   HG22  ILE  15          HG22      ILE  15  -4.906  -1.852  -4.367
   85   HG23  ILE  15          HG23      ILE  15  -5.727  -2.576  -2.977
   86   HD11  ILE  15          HD11      ILE  15  -8.422  -3.780  -3.152
   87   HD12  ILE  15          HD12      ILE  15  -9.396  -2.704  -2.139
   88   HD13  ILE  15          HD13      ILE  15  -7.648  -2.785  -1.906
   89    H    GLN  16           HN       GLN  16  -6.732  -2.779  -7.328
   90    HA   GLN  16           HA       GLN  16  -4.054  -3.202  -7.546
   91    HB2  GLN  16           HB2      GLN  16  -6.372  -3.943  -8.907
   92    HB3  GLN  16           HB1      GLN  16  -5.260  -3.374 -10.139
   93    HG2  GLN  16           HG2      GLN  16  -3.547  -4.929  -9.086
   94    HG3  GLN  16           HG1      GLN  16  -4.903  -5.620  -8.189
   95   HE21  GLN  16          HE21      GLN  16  -6.550  -6.675  -9.336
   96   HE22  GLN  16          HE22      GLN  16  -6.283  -7.312 -10.919
   97    H    SER  17           HN       SER  17  -5.979  -0.841  -9.329
   98    HA   SER  17           HA       SER  17  -4.020   0.028 -11.089
   99    HB2  SER  17           HB2      SER  17  -5.417   2.200 -11.057
  100    HB3  SER  17           HB1      SER  17  -6.197   0.713 -11.594
  101    HG   SER  17           HG       SER  17  -7.542   0.924 -10.013
  102    H    GLU  18           HN       GLU  18  -4.729   1.059  -7.807
  103    HA   GLU  18           HA       GLU  18  -2.560   2.974  -7.812
  104    HB2  GLU  18           HB2      GLU  18  -4.042   1.985  -5.408
  105    HB3  GLU  18           HB1      GLU  18  -3.223   3.513  -5.638
  106    HG2  GLU  18           HG2      GLU  18  -4.948   4.445  -6.712
  107    HG3  GLU  18           HG1      GLU  18  -5.437   2.921  -7.469
  108    H    HIS  19           HN       HIS  19  -3.220  -0.254  -6.605
  109    HA   HIS  19           HA       HIS  19  -1.278  -0.602  -4.705
  110    HB2  HIS  19           HB2      HIS  19  -2.714  -2.408  -4.912
  111    HB3  HIS  19           HB1      HIS  19  -2.577  -2.475  -6.659
  112    HD1  HIS  19           HD1      HIS  19  -0.184  -3.049  -3.728
  113    HD2  HIS  19           HD2      HIS  19  -1.237  -4.652  -7.406
  114    HE1  HIS  19           HE1      HIS  19   1.287  -5.057  -4.028
  115    HE2  HIS  19           HE2      HIS  19   0.797  -5.864  -6.363
  116    H    ARG  20           HN       ARG  20  -0.854  -1.242  -8.185
  117    HA   ARG  20           HA       ARG  20   1.855  -1.920  -8.085
  118    HB2  ARG  20           HB2      ARG  20   0.520  -0.451 -10.346
  119    HB3  ARG  20           HB1      ARG  20   1.879  -1.564 -10.441
  120    HG2  ARG  20           HG2      ARG  20   0.293  -3.335  -9.556
  121    HG3  ARG  20           HG1      ARG  20  -1.004  -2.183  -9.890
  122    HD2  ARG  20           HD2      ARG  20  -0.192  -2.050 -12.228
  123    HD3  ARG  20           HD1      ARG  20   0.960  -3.330 -11.852
  124    HE   ARG  20           HE       ARG  20  -1.405  -4.407 -11.114
  125   HH11  ARG  20          HH11      ARG  20  -0.271  -2.900 -14.056
  126   HH12  ARG  20          HH12      ARG  20  -1.359  -3.778 -15.080
  127   HH21  ARG  20          HH21      ARG  20  -2.850  -5.567 -12.452
  128   HH22  ARG  20          HH22      ARG  20  -2.815  -5.311 -14.169
  129    H    GLU  21           HN       GLU  21   0.283   1.163  -8.071
  130    HA   GLU  21           HA       GLU  21   2.545   2.791  -8.688
  131    HB2  GLU  21           HB2      GLU  21   0.136   3.693  -7.127
  132    HB3  GLU  21           HB1      GLU  21   1.096   4.608  -8.276
  133    HG2  GLU  21           HG2      GLU  21  -0.546   2.250  -9.096
  134    HG3  GLU  21           HG1      GLU  21  -1.246   3.860  -8.994
  135    H    LEU  22           HN       LEU  22   0.813   1.973  -5.710
  136    HA   LEU  22           HA       LEU  22   2.434   3.410  -3.945
  137    HB2  LEU  22           HB2      LEU  22   0.637   1.049  -3.550
  138    HB3  LEU  22           HB1      LEU  22   1.624   1.646  -2.232
  139    HG   LEU  22           HG       LEU  22  -0.459   2.668  -1.894
  140   HD11  LEU  22          HD11      LEU  22   1.531   4.223  -1.914
  141   HD12  LEU  22          HD12      LEU  22  -0.032   4.995  -2.150
  142   HD13  LEU  22          HD13      LEU  22   1.031   4.731  -3.530
  143   HD21  LEU  22          HD21      LEU  22  -0.509   3.398  -4.818
  144   HD22  LEU  22          HD22      LEU  22  -1.754   3.746  -3.619
  145   HD23  LEU  22          HD23      LEU  22  -1.413   2.078  -4.075
  146    H    VAL  23           HN       VAL  23   2.855   0.134  -5.243
  147    HA   VAL  23           HA       VAL  23   5.133  -0.304  -3.561
  148    HB   VAL  23           HB       VAL  23   4.805  -2.407  -4.055
  149   HG11  VAL  23          HG11      VAL  23   2.973  -1.739  -6.330
  150   HG12  VAL  23          HG12      VAL  23   2.471  -1.660  -4.645
  151   HG13  VAL  23          HG13      VAL  23   2.992  -3.198  -5.340
  152   HG21  VAL  23          HG21      VAL  23   6.552  -2.183  -5.661
  153   HG22  VAL  23          HG22      VAL  23   5.392  -1.644  -6.887
  154   HG23  VAL  23          HG23      VAL  23   5.328  -3.301  -6.278
  155    H    SER  24           HN       SER  24   4.571   0.766  -6.872
  156    HA   SER  24           HA       SER  24   7.216   1.081  -7.694
  157    HB2  SER  24           HB2      SER  24   5.275   1.574  -9.148
  158    HB3  SER  24           HB1      SER  24   4.879   2.968  -8.139
  159    HG   SER  24           HG       SER  24   6.782   3.947  -8.783
  160    H    ALA  25           HN       ALA  25   5.263   2.779  -5.394
  161    HA   ALA  25           HA       ALA  25   7.169   4.920  -4.968
  162    HB1  ALA  25           HB1      ALA  25   4.898   4.180  -3.149
  163    HB2  ALA  25           HB2      ALA  25   4.637   5.095  -4.645
  164    HB3  ALA  25           HB3      ALA  25   5.670   5.758  -3.354
  165    H    ILE  26           HN       ILE  26   6.290   1.837  -3.413
  166    HA   ILE  26           HA       ILE  26   7.873   2.051  -1.151
  167    HB   ILE  26           HB       ILE  26   6.904  -0.265  -2.768
  168   HG12  ILE  26          HG12      ILE  26   6.745   0.587   0.103
  169   HG13  ILE  26          HG11      ILE  26   5.441   0.527  -1.074
  170   HG21  ILE  26          HG21      ILE  26   9.245  -0.860  -2.314
  171   HG22  ILE  26          HG22      ILE  26   8.106  -1.894  -1.448
  172   HG23  ILE  26          HG23      ILE  26   8.953  -0.606  -0.591
  173   HD11  ILE  26          HD11      ILE  26   5.365  -1.834  -1.012
  174   HD12  ILE  26          HD12      ILE  26   5.478  -1.283   0.677
  175   HD13  ILE  26          HD13      ILE  26   6.906  -1.914  -0.141
  176    H    GLN  27           HN       GLN  27   8.692   0.762  -4.341
  177    HA   GLN  27           HA       GLN  27  11.377   0.212  -3.819
  178    HB2  GLN  27           HB2      GLN  27  10.060   0.920  -6.443
  179    HB3  GLN  27           HB1      GLN  27  11.626   0.129  -6.263
  180    HG2  GLN  27           HG2      GLN  27  10.446  -1.712  -5.053
  181    HG3  GLN  27           HG1      GLN  27   8.934  -0.931  -5.478
  182   HE21  GLN  27          HE21      GLN  27  11.660  -2.713  -6.637
  183   HE22  GLN  27          HE22      GLN  27  11.016  -3.089  -8.197
  184    H    SER  28           HN       SER  28   9.763   3.145  -4.825
  185    HA   SER  28           HA       SER  28  12.092   4.678  -5.351
  186    HB2  SER  28           HB2      SER  28   9.233   5.402  -4.714
  187    HB3  SER  28           HB1      SER  28  10.448   6.585  -5.167
  188    HG   SER  28           HG       SER  28   9.190   4.622  -6.703
  189    H    TYR  29           HN       TYR  29   9.855   4.566  -2.585
  190    HA   TYR  29           HA       TYR  29  11.111   6.293  -0.817
  191    HB2  TYR  29           HB2      TYR  29   8.876   5.274  -0.532
  192    HB3  TYR  29           HB1      TYR  29   9.620   3.712  -0.255
  193    HD1  TYR  29           HD1      TYR  29   7.666   4.586   1.569
  194    HD2  TYR  29           HD2      TYR  29  11.807   5.583   1.553
  195    HE1  TYR  29           HE1      TYR  29   7.575   4.948   3.999
  196    HE2  TYR  29           HE2      TYR  29  11.714   5.948   3.980
  197    HH   TYR  29           HH       TYR  29   9.093   4.970   5.913
  198    H    ILE  30           HN       ILE  30  11.449   2.777  -1.065
  199    HA   ILE  30           HA       ILE  30  13.358   2.496   0.956
  200    HB   ILE  30           HB       ILE  30  12.630   0.742  -1.370
  201   HG12  ILE  30          HG12      ILE  30  11.858   0.806   1.552
  202   HG13  ILE  30          HG11      ILE  30  10.833   1.187   0.180
  203   HG21  ILE  30          HG21      ILE  30  14.447   0.182   0.958
  204   HG22  ILE  30          HG22      ILE  30  14.819   0.072  -0.761
  205   HG23  ILE  30          HG23      ILE  30  13.706  -1.083  -0.022
  206   HD11  ILE  30          HD11      ILE  30  11.941  -1.508   0.890
  207   HD12  ILE  30          HD12      ILE  30  11.001  -1.141  -0.557
  208   HD13  ILE  30          HD13      ILE  30  10.269  -0.965   1.038
  209    H    GLY  31           HN       GLY  31  13.741   2.976  -2.524
  210    HA2  GLY  31           HA2      GLY  31  16.549   2.499  -2.550
  211    HA3  GLY  31           HA1      GLY  31  15.630   3.339  -3.794
  212    H    ALA  32           HN       ALA  32  14.606   5.114  -1.542
  213    HA   ALA  32           HA       ALA  32  16.721   7.102  -1.757
  214    HB1  ALA  32           HB1      ALA  32  14.315   7.612  -2.234
  215    HB2  ALA  32           HB2      ALA  32  15.077   8.674  -1.048
  216    HB3  ALA  32           HB3      ALA  32  14.000   7.382  -0.511
  217    H    GLN  33           HN       GLN  33  15.345   4.927   0.515
  218    HA   GLN  33           HA       GLN  33  15.633   6.241   2.898
  219    HB2  GLN  33           HB2      GLN  33  15.643   3.381   2.116
  220    HB3  GLN  33           HB1      GLN  33  15.937   3.844   3.789
  221    HG2  GLN  33           HG2      GLN  33  13.657   5.093   2.425
  222    HG3  GLN  33           HG1      GLN  33  13.521   3.400   2.836
  223   HE21  GLN  33          HE21      GLN  33  13.829   6.631   4.046
  224   HE22  GLN  33          HE22      GLN  33  13.442   6.278   5.691
  225    H    ASP  34           HN       ASP  34  17.074   5.909   4.635
  226    HA   ASP  34           HA       ASP  34  19.794   6.306   4.061
  227    HB2  ASP  34           HB2      ASP  34  18.349   6.878   6.179
  228    HB3  ASP  34           HB1      ASP  34  18.873   5.285   6.714
  229    H    ASP  35           HN       ASP  35  17.878   3.553   4.811
  230    HA   ASP  35           HA       ASP  35  20.033   1.844   3.811
  231    HB2  ASP  35           HB2      ASP  35  18.332   0.954   6.146
  232    HB3  ASP  35           HB1      ASP  35  19.648   0.079   5.396
  233    HA   PRO  36           HA       PRO  36  16.329   0.664   1.509
  234    HB2  PRO  36           HB2      PRO  36  17.590  -0.349  -0.576
  235    HB3  PRO  36           HB1      PRO  36  17.635   1.390  -0.290
  236    HG2  PRO  36           HG2      PRO  36  19.670  -0.659   0.549
  237    HG3  PRO  36           HG1      PRO  36  19.940   0.789  -0.437
  238    HD2  PRO  36           HD2      PRO  36  20.383   0.852   2.189
  239    HD3  PRO  36           HD1      PRO  36  19.615   2.228   1.369
  240    H    THR  37           HN       THR  37  18.594  -0.892   3.186
  241    HA   THR  37           HA       THR  37  18.210  -3.568   2.265
  242    HB   THR  37           HB       THR  37  19.894  -4.148   3.871
  243    HG1  THR  37           HG1      THR  37  20.158  -3.041   5.695
  244   HG21  THR  37          HG21      THR  37  21.663  -2.516   3.390
  245   HG22  THR  37          HG22      THR  37  20.446  -1.349   2.862
  246   HG23  THR  37          HG23      THR  37  20.703  -2.836   1.946
  247    H    ASN  38           HN       ASN  38  17.106  -1.553   4.826
  248    HA   ASN  38           HA       ASN  38  14.863  -3.238   5.343
  249    HB2  ASN  38           HB2      ASN  38  16.678  -4.275   6.662
  250    HB3  ASN  38           HB1      ASN  38  16.856  -2.775   7.561
  251   HD21  ASN  38          HD21      ASN  38  16.354  -3.815   9.502
  252   HD22  ASN  38          HD22      ASN  38  14.737  -4.283   9.898
  253    HA   PRO  39           HA       PRO  39  14.521   1.440   5.779
  254    HB2  PRO  39           HB2      PRO  39  12.178   1.449   4.307
  255    HB3  PRO  39           HB1      PRO  39  13.791   1.799   3.684
  256    HG2  PRO  39           HG2      PRO  39  12.231  -0.734   3.550
  257    HG3  PRO  39           HG1      PRO  39  13.291   0.001   2.353
  258    HD2  PRO  39           HD2      PRO  39  14.078  -2.073   3.801
  259    HD3  PRO  39           HD1      PRO  39  15.200  -0.789   3.342
  260    H    SER  40           HN       SER  40  12.543   2.678   6.438
  261    HA   SER  40           HA       SER  40  11.416   1.555   8.786
  262    HB2  SER  40           HB2      SER  40  10.498   4.040   7.321
  263    HB3  SER  40           HB1      SER  40  10.299   3.675   9.035
  264    HG   SER  40           HG       SER  40  12.836   3.500   8.713
  265    H    GLU  41           HN       GLU  41   8.904   1.949   9.106
  266    HA   GLU  41           HA       GLU  41   7.540   0.200   7.331
  267    HB2  GLU  41           HB2      GLU  41   6.730   0.095   9.513
  268    HB3  GLU  41           HB1      GLU  41   6.785   1.836   9.720
  269    HG2  GLU  41           HG2      GLU  41   4.875   2.134   8.392
  270    HG3  GLU  41           HG1      GLU  41   4.847   0.444   7.907
  271    H    ILE  42           HN       ILE  42   6.295   0.612   5.683
  272    HA   ILE  42           HA       ILE  42   6.491   3.326   4.668
  273    HB   ILE  42           HB       ILE  42   6.135   0.659   3.351
  274   HG12  ILE  42          HG12      ILE  42   8.341   2.662   3.630
  275   HG13  ILE  42          HG11      ILE  42   8.376   0.919   3.851
  276   HG21  ILE  42          HG21      ILE  42   6.214   1.910   1.224
  277   HG22  ILE  42          HG22      ILE  42   6.041   3.403   2.138
  278   HG23  ILE  42          HG23      ILE  42   4.755   2.198   2.165
  279   HD11  ILE  42          HD11      ILE  42   9.613   1.585   1.894
  280   HD12  ILE  42          HD12      ILE  42   8.170   2.359   1.235
  281   HD13  ILE  42          HD13      ILE  42   8.214   0.607   1.453
  282    H    THR  43           HN       THR  43   4.755   4.552   4.415
  283    HA   THR  43           HA       THR  43   2.142   3.245   4.169
  284    HB   THR  43           HB       THR  43   1.104   5.052   5.486
  285    HG1  THR  43           HG1      THR  43   2.565   6.344   6.785
  286   HG21  THR  43          HG21      THR  43   3.282   3.587   6.984
  287   HG22  THR  43          HG22      THR  43   1.706   2.914   6.556
  288   HG23  THR  43          HG23      THR  43   1.809   4.266   7.685
  289    H    LEU  44           HN       LEU  44   0.486   4.790   3.359
  290    HA   LEU  44           HA       LEU  44   1.323   5.714   0.847
  291    HB2  LEU  44           HB2      LEU  44  -1.164   6.468   2.310
  292    HB3  LEU  44           HB1      LEU  44  -0.912   6.484   0.593
  293    HG   LEU  44           HG       LEU  44  -1.242   4.138   2.387
  294   HD11  LEU  44          HD11      LEU  44  -3.041   5.567   1.015
  295   HD12  LEU  44          HD12      LEU  44  -3.208   3.867   1.429
  296   HD13  LEU  44          HD13      LEU  44  -2.624   4.326  -0.167
  297   HD21  LEU  44          HD21      LEU  44   0.704   3.730   0.954
  298   HD22  LEU  44          HD22      LEU  44  -0.274   4.114  -0.461
  299   HD23  LEU  44          HD23      LEU  44  -0.653   2.699   0.515
  300    H    ALA  45           HN       ALA  45   0.623   7.288   3.855
  301    HA   ALA  45           HA       ALA  45   0.768   9.948   2.985
  302    HB1  ALA  45           HB1      ALA  45  -0.303   9.284   5.064
  303    HB2  ALA  45           HB2      ALA  45   0.989  10.454   5.385
  304    HB3  ALA  45           HB3      ALA  45   1.259   8.734   5.709
  305    H    LYS  46           HN       LYS  46   3.177   7.591   3.808
  306    HA   LYS  46           HA       LYS  46   5.391   9.446   3.810
  307    HB2  LYS  46           HB2      LYS  46   5.179   6.467   3.941
  308    HB3  LYS  46           HB1      LYS  46   6.698   7.316   3.981
  309    HG2  LYS  46           HG2      LYS  46   6.086   8.390   6.044
  310    HG3  LYS  46           HG1      LYS  46   4.485   7.649   5.975
  311    HD2  LYS  46           HD2      LYS  46   5.663   5.414   5.945
  312    HD3  LYS  46           HD1      LYS  46   7.142   6.293   6.357
  313    HE2  LYS  46           HE2      LYS  46   4.578   6.312   7.927
  314    HE3  LYS  46           HE1      LYS  46   6.022   5.361   8.317
  315    HZ1  LYS  46           HZ1      LYS  46   5.893   7.413   9.618
  316    HZ2  LYS  46           HZ2      LYS  46   5.907   8.331   8.202
  317    HZ3  LYS  46           HZ3      LYS  46   7.257   7.406   8.623
  318    H    LEU  47           HN       LEU  47   3.811   7.211   1.673
  319    HA   LEU  47           HA       LEU  47   5.915   7.056  -0.232
  320    HB2  LEU  47           HB2      LEU  47   3.041   6.204  -0.189
  321    HB3  LEU  47           HB1      LEU  47   4.032   6.021  -1.626
  322    HG   LEU  47           HG       LEU  47   4.542   4.771   1.069
  323   HD11  LEU  47          HD11      LEU  47   3.681   3.572  -1.558
  324   HD12  LEU  47          HD12      LEU  47   2.697   3.732  -0.103
  325   HD13  LEU  47          HD13      LEU  47   4.102   2.665  -0.105
  326   HD21  LEU  47          HD21      LEU  47   6.095   4.597  -1.507
  327   HD22  LEU  47          HD22      LEU  47   6.352   3.566  -0.103
  328   HD23  LEU  47          HD23      LEU  47   6.639   5.300   0.015
  329    H    ALA  48           HN       ALA  48   3.725   9.436   0.491
  330    HA   ALA  48           HA       ALA  48   2.665  10.408  -1.816
  331    HB1  ALA  48           HB1      ALA  48   2.427  12.478  -0.758
  332    HB2  ALA  48           HB2      ALA  48   3.869  12.242   0.220
  333    HB3  ALA  48           HB3      ALA  48   2.422  11.287   0.545
  334    HA   PRO  49           HA       PRO  49   6.607  13.047  -2.819
  335    HB2  PRO  49           HB2      PRO  49   8.725  11.552  -1.389
  336    HB3  PRO  49           HB1      PRO  49   8.484  13.288  -1.528
  337    HG2  PRO  49           HG2      PRO  49   7.983  12.085   0.762
  338    HG3  PRO  49           HG1      PRO  49   6.857  13.320   0.153
  339    HD2  PRO  49           HD2      PRO  49   6.675  10.338  -0.070
  340    HD3  PRO  49           HD1      PRO  49   5.443  11.476   0.499
  341    H    TYR  50           HN       TYR  50   6.587   9.635  -2.469
  342    HA   TYR  50           HA       TYR  50   8.485   9.217  -4.652
  343    HB2  TYR  50           HB2      TYR  50   7.204   7.190  -2.819
  344    HB3  TYR  50           HB1      TYR  50   8.572   6.928  -3.896
  345    HD1  TYR  50           HD1      TYR  50  10.644   8.412  -3.486
  346    HD2  TYR  50           HD2      TYR  50   7.598   7.767  -0.600
  347    HE1  TYR  50           HE1      TYR  50  12.226   9.010  -1.692
  348    HE2  TYR  50           HE2      TYR  50   9.159   8.369   1.202
  349    HH   TYR  50           HH       TYR  50  12.270   9.743   0.566
  350    H    MET  51           HN       MET  51   5.348   9.850  -4.433
  351    HA   MET  51           HA       MET  51   4.498   7.856  -6.381
  352    HB2  MET  51           HB2      MET  51   2.930  10.055  -5.034
  353    HB3  MET  51           HB1      MET  51   2.265   8.895  -6.177
  354    HG2  MET  51           HG2      MET  51   3.427   8.289  -3.480
  355    HG3  MET  51           HG1      MET  51   1.723   8.256  -3.942
  356    HE1  MET  51           HE1      MET  51   1.406   7.062  -6.457
  357    HE2  MET  51           HE2      MET  51   0.615   6.022  -5.259
  358    HE3  MET  51           HE3      MET  51   1.689   5.317  -6.467
  359    H    SER  52           HN       SER  52   3.784   8.344  -8.356
  360    HA   SER  52           HA       SER  52   4.046  11.096  -9.316
  361    HB2  SER  52           HB2      SER  52   5.036   8.657 -10.826
  362    HB3  SER  52           HB1      SER  52   5.082  10.323 -11.406
  363    HG   SER  52           HG       SER  52   6.266  10.426  -9.108
  364    H    LYS  53           HN       LYS  53   2.534   8.040  -9.294
  365    HA   LYS  53           HA       LYS  53   0.412   8.400 -11.027
  366    HB2  LYS  53           HB2      LYS  53   0.838   6.334  -9.927
  367    HB3  LYS  53           HB1      LYS  53   0.845   7.088  -8.350
  368    HG2  LYS  53           HG2      LYS  53  -1.655   7.207  -9.870
  369    HG3  LYS  53           HG1      LYS  53  -1.148   5.639  -9.277
  370    HD2  LYS  53           HD2      LYS  53  -0.905   6.635  -7.009
  371    HD3  LYS  53           HD1      LYS  53  -1.603   8.134  -7.640
  372    HE2  LYS  53           HE2      LYS  53  -2.892   5.470  -7.169
  373    HE3  LYS  53           HE1      LYS  53  -3.455   7.090  -6.743
  374    HZ1  LYS  53           HZ1      LYS  53  -3.820   7.488  -9.148
  375    HZ2  LYS  53           HZ2      LYS  53  -4.799   6.271  -8.510
  376    HZ3  LYS  53           HZ3      LYS  53  -3.453   5.865  -9.448
  377    H    ASN  54           HN       ASN  54  -1.857   9.019 -10.276
  378    HA   ASN  54           HA       ASN  54  -2.345  11.515  -9.439
  379    HB2  ASN  54           HB2      ASN  54  -4.019   9.845 -10.092
  380    HB3  ASN  54           HB1      ASN  54  -3.914   9.144  -8.485
  381   HD21  ASN  54          HD21      ASN  54  -6.074   9.526  -8.063
  382   HD22  ASN  54          HD22      ASN  54  -6.685  11.112  -7.742
  383    H    ALA  55           HN       ALA  55  -0.975  12.231  -7.989
  384    HA   ALA  55           HA       ALA  55  -1.571  12.018  -5.201
  385    HB1  ALA  55           HB1      ALA  55   0.496  11.015  -4.518
  386    HB2  ALA  55           HB2      ALA  55   1.073  10.971  -6.190
  387    HB3  ALA  55           HB3      ALA  55  -0.291   9.955  -5.697
  388    H    LYS  56           HN       LYS  56   0.510  13.035  -3.979
  389    HA   LYS  56           HA       LYS  56   2.279  14.726  -5.272
  390    HB2  LYS  56           HB2      LYS  56   0.236  16.031  -5.851
  391    HB3  LYS  56           HB1      LYS  56  -0.057  16.263  -4.138
  392    HG2  LYS  56           HG2      LYS  56   0.950  18.247  -4.967
  393    HG3  LYS  56           HG1      LYS  56   2.160  17.412  -3.992
  394    HD2  LYS  56           HD2      LYS  56   2.115  16.803  -6.890
  395    HD3  LYS  56           HD1      LYS  56   2.676  18.407  -6.426
  396    HE2  LYS  56           HE2      LYS  56   4.380  17.444  -5.014
  397    HE3  LYS  56           HE1      LYS  56   3.772  15.822  -5.323
  398    HZ1  LYS  56           HZ1      LYS  56   4.954  17.644  -7.345
  399    HZ2  LYS  56           HZ2      LYS  56   4.353  16.099  -7.657
  400    HZ3  LYS  56           HZ3      LYS  56   5.709  16.291  -6.669
  401    H    ASN  57           HN       ASN  57   0.421  15.833  -2.461
  402    HA   ASN  57           HA       ASN  57   2.686  15.148  -0.741
  403    HB2  ASN  57           HB2      ASN  57   0.234  16.854  -0.247
  404    HB3  ASN  57           HB1      ASN  57   1.407  16.452   0.999
  405   HD21  ASN  57          HD21      ASN  57   3.507  17.298   0.850
  406   HD22  ASN  57          HD22      ASN  57   3.836  18.707  -0.095
  407    H    GLU  58           HN       GLU  58   1.461  14.743   1.640
  408    HA   GLU  58           HA       GLU  58   0.655  12.066   1.453
  409    HB2  GLU  58           HB2      GLU  58   1.151  12.161   3.618
  410    HB3  GLU  58           HB1      GLU  58   1.275  13.908   3.503
  411    HG2  GLU  58           HG2      GLU  58  -1.115  14.085   3.910
  412    HG3  GLU  58           HG1      GLU  58  -1.190  12.336   4.121
  413    H    ASP  59           HN       ASP  59  -1.154  15.034   1.861
  414    HA   ASP  59           HA       ASP  59  -3.729  13.852   1.825
  415    HB2  ASP  59           HB2      ASP  59  -3.472  16.063   2.706
  416    HB3  ASP  59           HB1      ASP  59  -2.744  16.629   1.213
  417    H    GLY  60           HN       GLY  60  -1.503  14.962  -0.620
  418    HA2  GLY  60           HA2      GLY  60  -3.265  14.946  -2.831
  419    HA3  GLY  60           HA1      GLY  60  -1.511  14.868  -2.909
  420    H    ILE  61           HN       ILE  61  -1.310  12.421  -1.345
  421    HA   ILE  61           HA       ILE  61  -1.867  10.627  -3.548
  422    HB   ILE  61           HB       ILE  61   0.356  10.474  -2.739
  423   HG12  ILE  61          HG12      ILE  61   0.556   8.181  -2.157
  424   HG13  ILE  61          HG11      ILE  61  -1.080   8.140  -1.494
  425   HG21  ILE  61          HG21      ILE  61  -0.781  10.071   0.015
  426   HG22  ILE  61          HG22      ILE  61   0.120  11.472  -0.560
  427   HG23  ILE  61          HG23      ILE  61   0.920   9.907  -0.415
  428   HD11  ILE  61          HD11      ILE  61  -0.813   7.067  -3.748
  429   HD12  ILE  61          HD12      ILE  61  -0.446   8.658  -4.402
  430   HD13  ILE  61          HD13      ILE  61  -2.035   8.342  -3.685
  431    H    VAL  62           HN       VAL  62  -2.363  10.655  -0.080
  432    HA   VAL  62           HA       VAL  62  -3.584   8.131  -0.014
  433    HB   VAL  62           HB       VAL  62  -3.648  10.370   2.002
  434   HG11  VAL  62          HG11      VAL  62  -5.455   8.753   2.386
  435   HG12  VAL  62          HG12      VAL  62  -4.203   8.682   3.636
  436   HG13  VAL  62          HG13      VAL  62  -4.257   7.448   2.378
  437   HG21  VAL  62          HG21      VAL  62  -1.623   8.640   1.069
  438   HG22  VAL  62          HG22      VAL  62  -2.064   8.144   2.715
  439   HG23  VAL  62          HG23      VAL  62  -1.550   9.810   2.399
  440    H    ASN  63           HN       ASN  63  -4.981  11.378   0.063
  441    HA   ASN  63           HA       ASN  63  -7.664  10.489   0.231
  442    HB2  ASN  63           HB2      ASN  63  -6.909  12.786   0.792
  443    HB3  ASN  63           HB1      ASN  63  -6.642  13.093  -0.919
  444   HD21  ASN  63          HD21      ASN  63  -9.005  12.663   1.582
  445   HD22  ASN  63          HD22      ASN  63 -10.366  13.208   0.667
  446    H    SER  64           HN       SER  64  -5.414  10.666  -2.326
  447    HA   SER  64           HA       SER  64  -7.304  10.588  -4.495
  448    HB2  SER  64           HB2      SER  64  -4.327  10.341  -4.233
  449    HB3  SER  64           HB1      SER  64  -5.105   9.957  -5.761
  450    HG   SER  64           HG       SER  64  -4.427  12.325  -4.838
  451    H    LEU  65           HN       LEU  65  -5.754   8.345  -2.435
  452    HA   LEU  65           HA       LEU  65  -6.056   6.091  -4.229
  453    HB2  LEU  65           HB2      LEU  65  -4.990   6.304  -1.426
  454    HB3  LEU  65           HB1      LEU  65  -5.038   4.822  -2.364
  455    HG   LEU  65           HG       LEU  65  -3.513   7.285  -3.146
  456   HD11  LEU  65          HD11      LEU  65  -1.561   6.098  -2.416
  457   HD12  LEU  65          HD12      LEU  65  -2.524   4.688  -2.000
  458   HD13  LEU  65          HD13      LEU  65  -2.699   6.181  -1.078
  459   HD21  LEU  65          HD21      LEU  65  -3.619   4.490  -4.218
  460   HD22  LEU  65          HD22      LEU  65  -2.439   5.705  -4.710
  461   HD23  LEU  65          HD23      LEU  65  -4.154   5.955  -5.039
  462    H    ALA  66           HN       ALA  66  -7.046   4.106  -3.530
  463    HA   ALA  66           HA       ALA  66  -9.694   4.265  -2.830
  464    HB1  ALA  66           HB1      ALA  66  -9.686   1.908  -2.586
  465    HB2  ALA  66           HB2      ALA  66  -7.979   1.897  -2.130
  466    HB3  ALA  66           HB3      ALA  66  -8.442   2.268  -3.797
  467    H    LYS  67           HN       LYS  67 -10.886   3.999  -1.013
  468    HA   LYS  67           HA       LYS  67  -9.408   4.353   1.494
  469    HB2  LYS  67           HB2      LYS  67 -12.080   5.475   0.678
  470    HB3  LYS  67           HB1      LYS  67 -11.435   5.571   2.303
  471    HG2  LYS  67           HG2      LYS  67 -10.481   6.951  -0.177
  472    HG3  LYS  67           HG1      LYS  67 -10.934   7.648   1.380
  473    HD2  LYS  67           HD2      LYS  67  -8.939   6.305   2.307
  474    HD3  LYS  67           HD1      LYS  67  -8.440   6.173   0.616
  475    HE2  LYS  67           HE2      LYS  67  -7.310   8.033   1.705
  476    HE3  LYS  67           HE1      LYS  67  -8.407   8.618   0.451
  477    HZ1  LYS  67           HZ1      LYS  67 -10.032   9.124   2.198
  478    HZ2  LYS  67           HZ2      LYS  67  -8.588   9.971   2.417
  479    HZ3  LYS  67           HZ3      LYS  67  -8.926   8.623   3.376
  480    H    ASP  68           HN       ASP  68  -9.932   3.158   3.220
  481    HA   ASP  68           HA       ASP  68 -11.555   0.801   2.710
  482    HB2  ASP  68           HB2      ASP  68 -10.434  -0.214   4.482
  483    HB3  ASP  68           HB1      ASP  68  -9.213   0.898   3.885
  484    H    LYS  69           HN       LYS  69 -13.303   0.173   4.121
  485    HA   LYS  69           HA       LYS  69 -14.915   2.543   4.438
  486    HB2  LYS  69           HB2      LYS  69 -15.594   0.483   3.140
  487    HB3  LYS  69           HB1      LYS  69 -15.843  -0.281   4.696
  488    HG2  LYS  69           HG2      LYS  69 -17.937   0.544   3.815
  489    HG3  LYS  69           HG1      LYS  69 -17.495   1.417   5.284
  490    HD2  LYS  69           HD2      LYS  69 -18.357   2.931   3.561
  491    HD3  LYS  69           HD1      LYS  69 -16.673   3.283   3.940
  492    HE2  LYS  69           HE2      LYS  69 -16.007   1.950   1.952
  493    HE3  LYS  69           HE1      LYS  69 -17.714   1.757   1.555
  494    HZ1  LYS  69           HZ1      LYS  69 -17.918   4.104   1.256
  495    HZ2  LYS  69           HZ2      LYS  69 -16.598   3.575   0.340
  496    HZ3  LYS  69           HZ3      LYS  69 -16.342   4.375   1.806
  497    H    SER  70           HN       SER  70 -13.996  -0.207   6.507
  498    HA   SER  70           HA       SER  70 -15.650   0.916   8.623
  499    HB2  SER  70           HB2      SER  70 -14.904  -1.231   9.831
  500    HB3  SER  70           HB1      SER  70 -15.981  -1.390   8.442
  501    HG   SER  70           HG       SER  70 -14.512  -2.575   7.562
  502    H    GLY  71           HN       GLY  71 -12.248   0.529   7.873
  503    HA2  GLY  71           HA2      GLY  71 -10.414   1.445   8.938
  504    HA3  GLY  71           HA1      GLY  71 -11.507   2.215  10.075
  505    H    ASN  72           HN       ASN  72 -11.896  -1.144   9.630
  506    HA   ASN  72           HA       ASN  72 -11.467  -1.572  12.429
  507    HB2  ASN  72           HB2      ASN  72 -13.320  -2.641  11.229
  508    HB3  ASN  72           HB1      ASN  72 -12.174  -3.518  10.221
  509   HD21  ASN  72          HD21      ASN  72 -12.777  -5.545  10.820
  510   HD22  ASN  72          HD22      ASN  72 -12.558  -6.178  12.413
  511    H    SER  73           HN       SER  73  -9.500  -1.960   9.616
  512    HA   SER  73           HA       SER  73  -7.986  -4.130  10.846
  513    HB2  SER  73           HB2      SER  73  -8.746  -4.245   8.447
  514    HB3  SER  73           HB1      SER  73  -7.587  -2.965   8.092
  515    HG   SER  73           HG       SER  73  -5.925  -4.324   8.718
  516    H    SER  74           HN       SER  74  -7.864  -0.834  10.854
  517    HA   SER  74           HA       SER  74  -6.309   0.730  11.367
  518    HB2  SER  74           HB2      SER  74  -4.667  -1.628  12.314
  519    HB3  SER  74           HB1      SER  74  -4.470   0.053  12.806
  520    HG   SER  74           HG       SER  74  -6.929  -0.396  13.348
  521    H    THR  75           HN       THR  75  -6.301   0.599   8.894
  522    HA   THR  75           HA       THR  75  -4.219  -0.652   7.479
  523    HB   THR  75           HB       THR  75  -6.425   0.075   6.548
  524    HG1  THR  75           HG1      THR  75  -5.182   1.182   4.618
  525   HG21  THR  75          HG21      THR  75  -5.165   2.799   6.300
  526   HG22  THR  75          HG22      THR  75  -6.274   2.373   7.611
  527   HG23  THR  75          HG23      THR  75  -6.828   2.322   5.937
  528    H    SER  76           HN       SER  76  -4.069   2.047   9.467
  529    HA   SER  76           HA       SER  76  -2.378   3.456  10.004
  530    HB2  SER  76           HB2      SER  76  -0.884   1.516   9.468
  531    HB3  SER  76           HB1      SER  76  -0.753   2.129   7.822
  532    HG   SER  76           HG       SER  76   0.672   2.830   9.932
  533    H    ALA  77           HN       ALA  77  -2.596   3.026   6.464
  534    HA   ALA  77           HA       ALA  77  -2.012   5.732   5.817
  535    HB1  ALA  77           HB1      ALA  77  -3.724   3.781   4.274
  536    HB2  ALA  77           HB2      ALA  77  -1.965   3.896   4.150
  537    HB3  ALA  77           HB3      ALA  77  -2.980   5.261   3.640
  538    HA   PRO  78           HA       PRO  78  -5.559   7.688   7.556
  539    HB2  PRO  78           HB2      PRO  78  -5.037   9.534   5.277
  540    HB3  PRO  78           HB1      PRO  78  -5.333   9.924   6.970
  541    HG2  PRO  78           HG2      PRO  78  -2.882  10.033   6.026
  542    HG3  PRO  78           HG1      PRO  78  -3.179   9.256   7.587
  543    HD2  PRO  78           HD2      PRO  78  -2.666   8.002   4.937
  544    HD3  PRO  78           HD1      PRO  78  -2.077   7.527   6.543
  545    H    GLY  79           HN       GLY  79  -7.305   6.477   7.161
  546    HA2  GLY  79           HA2      GLY  79  -9.271   5.774   6.231
  547    HA3  GLY  79           HA1      GLY  79  -9.167   7.179   5.190
  548    H    SER  80           HN       SER  80  -6.421   5.340   4.612
  549    HA   SER  80           HA       SER  80  -7.623   4.705   2.016
  550    HB2  SER  80           HB2      SER  80  -5.096   5.747   2.918
  551    HB3  SER  80           HB1      SER  80  -4.878   4.367   1.849
  552    HG   SER  80           HG       SER  80  -6.564   5.575   0.524
  553    H    ALA  81           HN       ALA  81  -7.476   2.901   0.984
  554    HA   ALA  81           HA       ALA  81  -7.306   0.476   2.468
  555    HB1  ALA  81           HB1      ALA  81  -8.995   0.857   0.769
  556    HB2  ALA  81           HB2      ALA  81  -7.997  -0.547   0.354
  557    HB3  ALA  81           HB3      ALA  81  -7.735   1.001  -0.457
  558    H    HIS  82           HN       HIS  82  -4.739   1.754   2.353
  559    HA   HIS  82           HA       HIS  82  -3.353  -0.526   1.214
  560    HB2  HIS  82           HB2      HIS  82  -2.504   2.329   0.837
  561    HB3  HIS  82           HB1      HIS  82  -1.485   0.963   0.522
  562    HD1  HIS  82           HD1      HIS  82  -2.198  -0.529  -1.588
  563    HD2  HIS  82           HD2      HIS  82  -4.291   3.023  -1.112
  564    HE1  HIS  82           HE1      HIS  82  -3.364  -0.128  -3.786
  565    HE2  HIS  82           HE2      HIS  82  -4.734   1.972  -3.431
  566    H    GLN  83           HN       GLN  83  -2.078  -1.470   2.612
  567    HA   GLN  83           HA       GLN  83  -0.782   0.048   4.740
  568    HB2  GLN  83           HB2      GLN  83  -2.891  -0.709   5.741
  569    HB3  GLN  83           HB1      GLN  83  -2.577  -2.348   5.193
  570    HG2  GLN  83           HG2      GLN  83  -0.473  -2.241   6.630
  571    HG3  GLN  83           HG1      GLN  83  -1.194  -0.804   7.355
  572   HE21  GLN  83          HE21      GLN  83  -0.570  -3.369   8.567
  573   HE22  GLN  83          HE22      GLN  83  -2.061  -3.978   9.203
  574    H    ILE  84           HN       ILE  84   1.286  -0.557   4.618
  575    HA   ILE  84           HA       ILE  84   1.920  -3.014   3.257
  576    HB   ILE  84           HB       ILE  84   3.344  -0.517   3.974
  577   HG12  ILE  84          HG12      ILE  84   3.713  -1.682   1.367
  578   HG13  ILE  84          HG11      ILE  84   2.006  -1.611   1.787
  579   HG21  ILE  84          HG21      ILE  84   5.462  -1.447   3.161
  580   HG22  ILE  84          HG22      ILE  84   4.723  -3.045   3.071
  581   HG23  ILE  84          HG23      ILE  84   4.928  -2.254   4.635
  582   HD11  ILE  84          HD11      ILE  84   2.492   0.391   0.657
  583   HD12  ILE  84          HD12      ILE  84   3.985   0.631   1.558
  584   HD13  ILE  84          HD13      ILE  84   2.427   0.827   2.365
  585    H    ASP  85           HN       ASP  85   2.773  -4.767   4.115
  586    HA   ASP  85           HA       ASP  85   3.007  -4.999   7.004
  587    HB2  ASP  85           HB2      ASP  85   1.927  -6.783   5.528
  588    HB3  ASP  85           HB1      ASP  85   3.534  -7.113   4.905
  589    H    THR  86           HN       THR  86   4.902  -4.463   7.920
  590    HA   THR  86           HA       THR  86   7.276  -4.403   6.280
  591    HB   THR  86           HB       THR  86   8.303  -3.376   8.297
  592    HG1  THR  86           HG1      THR  86   7.215  -3.912  10.071
  593   HG21  THR  86          HG21      THR  86   7.340  -2.031   6.550
  594   HG22  THR  86          HG22      THR  86   6.944  -1.315   8.118
  595   HG23  THR  86          HG23      THR  86   5.727  -2.239   7.237
  596    H    THR  87           HN       THR  87   5.879  -6.437   8.681
  597    HA   THR  87           HA       THR  87   8.161  -7.728   9.662
  598    HB   THR  87           HB       THR  87   5.346  -8.756   9.277
  599    HG1  THR  87           HG1      THR  87   5.191  -8.224  11.514
  600   HG21  THR  87          HG21      THR  87   6.932 -10.599   9.489
  601   HG22  THR  87          HG22      THR  87   5.917 -10.463  10.925
  602   HG23  THR  87          HG23      THR  87   7.580  -9.878  10.962
  603    H    ASN  88           HN       ASN  88   5.942  -8.645   7.036
  604    HA   ASN  88           HA       ASN  88   7.899 -10.613   6.097
  605    HB2  ASN  88           HB2      ASN  88   5.049 -10.061   5.270
  606    HB3  ASN  88           HB1      ASN  88   6.060 -11.313   4.561
  607   HD21  ASN  88          HD21      ASN  88   7.322 -11.994   7.110
  608   HD22  ASN  88          HD22      ASN  88   6.131 -12.859   8.015
  609    H    HIS  89           HN       HIS  89   6.845  -7.466   5.515
  610    HA   HIS  89           HA       HIS  89   7.784  -5.825   4.272
  611    HB2  HIS  89           HB2      HIS  89   9.632  -8.070   3.770
  612    HB3  HIS  89           HB1      HIS  89   9.641  -6.816   2.539
  613    HD1  HIS  89           HD1      HIS  89  11.750  -7.588   5.009
  614    HD2  HIS  89           HD2      HIS  89   9.390  -4.201   4.511
  615    HE1  HIS  89           HE1      HIS  89  12.849  -5.788   6.379
  616    HE2  HIS  89           HE2      HIS  89  11.314  -3.803   6.191
  617    H    LYS  90           HN       LYS  90   5.447  -6.710   3.607
  618    HA   LYS  90           HA       LYS  90   5.388  -7.056   0.688
  619    HB2  LYS  90           HB2      LYS  90   3.684  -7.965   2.947
  620    HB3  LYS  90           HB1      LYS  90   2.939  -7.771   1.383
  621    HG2  LYS  90           HG2      LYS  90   4.541  -9.376   0.439
  622    HG3  LYS  90           HG1      LYS  90   5.287  -9.551   2.030
  623    HD2  LYS  90           HD2      LYS  90   2.442 -10.243   1.296
  624    HD3  LYS  90           HD1      LYS  90   3.748 -11.384   1.624
  625    HE2  LYS  90           HE2      LYS  90   3.906 -10.554   3.909
  626    HE3  LYS  90           HE1      LYS  90   2.628  -9.391   3.591
  627    HZ1  LYS  90           HZ1      LYS  90   1.751 -11.303   4.729
  628    HZ2  LYS  90           HZ2      LYS  90   2.359 -12.347   3.548
  629    HZ3  LYS  90           HZ3      LYS  90   1.124 -11.259   3.160
  630    H    LEU  91           HN       LEU  91   4.041  -5.764  -0.530
  631    HA   LEU  91           HA       LEU  91   2.894  -3.363   0.695
  632    HB2  LEU  91           HB2      LEU  91   4.103  -3.381  -1.591
  633    HB3  LEU  91           HB1      LEU  91   2.734  -4.233  -2.161
  634    HG   LEU  91           HG       LEU  91   2.132  -2.212  -2.889
  635   HD11  LEU  91          HD11      LEU  91   0.310  -2.720  -1.440
  636   HD12  LEU  91          HD12      LEU  91   0.632  -0.988  -1.353
  637   HD13  LEU  91          HD13      LEU  91   1.167  -2.053  -0.047
  638   HD21  LEU  91          HD21      LEU  91   2.734  -0.097  -1.903
  639   HD22  LEU  91          HD22      LEU  91   4.140  -1.120  -2.203
  640   HD23  LEU  91          HD23      LEU  91   3.508  -0.942  -0.565
  641    H    ILE  92           HN       ILE  92   1.117  -3.964   1.777
  642    HA   ILE  92           HA       ILE  92  -0.861  -5.661   0.478
  643    HB   ILE  92           HB       ILE  92  -0.352  -4.729   3.267
  644   HG12  ILE  92          HG12      ILE  92  -0.907  -7.269   3.599
  645   HG13  ILE  92          HG11      ILE  92  -0.630  -7.353   1.862
  646   HG21  ILE  92          HG21      ILE  92  -2.978  -5.909   2.345
  647   HG22  ILE  92          HG22      ILE  92  -2.722  -4.267   2.931
  648   HG23  ILE  92          HG23      ILE  92  -2.506  -5.637   4.020
  649   HD11  ILE  92          HD11      ILE  92   1.589  -6.529   2.124
  650   HD12  ILE  92          HD12      ILE  92   1.343  -7.903   3.203
  651   HD13  ILE  92          HD13      ILE  92   1.326  -6.262   3.842
  652    H    SER  93           HN       SER  93  -2.779  -4.852  -0.190
  653    HA   SER  93           HA       SER  93  -3.351  -2.082   0.514
  654    HB2  SER  93           HB2      SER  93  -4.826  -1.987  -1.353
  655    HB3  SER  93           HB1      SER  93  -3.348  -2.762  -1.928
  656    HG   SER  93           HG       SER  93  -5.602  -4.210  -1.004
  657    H    THR  94           HN       THR  94  -4.670  -1.908   2.273
  658    HA   THR  94           HA       THR  94  -6.192  -4.295   2.955
  659    HB   THR  94           HB       THR  94  -5.563  -1.861   4.625
  660    HG1  THR  94           HG1      THR  94  -4.091  -3.231   5.646
  661   HG21  THR  94          HG21      THR  94  -6.967  -4.447   5.257
  662   HG22  THR  94          HG22      THR  94  -7.633  -2.818   5.342
  663   HG23  THR  94          HG23      THR  94  -6.384  -3.321   6.484
  664    H    PHE  95           HN       PHE  95  -8.132  -4.290   2.074
  665    HA   PHE  95           HA       PHE  95  -9.695  -1.811   2.153
  666    HB2  PHE  95           HB2      PHE  95  -9.475  -3.318   0.033
  667    HB3  PHE  95           HB1      PHE  95 -10.600  -4.364   0.899
  668    HD1  PHE  95           HD1      PHE  95 -12.862  -3.545   1.499
  669    HD2  PHE  95           HD2      PHE  95 -10.228  -1.282  -0.971
  670    HE1  PHE  95           HE1      PHE  95 -14.750  -2.151   0.758
  671    HE2  PHE  95           HE2      PHE  95 -12.114   0.106  -1.718
  672    HZ   PHE  95           HZ       PHE  95 -14.377  -0.326  -0.852
  673    H    THR  96           HN       THR  96 -10.494  -1.756   4.213
  674    HA   THR  96           HA       THR  96 -11.499  -4.183   5.402
  675    HB   THR  96           HB       THR  96 -12.017  -1.674   6.828
  676    HG1  THR  96           HG1      THR  96 -10.078  -0.854   6.541
  677   HG21  THR  96          HG21      THR  96 -12.231  -3.820   7.891
  678   HG22  THR  96          HG22      THR  96 -10.857  -2.975   8.603
  679   HG23  THR  96          HG23      THR  96 -10.590  -4.258   7.420
  680    HA   PRO  97           HA       PRO  97 -15.467  -3.240   3.481
  681    HB2  PRO  97           HB2      PRO  97 -16.562  -5.618   4.398
  682    HB3  PRO  97           HB1      PRO  97 -15.787  -5.380   2.832
  683    HG2  PRO  97           HG2      PRO  97 -14.774  -6.688   5.270
  684    HG3  PRO  97           HG1      PRO  97 -14.337  -6.954   3.575
  685    HD2  PRO  97           HD2      PRO  97 -12.792  -5.622   5.392
  686    HD3  PRO  97           HD1      PRO  97 -12.679  -5.416   3.643
  687    H    SER  98           HN       SER  98 -17.657  -3.115   4.259
  688    HA   SER  98           HA       SER  98 -17.805  -1.845   6.789
  689    HB2  SER  98           HB2      SER  98 -20.152  -2.777   5.140
  690    HB3  SER  98           HB1      SER  98 -20.063  -1.382   6.215
  691    HG   SER  98           HG       SER  98 -19.581  -0.326   4.472
  692    H    ASN  99           HN       ASN  99 -18.254  -5.057   5.694
  693    HA   ASN  99           HA       ASN  99 -19.957  -6.001   7.775
  694    HB2  ASN  99           HB2      ASN  99 -18.155  -7.308   5.771
  695    HB3  ASN  99           HB1      ASN  99 -18.950  -8.248   7.015
  696   HD21  ASN  99          HD21      ASN  99 -20.146  -9.400   5.502
  697   HD22  ASN  99          HD22      ASN  99 -21.468  -8.691   4.641
  698    H    GLY 100           HN       GLY 100 -16.633  -5.334   7.528
  699    HA2  GLY 100           HA2      GLY 100 -15.054  -5.260   9.240
  700    HA3  GLY 100           HA1      GLY 100 -16.183  -6.122  10.277
  701    H    GLY 101           HN       GLY 101 -15.929  -7.576   7.292
  702    HA2  GLY 101           HA2      GLY 101 -14.621  -9.877   8.410
  703    HA3  GLY 101           HA1      GLY 101 -15.254  -9.722   6.780
  704    H    GLN 102           HN       GLN 102 -13.262 -10.921   6.292
  705    HA   GLN 102           HA       GLN 102 -10.693  -9.879   6.658
  706    HB2  GLN 102           HB2      GLN 102 -11.823 -11.751   4.584
  707    HB3  GLN 102           HB1      GLN 102 -10.125 -11.302   4.607
  708    HG2  GLN 102           HG2      GLN 102 -10.322 -13.389   5.703
  709    HG3  GLN 102           HG1      GLN 102 -10.003 -12.173   6.939
  710   HE21  GLN 102          HE21      GLN 102 -12.357 -14.347   5.591
  711   HE22  GLN 102          HE22      GLN 102 -13.479 -14.265   6.903
  712    H    ALA 103           HN       ALA 103  -9.478  -8.470   5.595
  713    HA   ALA 103           HA       ALA 103 -10.795  -6.607   3.824
  714    HB1  ALA 103           HB1      ALA 103  -8.687  -5.381   3.896
  715    HB2  ALA 103           HB2      ALA 103  -7.936  -6.710   4.791
  716    HB3  ALA 103           HB3      ALA 103  -9.258  -5.789   5.516
  717    H    THR 104           HN       THR 104 -10.276  -6.087   1.871
  718    HA   THR 104           HA       THR 104  -9.448  -8.272   0.178
  719    HB   THR 104           HB       THR 104 -10.876  -5.705  -0.113
  720    HG1  THR 104           HG1      THR 104 -11.373  -8.417  -0.633
  721   HG21  THR 104          HG21      THR 104 -10.916  -6.048  -2.594
  722   HG22  THR 104          HG22      THR 104  -9.537  -7.138  -2.383
  723   HG23  THR 104          HG23      THR 104  -9.404  -5.434  -1.922
  724    H    VAL 105           HN       VAL 105  -7.437  -8.420  -0.728
  725    HA   VAL 105           HA       VAL 105  -5.685  -6.078  -0.346
  726    HB   VAL 105           HB       VAL 105  -4.986  -8.954   0.200
  727   HG11  VAL 105          HG11      VAL 105  -3.348  -6.452   0.503
  728   HG12  VAL 105          HG12      VAL 105  -3.057  -7.784  -0.614
  729   HG13  VAL 105          HG13      VAL 105  -2.883  -8.033   1.124
  730   HG21  VAL 105          HG21      VAL 105  -6.412  -8.122   1.958
  731   HG22  VAL 105          HG22      VAL 105  -5.441  -6.655   2.094
  732   HG23  VAL 105          HG23      VAL 105  -4.752  -8.211   2.559
  733    H    LEU 106           HN       LEU 106  -4.410  -5.544  -1.900
  734    HA   LEU 106           HA       LEU 106  -3.639  -7.466  -3.985
  735    HB2  LEU 106           HB2      LEU 106  -3.743  -4.458  -3.887
  736    HB3  LEU 106           HB1      LEU 106  -2.813  -5.300  -5.106
  737    HG   LEU 106           HG       LEU 106  -4.866  -4.703  -6.098
  738   HD11  LEU 106          HD11      LEU 106  -5.840  -6.855  -6.677
  739   HD12  LEU 106          HD12      LEU 106  -5.090  -7.599  -5.265
  740   HD13  LEU 106          HD13      LEU 106  -4.083  -6.989  -6.580
  741   HD21  LEU 106          HD21      LEU 106  -6.338  -6.064  -3.828
  742   HD22  LEU 106          HD22      LEU 106  -7.038  -5.129  -5.157
  743   HD23  LEU 106          HD23      LEU 106  -6.070  -4.325  -3.929
  744    H    THR 107           HN       THR 107  -1.649  -8.329  -3.695
  745    HA   THR 107           HA       THR 107   0.064  -6.974  -1.719
  746    HB   THR 107           HB       THR 107   0.183  -9.907  -2.344
  747    HG1  THR 107           HG1      THR 107  -1.220  -8.950  -0.105
  748   HG21  THR 107          HG21      THR 107   1.125 -10.041  -0.086
  749   HG22  THR 107          HG22      THR 107   0.958  -8.294   0.096
  750   HG23  THR 107          HG23      THR 107   2.072  -8.952  -1.103
  751    H    TYR 108           HN       TYR 108   2.186  -6.762  -1.976
  752    HA   TYR 108           HA       TYR 108   3.563  -7.881  -4.318
  753    HB2  TYR 108           HB2      TYR 108   3.266  -5.636  -5.018
  754    HB3  TYR 108           HB1      TYR 108   3.442  -5.029  -3.410
  755    HD1  TYR 108           HD1      TYR 108   5.408  -4.126  -2.688
  756    HD2  TYR 108           HD2      TYR 108   5.419  -6.597  -6.143
  757    HE1  TYR 108           HE1      TYR 108   7.721  -3.473  -3.121
  758    HE2  TYR 108           HE2      TYR 108   7.761  -5.975  -6.580
  759    HH   TYR 108           HH       TYR 108   9.288  -4.089  -6.050
  760    H    ASP 109           HN       ASP 109   5.750  -8.462  -3.832
  761    HA   ASP 109           HA       ASP 109   6.424  -8.213  -0.969
  762    HB2  ASP 109           HB2      ASP 109   5.965 -10.539  -1.959
  763    HB3  ASP 109           HB1      ASP 109   7.492 -10.344  -2.814
  764    H    TRP 110           HN       TRP 110   7.893  -6.626  -0.735
  765    HA   TRP 110           HA       TRP 110   9.590  -5.756  -2.845
  766    HB2  TRP 110           HB2      TRP 110   9.105  -4.051  -1.342
  767    HB3  TRP 110           HB1      TRP 110   9.338  -5.074   0.065
  768    HD1  TRP 110           HD1      TRP 110  11.424  -3.223  -2.612
  769    HE1  TRP 110           HE1      TRP 110  13.735  -2.685  -1.603
  770    HE3  TRP 110           HE3      TRP 110  10.950  -5.651   1.852
  771    HZ2  TRP 110           HZ2      TRP 110  15.157  -3.229   0.772
  772    HZ3  TRP 110           HZ3      TRP 110  12.826  -5.596   3.437
  773    HH2  TRP 110           HH2      TRP 110  14.892  -4.408   2.915
  774    H    SER 111           HN       SER 111  10.060  -7.794  -0.036
  775    HA   SER 111           HA       SER 111  12.845  -8.023  -0.199
  776    HB2  SER 111           HB2      SER 111  10.726  -9.726   1.040
  777    HB3  SER 111           HB1      SER 111  12.431 -10.025   1.252
  778    HG   SER 111           HG       SER 111  12.528  -8.452   2.632
  779    H    ALA 112           HN       ALA 112  10.233  -9.769  -1.733
  780    HA   ALA 112           HA       ALA 112  12.139 -11.571  -3.013
  781    HB1  ALA 112           HB1      ALA 112  10.214 -12.785  -3.829
  782    HB2  ALA 112           HB2      ALA 112   9.140 -11.530  -3.213
  783    HB3  ALA 112           HB3      ALA 112  10.075 -12.517  -2.091
  784    H    ASN 113           HN       ASN 113  11.642  -8.608  -3.557
  785    HA   ASN 113           HA       ASN 113  11.547  -7.146  -5.269
  786    HB2  ASN 113           HB2      ASN 113  12.920  -9.483  -6.577
  787    HB3  ASN 113           HB1      ASN 113  12.812  -7.883  -7.289
  788   HD21  ASN 113          HD21      ASN 113  14.247  -9.814  -4.807
  789   HD22  ASN 113          HD22      ASN 113  15.434  -8.661  -4.311
  790    H    GLY 114           HN       GLY 114   9.126  -8.212  -4.936
  791    HA2  GLY 114           HA2      GLY 114   7.178  -7.916  -6.297
  792    HA3  GLY 114           HA1      GLY 114   8.113  -8.448  -7.692
  793    H    VAL 115           HN       VAL 115   8.602 -10.632  -7.929
  794    HA   VAL 115           HA       VAL 115   7.488 -12.480  -5.976
  795    HB   VAL 115           HB       VAL 115   5.785 -12.350  -7.722
  796   HG11  VAL 115          HG11      VAL 115   7.981 -13.163  -9.615
  797   HG12  VAL 115          HG12      VAL 115   7.140 -11.613  -9.586
  798   HG13  VAL 115          HG13      VAL 115   6.265 -13.084 -10.012
  799   HG21  VAL 115          HG21      VAL 115   6.070 -14.482  -6.636
  800   HG22  VAL 115          HG22      VAL 115   7.378 -14.914  -7.738
  801   HG23  VAL 115          HG23      VAL 115   5.728 -14.756  -8.345
  802    H    ASN 116           HN       ASN 116   8.758 -14.163  -5.593
  803    HA   ASN 116           HA       ASN 116  11.437 -14.142  -6.501
  804    HB2  ASN 116           HB2      ASN 116  10.709 -14.950  -4.272
  805    HB3  ASN 116           HB1      ASN 116   9.916 -16.316  -5.044
  806   HD21  ASN 116          HD21      ASN 116  12.958 -14.882  -4.179
  807   HD22  ASN 116          HD22      ASN 116  13.929 -16.285  -4.466
  808    H    SER 117           HN       SER 117  12.491 -15.492  -7.942
  809    HA   SER 117           HA       SER 117  10.931 -16.632 -10.042
  810    HB2  SER 117           HB2      SER 117  13.907 -16.815  -9.511
  811    HB3  SER 117           HB1      SER 117  13.104 -17.245 -11.023
  812    HG   SER 117           HG       SER 117  13.925 -14.831 -10.183
  813    H    ASN 118           HN       ASN 118   9.807 -17.980  -8.331
  814    HA   ASN 118           HA       ASN 118  11.227 -20.451  -7.696
  815    HB2  ASN 118           HB2      ASN 118  10.016 -19.387  -5.868
  816    HB3  ASN 118           HB1      ASN 118   8.532 -19.390  -6.813
  817   HD21  ASN 118          HD21      ASN 118  10.837 -21.378  -5.092
  818   HD22  ASN 118          HD22      ASN 118   9.796 -22.745  -4.905
  Start of MODEL    8
    1    H1   HIS   6           HT1      HIS   6 -21.286  -6.486  -7.526
    2    H2   HIS   6           HT2      HIS   6 -20.658  -5.961  -6.049
    3    H3   HIS   6           HT3      HIS   6 -19.718  -6.940  -7.064
    4    HA   HIS   6           HA       HIS   6 -19.728  -5.180  -8.746
    5    HB2  HIS   6           HB2      HIS   6 -21.208  -3.727  -6.560
    6    HB3  HIS   6           HB1      HIS   6 -20.318  -2.863  -7.804
    7    HD1  HIS   6           HD1      HIS   6 -23.575  -4.229  -7.080
    8    HD2  HIS   6           HD2      HIS   6 -21.328  -3.522 -10.507
    9    HE1  HIS   6           HE1      HIS   6 -25.222  -4.211  -8.979
   10    HE2  HIS   6           HE2      HIS   6 -23.860  -3.636 -11.018
   11    H    GLN   7           HN       GLN   7 -19.423  -4.107  -5.356
   12    HA   GLN   7           HA       GLN   7 -16.898  -2.951  -5.654
   13    HB2  GLN   7           HB2      GLN   7 -18.157  -2.334  -3.778
   14    HB3  GLN   7           HB1      GLN   7 -18.394  -4.004  -3.312
   15    HG2  GLN   7           HG2      GLN   7 -16.021  -4.179  -2.723
   16    HG3  GLN   7           HG1      GLN   7 -15.817  -2.474  -3.135
   17   HE21  GLN   7          HE21      GLN   7 -16.750  -0.901  -1.812
   18   HE22  GLN   7          HE22      GLN   7 -17.260  -1.250  -0.197
   19    H    ASP   8           HN       ASP   8 -17.877  -6.217  -5.152
   20    HA   ASP   8           HA       ASP   8 -15.509  -7.236  -4.074
   21    HB2  ASP   8           HB2      ASP   8 -16.345  -9.416  -4.713
   22    HB3  ASP   8           HB1      ASP   8 -17.693  -8.438  -4.142
   23    H    ASN   9           HN       ASN   9 -16.542  -6.667  -7.366
   24    HA   ASN   9           HA       ASN   9 -14.067  -7.662  -8.481
   25    HB2  ASN   9           HB2      ASN   9 -16.499  -6.302  -9.617
   26    HB3  ASN   9           HB1      ASN   9 -15.045  -6.523 -10.581
   27   HD21  ASN   9          HD21      ASN   9 -17.683  -8.143  -8.969
   28   HD22  ASN   9          HD22      ASN   9 -17.486  -9.666  -9.762
   29    H    ALA  10           HN       ALA  10 -15.575  -4.663  -7.612
   30    HA   ALA  10           HA       ALA  10 -13.903  -2.859  -8.961
   31    HB1  ALA  10           HB1      ALA  10 -15.353  -2.498  -6.345
   32    HB2  ALA  10           HB2      ALA  10 -16.003  -2.170  -7.956
   33    HB3  ALA  10           HB3      ALA  10 -14.656  -1.204  -7.326
   34    H    ARG  11           HN       ARG  11 -13.784  -4.054  -5.635
   35    HA   ARG  11           HA       ARG  11 -11.687  -2.585  -4.649
   36    HB2  ARG  11           HB2      ARG  11 -11.226  -4.507  -3.148
   37    HB3  ARG  11           HB1      ARG  11 -12.939  -4.068  -3.218
   38    HG2  ARG  11           HG2      ARG  11 -13.262  -5.903  -4.864
   39    HG3  ARG  11           HG1      ARG  11 -11.586  -6.381  -4.578
   40    HD2  ARG  11           HD2      ARG  11 -12.877  -7.749  -3.190
   41    HD3  ARG  11           HD1      ARG  11 -12.183  -6.515  -2.139
   42    HE   ARG  11           HE       ARG  11 -14.726  -5.676  -3.001
   43   HH11  ARG  11          HH11      ARG  11 -13.158  -7.954  -0.872
   44   HH12  ARG  11          HH12      ARG  11 -14.552  -8.174   0.142
   45   HH21  ARG  11          HH21      ARG  11 -16.585  -5.950  -1.647
   46   HH22  ARG  11          HH22      ARG  11 -16.495  -7.039  -0.303
   47    H    LYS  12           HN       LYS  12 -11.501  -5.680  -6.335
   48    HA   LYS  12           HA       LYS  12  -8.777  -6.063  -6.272
   49    HB2  LYS  12           HB2      LYS  12 -10.560  -7.642  -7.129
   50    HB3  LYS  12           HB1      LYS  12 -10.548  -6.719  -8.628
   51    HG2  LYS  12           HG2      LYS  12  -9.153  -8.485  -9.080
   52    HG3  LYS  12           HG1      LYS  12  -8.019  -7.220  -8.612
   53    HD2  LYS  12           HD2      LYS  12  -8.052  -8.145  -6.300
   54    HD3  LYS  12           HD1      LYS  12  -9.031  -9.486  -6.900
   55    HE2  LYS  12           HE2      LYS  12  -7.245 -10.041  -8.491
   56    HE3  LYS  12           HE1      LYS  12  -6.285  -8.729  -7.820
   57    HZ1  LYS  12           HZ1      LYS  12  -5.596 -10.802  -6.856
   58    HZ2  LYS  12           HZ2      LYS  12  -7.177 -11.167  -6.388
   59    HZ3  LYS  12           HZ3      LYS  12  -6.361  -9.880  -5.661
   60    H    SER  13           HN       SER  13 -10.734  -4.151  -8.523
   61    HA   SER  13           HA       SER  13  -8.420  -3.668 -10.222
   62    HB2  SER  13           HB2      SER  13 -11.323  -2.806 -10.373
   63    HB3  SER  13           HB1      SER  13 -10.108  -2.425 -11.603
   64    HG   SER  13           HG       SER  13  -9.770  -4.773 -11.708
   65    H    ARG  14           HN       ARG  14 -10.609  -1.784  -8.167
   66    HA   ARG  14           HA       ARG  14  -9.521   0.744  -8.699
   67    HB2  ARG  14           HB2      ARG  14 -10.672   1.485  -6.673
   68    HB3  ARG  14           HB1      ARG  14 -11.713   0.419  -7.609
   69    HG2  ARG  14           HG2      ARG  14 -11.427  -1.352  -6.121
   70    HG3  ARG  14           HG1      ARG  14 -10.022  -0.598  -5.374
   71    HD2  ARG  14           HD2      ARG  14 -11.899  -0.440  -3.884
   72    HD3  ARG  14           HD1      ARG  14 -11.486   1.158  -4.482
   73    HE   ARG  14           HE       ARG  14 -13.818  -0.400  -5.360
   74   HH11  ARG  14          HH11      ARG  14 -12.150   2.652  -4.930
   75   HH12  ARG  14          HH12      ARG  14 -13.474   3.603  -5.515
   76   HH21  ARG  14          HH21      ARG  14 -15.583   0.874  -6.103
   77   HH22  ARG  14          HH22      ARG  14 -15.422   2.599  -6.174
   78    H    ILE  15           HN       ILE  15  -8.643  -1.744  -6.364
   79    HA   ILE  15           HA       ILE  15  -6.723  -0.070  -5.038
   80    HB   ILE  15           HB       ILE  15  -6.958  -3.083  -5.056
   81   HG12  ILE  15          HG12      ILE  15  -7.921  -1.123  -2.946
   82   HG13  ILE  15          HG11      ILE  15  -8.972  -1.809  -4.182
   83   HG21  ILE  15          HG21      ILE  15  -5.531  -1.219  -3.149
   84   HG22  ILE  15          HG22      ILE  15  -4.751  -2.214  -4.379
   85   HG23  ILE  15          HG23      ILE  15  -5.596  -2.980  -3.030
   86   HD11  ILE  15          HD11      ILE  15  -9.124  -2.953  -2.015
   87   HD12  ILE  15          HD12      ILE  15  -7.425  -3.413  -2.170
   88   HD13  ILE  15          HD13      ILE  15  -8.618  -4.022  -3.337
   89    H    GLN  16           HN       GLN  16  -6.699  -2.682  -7.393
   90    HA   GLN  16           HA       GLN  16  -4.035  -3.180  -7.645
   91    HB2  GLN  16           HB2      GLN  16  -6.435  -3.689  -9.069
   92    HB3  GLN  16           HB1      GLN  16  -5.150  -3.362 -10.215
   93    HG2  GLN  16           HG2      GLN  16  -3.764  -5.058  -9.076
   94    HG3  GLN  16           HG1      GLN  16  -5.129  -5.390  -8.007
   95   HE21  GLN  16          HE21      GLN  16  -5.479  -4.661 -11.403
   96   HE22  GLN  16          HE22      GLN  16  -5.993  -6.238 -11.885
   97    H    SER  17           HN       SER  17  -5.872  -0.722  -9.491
   98    HA   SER  17           HA       SER  17  -3.785   0.090 -11.144
   99    HB2  SER  17           HB2      SER  17  -5.970   1.840  -9.993
  100    HB3  SER  17           HB1      SER  17  -5.040   2.156 -11.458
  101    HG   SER  17           HG       SER  17  -5.965   0.294 -12.379
  102    H    GLU  18           HN       GLU  18  -4.612   1.047  -7.893
  103    HA   GLU  18           HA       GLU  18  -2.486   3.008  -7.743
  104    HB2  GLU  18           HB2      GLU  18  -4.361   1.990  -5.619
  105    HB3  GLU  18           HB1      GLU  18  -3.353   3.431  -5.543
  106    HG2  GLU  18           HG2      GLU  18  -5.377   3.029  -7.684
  107    HG3  GLU  18           HG1      GLU  18  -5.791   3.758  -6.129
  108    H    HIS  19           HN       HIS  19  -3.205  -0.216  -6.541
  109    HA   HIS  19           HA       HIS  19  -1.217  -0.604  -4.677
  110    HB2  HIS  19           HB2      HIS  19  -2.735  -2.363  -4.872
  111    HB3  HIS  19           HB1      HIS  19  -2.607  -2.443  -6.618
  112    HD1  HIS  19           HD1      HIS  19  -0.285  -3.115  -3.652
  113    HD2  HIS  19           HD2      HIS  19  -1.271  -4.601  -7.397
  114    HE1  HIS  19           HE1      HIS  19   1.099  -5.190  -3.934
  115    HE2  HIS  19           HE2      HIS  19   0.312  -6.189  -6.109
  116    H    ARG  20           HN       ARG  20  -0.959  -1.170  -8.193
  117    HA   ARG  20           HA       ARG  20   1.752  -1.770  -8.298
  118    HB2  ARG  20           HB2      ARG  20   0.037  -0.227 -10.252
  119    HB3  ARG  20           HB1      ARG  20   1.652  -0.814 -10.618
  120    HG2  ARG  20           HG2      ARG  20  -0.293  -2.793  -9.608
  121    HG3  ARG  20           HG1      ARG  20  -0.563  -2.158 -11.235
  122    HD2  ARG  20           HD2      ARG  20   0.764  -4.171 -11.358
  123    HD3  ARG  20           HD1      ARG  20   1.752  -2.790 -11.822
  124    HE   ARG  20           HE       ARG  20   1.907  -4.136  -9.198
  125   HH11  ARG  20          HH11      ARG  20   3.411  -2.401 -11.844
  126   HH12  ARG  20          HH12      ARG  20   5.010  -2.536 -11.190
  127   HH21  ARG  20          HH21      ARG  20   4.024  -4.331  -8.351
  128   HH22  ARG  20          HH22      ARG  20   5.363  -3.640  -9.214
  129    H    GLU  21           HN       GLU  21   0.160   1.407  -8.334
  130    HA   GLU  21           HA       GLU  21   2.396   3.051  -8.582
  131    HB2  GLU  21           HB2      GLU  21  -0.034   3.635  -6.881
  132    HB3  GLU  21           HB1      GLU  21   1.032   4.803  -7.639
  133    HG2  GLU  21           HG2      GLU  21  -0.749   2.901  -9.110
  134    HG3  GLU  21           HG1      GLU  21  -1.162   4.583  -8.756
  135    H    LEU  22           HN       LEU  22   0.832   1.815  -5.622
  136    HA   LEU  22           HA       LEU  22   2.518   3.225  -3.860
  137    HB2  LEU  22           HB2      LEU  22   0.709   0.873  -3.458
  138    HB3  LEU  22           HB1      LEU  22   1.751   1.438  -2.169
  139    HG   LEU  22           HG       LEU  22  -0.277   2.473  -1.702
  140   HD11  LEU  22          HD11      LEU  22   0.060   4.850  -2.152
  141   HD12  LEU  22          HD12      LEU  22   1.229   4.466  -3.408
  142   HD13  LEU  22          HD13      LEU  22   1.583   4.073  -1.727
  143   HD21  LEU  22          HD21      LEU  22  -1.355   1.864  -3.830
  144   HD22  LEU  22          HD22      LEU  22  -0.553   3.238  -4.599
  145   HD23  LEU  22          HD23      LEU  22  -1.719   3.507  -3.304
  146    H    VAL  23           HN       VAL  23   2.877   0.045  -5.347
  147    HA   VAL  23           HA       VAL  23   5.151  -0.508  -3.685
  148    HB   VAL  23           HB       VAL  23   4.812  -2.582  -4.264
  149   HG11  VAL  23          HG11      VAL  23   2.472  -1.847  -4.755
  150   HG12  VAL  23          HG12      VAL  23   2.988  -3.315  -5.587
  151   HG13  VAL  23          HG13      VAL  23   2.929  -1.786  -6.459
  152   HG21  VAL  23          HG21      VAL  23   5.323  -1.749  -7.090
  153   HG22  VAL  23          HG22      VAL  23   5.325  -3.409  -6.489
  154   HG23  VAL  23          HG23      VAL  23   6.535  -2.257  -5.903
  155    H    SER  24           HN       SER  24   4.558   0.725  -6.926
  156    HA   SER  24           HA       SER  24   7.209   1.016  -7.777
  157    HB2  SER  24           HB2      SER  24   5.138   1.545  -9.127
  158    HB3  SER  24           HB1      SER  24   4.970   3.022  -8.177
  159    HG   SER  24           HG       SER  24   7.029   2.310  -9.987
  160    H    ALA  25           HN       ALA  25   5.290   2.666  -5.429
  161    HA   ALA  25           HA       ALA  25   7.176   4.837  -5.006
  162    HB1  ALA  25           HB1      ALA  25   4.933   4.042  -3.174
  163    HB2  ALA  25           HB2      ALA  25   4.641   4.948  -4.665
  164    HB3  ALA  25           HB3      ALA  25   5.663   5.638  -3.388
  165    H    ILE  26           HN       ILE  26   6.329   1.746  -3.456
  166    HA   ILE  26           HA       ILE  26   7.913   1.982  -1.194
  167    HB   ILE  26           HB       ILE  26   6.828  -0.293  -2.749
  168   HG12  ILE  26          HG12      ILE  26   6.943   0.527   0.136
  169   HG13  ILE  26          HG11      ILE  26   5.541   0.483  -0.928
  170   HG21  ILE  26          HG21      ILE  26   9.156  -1.004  -2.551
  171   HG22  ILE  26          HG22      ILE  26   8.094  -1.985  -1.540
  172   HG23  ILE  26          HG23      ILE  26   9.088  -0.724  -0.811
  173   HD11  ILE  26          HD11      ILE  26   5.615  -1.338   0.741
  174   HD12  ILE  26          HD12      ILE  26   7.073  -1.945  -0.051
  175   HD13  ILE  26          HD13      ILE  26   5.544  -1.903  -0.937
  176    H    GLN  27           HN       GLN  27   8.719   0.748  -4.398
  177    HA   GLN  27           HA       GLN  27  11.390   0.095  -3.863
  178    HB2  GLN  27           HB2      GLN  27  10.082   0.865  -6.481
  179    HB3  GLN  27           HB1      GLN  27  11.617   0.015  -6.313
  180    HG2  GLN  27           HG2      GLN  27  10.425  -1.832  -5.206
  181    HG3  GLN  27           HG1      GLN  27   8.915  -0.969  -5.442
  182   HE21  GLN  27          HE21      GLN  27  11.470  -2.740  -6.983
  183   HE22  GLN  27          HE22      GLN  27  10.662  -2.985  -8.493
  184    H    SER  28           HN       SER  28   9.810   3.057  -4.661
  185    HA   SER  28           HA       SER  28  12.167   4.574  -5.223
  186    HB2  SER  28           HB2      SER  28   9.307   5.333  -4.606
  187    HB3  SER  28           HB1      SER  28  10.535   6.478  -5.107
  188    HG   SER  28           HG       SER  28   9.230   4.497  -6.574
  189    H    TYR  29           HN       TYR  29   9.828   4.575  -2.529
  190    HA   TYR  29           HA       TYR  29  11.085   6.210  -0.707
  191    HB2  TYR  29           HB2      TYR  29   8.821   5.206  -0.500
  192    HB3  TYR  29           HB1      TYR  29   9.557   3.648  -0.161
  193    HD1  TYR  29           HD1      TYR  29   7.578   4.536   1.620
  194    HD2  TYR  29           HD2      TYR  29  11.700   5.602   1.616
  195    HE1  TYR  29           HE1      TYR  29   7.451   4.990   4.033
  196    HE2  TYR  29           HE2      TYR  29  11.573   6.068   4.018
  197    HH   TYR  29           HH       TYR  29   9.912   6.662   5.697
  198    H    ILE  30           HN       ILE  30  11.390   2.691  -0.983
  199    HA   ILE  30           HA       ILE  30  13.174   2.379   1.146
  200    HB   ILE  30           HB       ILE  30  12.605   0.646  -1.243
  201   HG12  ILE  30          HG12      ILE  30  11.613   0.692   1.610
  202   HG13  ILE  30          HG11      ILE  30  10.695   1.078   0.165
  203   HG21  ILE  30          HG21      ILE  30  14.157  -0.001   1.254
  204   HG22  ILE  30          HG22      ILE  30  14.778   0.051  -0.394
  205   HG23  ILE  30          HG23      ILE  30  13.607  -1.186   0.070
  206   HD11  ILE  30          HD11      ILE  30  10.946  -1.251  -0.567
  207   HD12  ILE  30          HD12      ILE  30  10.063  -1.070   0.951
  208   HD13  ILE  30          HD13      ILE  30  11.743  -1.613   0.965
  209    H    GLY  31           HN       GLY  31  13.751   2.875  -2.304
  210    HA2  GLY  31           HA2      GLY  31  16.565   2.406  -2.153
  211    HA3  GLY  31           HA1      GLY  31  15.716   3.212  -3.468
  212    H    ALA  32           HN       ALA  32  14.588   4.950  -1.151
  213    HA   ALA  32           HA       ALA  32  16.703   6.962  -1.283
  214    HB1  ALA  32           HB1      ALA  32  13.926   7.258  -0.176
  215    HB2  ALA  32           HB2      ALA  32  14.313   7.473  -1.885
  216    HB3  ALA  32           HB3      ALA  32  15.032   8.539  -0.674
  217    H    GLN  33           HN       GLN  33  15.156   4.786   0.906
  218    HA   GLN  33           HA       GLN  33  15.389   6.080   3.305
  219    HB2  GLN  33           HB2      GLN  33  15.366   3.217   2.516
  220    HB3  GLN  33           HB1      GLN  33  15.635   3.674   4.194
  221    HG2  GLN  33           HG2      GLN  33  13.389   4.956   2.818
  222    HG3  GLN  33           HG1      GLN  33  13.235   3.251   3.170
  223   HE21  GLN  33          HE21      GLN  33  11.693   3.468   4.791
  224   HE22  GLN  33          HE22      GLN  33  12.006   4.254   6.298
  225    H    ASP  34           HN       ASP  34  16.784   5.707   5.079
  226    HA   ASP  34           HA       ASP  34  19.548   5.920   4.518
  227    HB2  ASP  34           HB2      ASP  34  18.148   6.725   6.572
  228    HB3  ASP  34           HB1      ASP  34  18.486   5.115   7.195
  229    H    ASP  35           HN       ASP  35  17.399   3.389   5.378
  230    HA   ASP  35           HA       ASP  35  19.489   1.427   4.738
  231    HB2  ASP  35           HB2      ASP  35  17.389   0.687   6.753
  232    HB3  ASP  35           HB1      ASP  35  18.958  -0.036   6.467
  233    HA   PRO  36           HA       PRO  36  15.949   0.583   1.984
  234    HB2  PRO  36           HB2      PRO  36  17.427  -0.375  -0.014
  235    HB3  PRO  36           HB1      PRO  36  17.435   1.349   0.325
  236    HG2  PRO  36           HG2      PRO  36  19.341  -0.729   1.345
  237    HG3  PRO  36           HG1      PRO  36  19.738   0.707   0.392
  238    HD2  PRO  36           HD2      PRO  36  19.933   0.839   3.004
  239    HD3  PRO  36           HD1      PRO  36  19.136   2.157   2.118
  240    H    THR  37           HN       THR  37  17.886  -1.074   3.909
  241    HA   THR  37           HA       THR  37  17.659  -3.700   2.778
  242    HB   THR  37           HB       THR  37  19.182  -4.356   4.507
  243    HG1  THR  37           HG1      THR  37  19.703  -2.674   6.159
  244   HG21  THR  37          HG21      THR  37  20.988  -2.721   4.250
  245   HG22  THR  37          HG22      THR  37  19.823  -1.517   3.685
  246   HG23  THR  37          HG23      THR  37  20.149  -2.958   2.715
  247    H    ASN  38           HN       ASN  38  16.282  -1.804   5.301
  248    HA   ASN  38           HA       ASN  38  14.048  -3.569   5.554
  249    HB2  ASN  38           HB2      ASN  38  15.860  -4.577   6.975
  250    HB3  ASN  38           HB1      ASN  38  15.765  -3.143   7.991
  251   HD21  ASN  38          HD21      ASN  38  15.098  -4.329   9.791
  252   HD22  ASN  38          HD22      ASN  38  13.504  -4.991   9.919
  253    HA   PRO  39           HA       PRO  39  13.620   1.110   6.359
  254    HB2  PRO  39           HB2      PRO  39  11.381   1.121   4.652
  255    HB3  PRO  39           HB1      PRO  39  12.974   1.802   4.328
  256    HG2  PRO  39           HG2      PRO  39  11.801  -0.745   3.422
  257    HG3  PRO  39           HG1      PRO  39  13.069   0.232   2.694
  258    HD2  PRO  39           HD2      PRO  39  13.528  -2.109   3.939
  259    HD3  PRO  39           HD1      PRO  39  14.722  -0.811   3.852
  260    H    SER  40           HN       SER  40  11.775   2.193   7.249
  261    HA   SER  40           HA       SER  40  10.352   0.667   9.163
  262    HB2  SER  40           HB2      SER  40   9.697   3.468   8.237
  263    HB3  SER  40           HB1      SER  40   9.353   2.751   9.810
  264    HG   SER  40           HG       SER  40  11.852   2.480   9.719
  265    H    GLU  41           HN       GLU  41   7.864   0.998   9.372
  266    HA   GLU  41           HA       GLU  41   6.632  -0.322   7.237
  267    HB2  GLU  41           HB2      GLU  41   5.542  -0.710   9.194
  268    HB3  GLU  41           HB1      GLU  41   5.692   0.953   9.745
  269    HG2  GLU  41           HG2      GLU  41   4.023   1.621   8.117
  270    HG3  GLU  41           HG1      GLU  41   3.815  -0.058   7.627
  271    H    ILE  42           HN       ILE  42   5.901   0.319   5.459
  272    HA   ILE  42           HA       ILE  42   6.132   3.118   4.805
  273    HB   ILE  42           HB       ILE  42   5.951   0.584   3.221
  274   HG12  ILE  42          HG12      ILE  42   8.044   2.665   3.784
  275   HG13  ILE  42          HG11      ILE  42   8.105   0.935   4.079
  276   HG21  ILE  42          HG21      ILE  42   4.645   2.238   2.044
  277   HG22  ILE  42          HG22      ILE  42   6.158   1.913   1.197
  278   HG23  ILE  42          HG23      ILE  42   5.978   3.388   2.147
  279   HD11  ILE  42          HD11      ILE  42   8.219   0.534   1.689
  280   HD12  ILE  42          HD12      ILE  42   9.539   1.561   2.252
  281   HD13  ILE  42          HD13      ILE  42   8.163   2.275   1.406
  282    H    THR  43           HN       THR  43   4.453   4.412   4.401
  283    HA   THR  43           HA       THR  43   1.822   3.169   4.013
  284    HB   THR  43           HB       THR  43   0.765   4.919   5.356
  285    HG1  THR  43           HG1      THR  43   2.073   6.328   6.585
  286   HG21  THR  43          HG21      THR  43   2.958   3.454   6.833
  287   HG22  THR  43          HG22      THR  43   1.353   2.822   6.460
  288   HG23  THR  43          HG23      THR  43   1.532   4.176   7.576
  289    H    LEU  44           HN       LEU  44   0.223   4.796   3.261
  290    HA   LEU  44           HA       LEU  44   1.095   5.782   0.782
  291    HB2  LEU  44           HB2      LEU  44  -1.406   6.474   2.253
  292    HB3  LEU  44           HB1      LEU  44  -1.151   6.520   0.532
  293    HG   LEU  44           HG       LEU  44  -1.419   4.141   2.299
  294   HD11  LEU  44          HD11      LEU  44  -3.355   3.728   1.236
  295   HD12  LEU  44          HD12      LEU  44  -2.808   4.435  -0.275
  296   HD13  LEU  44          HD13      LEU  44  -3.315   5.480   1.049
  297   HD21  LEU  44          HD21      LEU  44  -0.533   4.123  -0.565
  298   HD22  LEU  44          HD22      LEU  44  -0.741   2.727   0.484
  299   HD23  LEU  44          HD23      LEU  44   0.541   3.885   0.807
  300    H    ALA  45           HN       ALA  45   0.404   7.236   3.844
  301    HA   ALA  45           HA       ALA  45   0.637   9.935   3.085
  302    HB1  ALA  45           HB1      ALA  45   0.834  10.338   5.505
  303    HB2  ALA  45           HB2      ALA  45   1.032   8.599   5.764
  304    HB3  ALA  45           HB3      ALA  45  -0.496   9.235   5.116
  305    H    LYS  46           HN       LYS  46   2.954   7.460   3.830
  306    HA   LYS  46           HA       LYS  46   5.214   9.262   3.954
  307    HB2  LYS  46           HB2      LYS  46   4.945   6.284   3.938
  308    HB3  LYS  46           HB1      LYS  46   6.476   7.104   4.035
  309    HG2  LYS  46           HG2      LYS  46   5.892   8.054   6.158
  310    HG3  LYS  46           HG1      LYS  46   4.259   7.390   6.035
  311    HD2  LYS  46           HD2      LYS  46   5.395   5.112   5.834
  312    HD3  LYS  46           HD1      LYS  46   6.858   5.924   6.400
  313    HE2  LYS  46           HE2      LYS  46   4.223   5.965   7.848
  314    HE3  LYS  46           HE1      LYS  46   5.513   4.802   8.172
  315    HZ1  LYS  46           HZ1      LYS  46   5.682   6.562   9.739
  316    HZ2  LYS  46           HZ2      LYS  46   5.620   7.743   8.532
  317    HZ3  LYS  46           HZ3      LYS  46   6.971   6.734   8.658
  318    H    LEU  47           HN       LEU  47   3.599   7.194   1.666
  319    HA   LEU  47           HA       LEU  47   5.765   7.214  -0.199
  320    HB2  LEU  47           HB2      LEU  47   2.961   6.138  -0.267
  321    HB3  LEU  47           HB1      LEU  47   4.032   6.045  -1.653
  322    HG   LEU  47           HG       LEU  47   4.529   4.803   1.046
  323   HD11  LEU  47          HD11      LEU  47   2.773   3.648  -0.107
  324   HD12  LEU  47          HD12      LEU  47   4.245   2.679  -0.187
  325   HD13  LEU  47          HD13      LEU  47   3.720   3.604  -1.594
  326   HD21  LEU  47          HD21      LEU  47   6.420   3.702  -0.085
  327   HD22  LEU  47          HD22      LEU  47   6.604   5.452   0.007
  328   HD23  LEU  47          HD23      LEU  47   6.120   4.696  -1.510
  329    H    ALA  48           HN       ALA  48   3.415   9.343   0.599
  330    HA   ALA  48           HA       ALA  48   2.360  10.631  -1.471
  331    HB1  ALA  48           HB1      ALA  48   2.853  12.741  -0.270
  332    HB2  ALA  48           HB2      ALA  48   3.998  11.840   0.737
  333    HB3  ALA  48           HB3      ALA  48   2.272  11.455   0.795
  334    HA   PRO  49           HA       PRO  49   6.351  12.965  -2.716
  335    HB2  PRO  49           HB2      PRO  49   8.689  12.402  -1.631
  336    HB3  PRO  49           HB1      PRO  49   7.487  13.349  -0.750
  337    HG2  PRO  49           HG2      PRO  49   8.021  10.420  -0.606
  338    HG3  PRO  49           HG1      PRO  49   7.938  11.588   0.721
  339    HD2  PRO  49           HD2      PRO  49   5.849  10.077   0.084
  340    HD3  PRO  49           HD1      PRO  49   5.698  11.731   0.600
  341    H    TYR  50           HN       TYR  50   6.157   9.605  -2.607
  342    HA   TYR  50           HA       TYR  50   8.206   9.275  -4.686
  343    HB2  TYR  50           HB2      TYR  50   6.926   7.161  -2.953
  344    HB3  TYR  50           HB1      TYR  50   8.275   6.939  -4.060
  345    HD1  TYR  50           HD1      TYR  50  10.436   8.078  -3.577
  346    HD2  TYR  50           HD2      TYR  50   7.292   7.921  -0.737
  347    HE1  TYR  50           HE1      TYR  50  12.050   8.572  -1.794
  348    HE2  TYR  50           HE2      TYR  50   8.887   8.426   1.068
  349    HH   TYR  50           HH       TYR  50  12.116   9.448   0.436
  350    H    MET  51           HN       MET  51   4.916   9.581  -4.309
  351    HA   MET  51           HA       MET  51   4.292   7.901  -6.616
  352    HB2  MET  51           HB2      MET  51   2.313   9.726  -5.294
  353    HB3  MET  51           HB1      MET  51   2.025   8.253  -6.189
  354    HG2  MET  51           HG2      MET  51   3.410   8.317  -3.545
  355    HG3  MET  51           HG1      MET  51   1.667   8.139  -3.729
  356    HE1  MET  51           HE1      MET  51   1.608   6.349  -6.402
  357    HE2  MET  51           HE2      MET  51   0.562   6.066  -5.011
  358    HE3  MET  51           HE3      MET  51   1.515   4.742  -5.683
  359    H    SER  52           HN       SER  52   2.863   9.008  -8.295
  360    HA   SER  52           HA       SER  52   3.348  11.811  -8.721
  361    HB2  SER  52           HB2      SER  52   5.514  10.790  -9.388
  362    HB3  SER  52           HB1      SER  52   4.661   9.836 -10.600
  363    HG   SER  52           HG       SER  52   5.314  12.533 -10.582
  364    H    LYS  53           HN       LYS  53   1.870   8.815  -9.611
  365    HA   LYS  53           HA       LYS  53   0.810   9.372 -12.078
  366    HB2  LYS  53           HB2      LYS  53  -0.612   7.565 -11.774
  367    HB3  LYS  53           HB1      LYS  53   0.765   7.186 -10.775
  368    HG2  LYS  53           HG2      LYS  53  -1.812   8.363  -9.750
  369    HG3  LYS  53           HG1      LYS  53  -1.444   6.641  -9.764
  370    HD2  LYS  53           HD2      LYS  53   0.476   7.046  -8.299
  371    HD3  LYS  53           HD1      LYS  53   0.104   8.775  -8.286
  372    HE2  LYS  53           HE2      LYS  53  -0.747   7.798  -6.277
  373    HE3  LYS  53           HE1      LYS  53  -2.110   8.218  -7.319
  374    HZ1  LYS  53           HZ1      LYS  53  -2.333   5.943  -7.991
  375    HZ2  LYS  53           HZ2      LYS  53  -2.365   6.034  -6.305
  376    HZ3  LYS  53           HZ3      LYS  53  -0.968   5.498  -7.092
  377    H    ASN  54           HN       ASN  54  -0.189  10.480  -9.069
  378    HA   ASN  54           HA       ASN  54  -2.038  12.411  -9.992
  379    HB2  ASN  54           HB2      ASN  54  -3.120   9.992 -10.179
  380    HB3  ASN  54           HB1      ASN  54  -3.448  10.271  -8.476
  381   HD21  ASN  54          HD21      ASN  54  -4.918  11.862  -7.888
  382   HD22  ASN  54          HD22      ASN  54  -5.988  12.607  -9.030
  383    H    ALA  55           HN       ALA  55   0.151  11.860  -8.147
  384    HA   ALA  55           HA       ALA  55  -1.113  12.581  -5.596
  385    HB1  ALA  55           HB1      ALA  55  -0.604  10.326  -5.341
  386    HB2  ALA  55           HB2      ALA  55   0.737  11.167  -4.557
  387    HB3  ALA  55           HB3      ALA  55   0.937  10.487  -6.175
  388    H    LYS  56           HN       LYS  56   0.216  13.757  -4.135
  389    HA   LYS  56           HA       LYS  56   2.610  14.994  -5.228
  390    HB2  LYS  56           HB2      LYS  56   0.163  16.507  -4.317
  391    HB3  LYS  56           HB1      LYS  56   1.742  17.255  -4.513
  392    HG2  LYS  56           HG2      LYS  56   0.235  15.855  -6.709
  393    HG3  LYS  56           HG1      LYS  56   0.225  17.599  -6.433
  394    HD2  LYS  56           HD2      LYS  56   2.548  17.769  -6.892
  395    HD3  LYS  56           HD1      LYS  56   2.752  16.020  -6.853
  396    HE2  LYS  56           HE2      LYS  56   2.767  16.850  -9.134
  397    HE3  LYS  56           HE1      LYS  56   1.378  15.807  -8.846
  398    HZ1  LYS  56           HZ1      LYS  56   0.841  17.835 -10.107
  399    HZ2  LYS  56           HZ2      LYS  56   1.285  18.774  -8.772
  400    HZ3  LYS  56           HZ3      LYS  56  -0.028  17.715  -8.664
  401    H    ASN  57           HN       ASN  57   0.555  15.942  -2.513
  402    HA   ASN  57           HA       ASN  57   2.699  15.156  -0.673
  403    HB2  ASN  57           HB2      ASN  57   0.455  17.160  -0.389
  404    HB3  ASN  57           HB1      ASN  57   1.429  16.621   0.971
  405   HD21  ASN  57          HD21      ASN  57   1.121  19.270  -0.227
  406   HD22  ASN  57          HD22      ASN  57   2.716  19.782  -0.652
  407    H    GLU  58           HN       GLU  58   1.397  14.878   1.628
  408    HA   GLU  58           HA       GLU  58   0.380  12.302   1.502
  409    HB2  GLU  58           HB2      GLU  58   0.714  12.456   3.693
  410    HB3  GLU  58           HB1      GLU  58   1.006  14.176   3.497
  411    HG2  GLU  58           HG2      GLU  58  -1.348  14.620   3.769
  412    HG3  GLU  58           HG1      GLU  58  -1.650  12.898   3.988
  413    H    ASP  59           HN       ASP  59  -1.305  15.373   1.584
  414    HA   ASP  59           HA       ASP  59  -3.915  14.283   1.751
  415    HB2  ASP  59           HB2      ASP  59  -3.551  16.548   2.427
  416    HB3  ASP  59           HB1      ASP  59  -2.893  16.964   0.854
  417    H    GLY  60           HN       GLY  60  -1.759  15.012  -0.887
  418    HA2  GLY  60           HA2      GLY  60  -3.812  14.811  -2.896
  419    HA3  GLY  60           HA1      GLY  60  -2.093  15.001  -3.181
  420    H    ILE  61           HN       ILE  61  -1.500  12.646  -1.443
  421    HA   ILE  61           HA       ILE  61  -1.794  10.705  -3.538
  422    HB   ILE  61           HB       ILE  61   0.367  10.799  -2.576
  423   HG12  ILE  61          HG12      ILE  61   0.750   8.577  -1.878
  424   HG13  ILE  61          HG11      ILE  61  -0.900   8.389  -1.293
  425   HG21  ILE  61          HG21      ILE  61  -0.138  11.859  -0.465
  426   HG22  ILE  61          HG22      ILE  61   0.823  10.406  -0.200
  427   HG23  ILE  61          HG23      ILE  61  -0.906  10.386   0.119
  428   HD11  ILE  61          HD11      ILE  61  -1.762   8.282  -3.475
  429   HD12  ILE  61          HD12      ILE  61  -0.309   7.270  -3.500
  430   HD13  ILE  61          HD13      ILE  61  -0.265   8.892  -4.186
  431    H    VAL  62           HN       VAL  62  -2.489  10.738  -0.097
  432    HA   VAL  62           HA       VAL  62  -3.608   8.158  -0.070
  433    HB   VAL  62           HB       VAL  62  -3.907  10.417   1.911
  434   HG11  VAL  62          HG11      VAL  62  -4.316   7.463   2.314
  435   HG12  VAL  62          HG12      VAL  62  -5.613   8.663   2.188
  436   HG13  VAL  62          HG13      VAL  62  -4.464   8.730   3.534
  437   HG21  VAL  62          HG21      VAL  62  -1.828   9.979   2.514
  438   HG22  VAL  62          HG22      VAL  62  -1.699   8.894   1.120
  439   HG23  VAL  62          HG23      VAL  62  -2.219   8.264   2.693
  440    H    ASN  63           HN       ASN  63  -5.064  11.357  -0.112
  441    HA   ASN  63           HA       ASN  63  -7.742  10.468  -0.015
  442    HB2  ASN  63           HB2      ASN  63  -7.084  12.750   0.553
  443    HB3  ASN  63           HB1      ASN  63  -6.608  13.046  -1.112
  444   HD21  ASN  63          HD21      ASN  63  -9.296  12.567   1.053
  445   HD22  ASN  63          HD22      ASN  63 -10.513  13.182  -0.011
  446    H    SER  64           HN       SER  64  -5.438  10.673  -2.574
  447    HA   SER  64           HA       SER  64  -7.399  10.467  -4.691
  448    HB2  SER  64           HB2      SER  64  -5.105  11.587  -4.923
  449    HB3  SER  64           HB1      SER  64  -4.428   9.956  -4.961
  450    HG   SER  64           HG       SER  64  -5.398   9.569  -6.862
  451    H    LEU  65           HN       LEU  65  -5.648   8.389  -2.629
  452    HA   LEU  65           HA       LEU  65  -5.802   6.063  -4.339
  453    HB2  LEU  65           HB2      LEU  65  -4.839   6.488  -1.522
  454    HB3  LEU  65           HB1      LEU  65  -4.850   4.921  -2.310
  455    HG   LEU  65           HG       LEU  65  -3.328   7.309  -3.314
  456   HD11  LEU  65          HD11      LEU  65  -2.631   6.375  -1.060
  457   HD12  LEU  65          HD12      LEU  65  -1.403   6.396  -2.318
  458   HD13  LEU  65          HD13      LEU  65  -2.225   4.893  -1.925
  459   HD21  LEU  65          HD21      LEU  65  -2.146   5.568  -4.612
  460   HD22  LEU  65          HD22      LEU  65  -3.847   5.739  -5.051
  461   HD23  LEU  65          HD23      LEU  65  -3.330   4.397  -4.029
  462    H    ALA  66           HN       ALA  66  -6.772   4.074  -3.658
  463    HA   ALA  66           HA       ALA  66  -9.430   4.114  -3.007
  464    HB1  ALA  66           HB1      ALA  66  -8.090   2.152  -3.905
  465    HB2  ALA  66           HB2      ALA  66  -9.328   1.761  -2.697
  466    HB3  ALA  66           HB3      ALA  66  -7.625   1.837  -2.225
  467    H    LYS  67           HN       LYS  67 -10.644   3.760  -1.200
  468    HA   LYS  67           HA       LYS  67  -9.249   4.393   1.286
  469    HB2  LYS  67           HB2      LYS  67 -11.976   5.222   0.352
  470    HB3  LYS  67           HB1      LYS  67 -11.420   5.432   2.001
  471    HG2  LYS  67           HG2      LYS  67 -10.475   6.795  -0.489
  472    HG3  LYS  67           HG1      LYS  67 -11.022   7.505   1.032
  473    HD2  LYS  67           HD2      LYS  67  -8.963   6.296   2.043
  474    HD3  LYS  67           HD1      LYS  67  -8.403   6.214   0.370
  475    HE2  LYS  67           HE2      LYS  67  -7.475   8.155   1.541
  476    HE3  LYS  67           HE1      LYS  67  -8.529   8.645   0.209
  477    HZ1  LYS  67           HZ1      LYS  67  -8.913   9.952   2.217
  478    HZ2  LYS  67           HZ2      LYS  67  -9.317   8.551   3.069
  479    HZ3  LYS  67           HZ3      LYS  67 -10.292   9.070   1.792
  480    H    ASP  68           HN       ASP  68  -9.600   3.294   3.042
  481    HA   ASP  68           HA       ASP  68 -11.090   0.808   2.868
  482    HB2  ASP  68           HB2      ASP  68  -8.793   0.906   3.897
  483    HB3  ASP  68           HB1      ASP  68  -9.449   1.922   5.166
  484    H    LYS  69           HN       LYS  69 -12.885   0.361   4.174
  485    HA   LYS  69           HA       LYS  69 -14.496   2.688   4.551
  486    HB2  LYS  69           HB2      LYS  69 -15.502   0.818   3.484
  487    HB3  LYS  69           HB1      LYS  69 -15.059  -0.236   4.808
  488    HG2  LYS  69           HG2      LYS  69 -17.315   0.080   5.153
  489    HG3  LYS  69           HG1      LYS  69 -16.597   1.267   6.236
  490    HD2  LYS  69           HD2      LYS  69 -17.488   1.966   3.449
  491    HD3  LYS  69           HD1      LYS  69 -18.587   2.016   4.824
  492    HE2  LYS  69           HE2      LYS  69 -17.002   3.592   5.935
  493    HE3  LYS  69           HE1      LYS  69 -16.067   3.623   4.444
  494    HZ1  LYS  69           HZ1      LYS  69 -17.539   5.495   4.511
  495    HZ2  LYS  69           HZ2      LYS  69 -18.881   4.498   4.767
  496    HZ3  LYS  69           HZ3      LYS  69 -18.055   4.440   3.292
  497    H    SER  70           HN       SER  70 -13.306   0.126   6.713
  498    HA   SER  70           HA       SER  70 -14.575   1.587   8.925
  499    HB2  SER  70           HB2      SER  70 -14.365  -0.576  10.176
  500    HB3  SER  70           HB1      SER  70 -15.411  -0.647   8.759
  501    HG   SER  70           HG       SER  70 -13.619  -1.539   7.608
  502    H    GLY  71           HN       GLY  71 -11.491   0.393   7.786
  503    HA2  GLY  71           HA2      GLY  71  -9.371   0.619   8.653
  504    HA3  GLY  71           HA1      GLY  71 -10.027   1.734   9.845
  505    H    ASN  72           HN       ASN  72 -11.580  -1.282   9.598
  506    HA   ASN  72           HA       ASN  72 -11.425  -1.852  12.297
  507    HB2  ASN  72           HB2      ASN  72 -13.116  -2.817  10.841
  508    HB3  ASN  72           HB1      ASN  72 -11.890  -3.753   9.992
  509   HD21  ASN  72          HD21      ASN  72 -13.739  -3.430  12.915
  510   HD22  ASN  72          HD22      ASN  72 -13.383  -4.999  13.550
  511    H    SER  73           HN       SER  73  -9.313  -3.017   9.708
  512    HA   SER  73           HA       SER  73  -7.853  -4.640  11.645
  513    HB2  SER  73           HB2      SER  73  -8.530  -5.588   9.416
  514    HB3  SER  73           HB1      SER  73  -7.412  -4.458   8.657
  515    HG   SER  73           HG       SER  73  -5.719  -5.452   9.791
  516    H    SER  74           HN       SER  74  -7.818  -1.534  10.870
  517    HA   SER  74           HA       SER  74  -6.365   0.183  10.951
  518    HB2  SER  74           HB2      SER  74  -4.494  -1.904  12.073
  519    HB3  SER  74           HB1      SER  74  -4.178  -0.169  12.072
  520    HG   SER  74           HG       SER  74  -5.945  -1.667  13.615
  521    H    THR  75           HN       THR  75  -5.384   1.185   9.327
  522    HA   THR  75           HA       THR  75  -3.952  -0.497   7.376
  523    HB   THR  75           HB       THR  75  -6.274   0.297   6.718
  524    HG1  THR  75           HG1      THR  75  -5.496   1.002   4.601
  525   HG21  THR  75          HG21      THR  75  -5.994   2.572   7.706
  526   HG22  THR  75          HG22      THR  75  -6.564   2.572   6.038
  527   HG23  THR  75          HG23      THR  75  -4.874   2.947   6.390
  528    H    SER  76           HN       SER  76  -3.746   2.156   9.443
  529    HA   SER  76           HA       SER  76  -2.108   3.647   9.904
  530    HB2  SER  76           HB2      SER  76  -0.549   2.226   7.738
  531    HB3  SER  76           HB1      SER  76   0.116   3.411   8.860
  532    HG   SER  76           HG       SER  76   0.552   1.476   9.776
  533    H    ALA  77           HN       ALA  77  -2.570   3.201   6.411
  534    HA   ALA  77           HA       ALA  77  -2.025   5.928   5.737
  535    HB1  ALA  77           HB1      ALA  77  -1.874   4.073   4.117
  536    HB2  ALA  77           HB2      ALA  77  -2.945   5.374   3.571
  537    HB3  ALA  77           HB3      ALA  77  -3.625   3.873   4.224
  538    HA   PRO  78           HA       PRO  78  -5.635   7.572   7.674
  539    HB2  PRO  78           HB2      PRO  78  -5.140   9.691   5.646
  540    HB3  PRO  78           HB1      PRO  78  -5.447   9.862   7.374
  541    HG2  PRO  78           HG2      PRO  78  -2.995  10.138   6.473
  542    HG3  PRO  78           HG1      PRO  78  -3.283   9.152   7.915
  543    HD2  PRO  78           HD2      PRO  78  -2.765   8.270   5.118
  544    HD3  PRO  78           HD1      PRO  78  -2.132   7.607   6.637
  545    H    GLY  79           HN       GLY  79  -7.356   6.380   7.108
  546    HA2  GLY  79           HA2      GLY  79  -9.405   5.997   6.141
  547    HA3  GLY  79           HA1      GLY  79  -9.131   7.402   5.128
  548    H    SER  80           HN       SER  80  -6.524   5.385   4.617
  549    HA   SER  80           HA       SER  80  -7.696   4.733   2.003
  550    HB2  SER  80           HB2      SER  80  -5.133   5.658   2.958
  551    HB3  SER  80           HB1      SER  80  -4.987   4.274   1.886
  552    HG   SER  80           HG       SER  80  -6.565   5.569   0.530
  553    H    ALA  81           HN       ALA  81  -6.931   2.867   0.862
  554    HA   ALA  81           HA       ALA  81  -7.187   0.527   2.576
  555    HB1  ALA  81           HB1      ALA  81  -8.802   0.856   0.779
  556    HB2  ALA  81           HB2      ALA  81  -7.857  -0.618   0.515
  557    HB3  ALA  81           HB3      ALA  81  -7.495   0.846  -0.404
  558    H    HIS  82           HN       HIS  82  -4.585   1.647   2.612
  559    HA   HIS  82           HA       HIS  82  -3.164  -0.648   1.553
  560    HB2  HIS  82           HB2      HIS  82  -2.443   2.197   0.939
  561    HB3  HIS  82           HB1      HIS  82  -1.303   0.897   0.817
  562    HD1  HIS  82           HD1      HIS  82  -1.831  -0.908  -1.086
  563    HD2  HIS  82           HD2      HIS  82  -4.106   2.566  -1.187
  564    HE1  HIS  82           HE1      HIS  82  -2.847  -0.830  -3.382
  565    HE2  HIS  82           HE2      HIS  82  -4.377   1.165  -3.342
  566    H    GLN  83           HN       GLN  83  -1.937  -1.507   3.050
  567    HA   GLN  83           HA       GLN  83  -0.331   0.188   4.795
  568    HB2  GLN  83           HB2      GLN  83  -2.204  -0.343   6.251
  569    HB3  GLN  83           HB1      GLN  83  -2.119  -2.043   5.797
  570    HG2  GLN  83           HG2      GLN  83   0.106  -2.194   6.833
  571    HG3  GLN  83           HG1      GLN  83  -0.024  -0.508   7.324
  572   HE21  GLN  83          HE21      GLN  83  -1.319   0.042   9.030
  573   HE22  GLN  83          HE22      GLN  83  -2.020  -1.130  10.092
  574    H    ILE  84           HN       ILE  84   1.705  -0.509   4.607
  575    HA   ILE  84           HA       ILE  84   2.123  -3.012   3.262
  576    HB   ILE  84           HB       ILE  84   3.689  -0.552   3.773
  577   HG12  ILE  84          HG12      ILE  84   3.853  -1.743   1.188
  578   HG13  ILE  84          HG11      ILE  84   2.181  -1.761   1.719
  579   HG21  ILE  84          HG21      ILE  84   4.919  -3.141   2.826
  580   HG22  ILE  84          HG22      ILE  84   5.246  -2.352   4.368
  581   HG23  ILE  84          HG23      ILE  84   5.709  -1.564   2.860
  582   HD11  ILE  84          HD11      ILE  84   4.001   0.599   1.372
  583   HD12  ILE  84          HD12      ILE  84   2.461   0.692   2.226
  584   HD13  ILE  84          HD13      ILE  84   2.500   0.242   0.520
  585    H    ASP  85           HN       ASP  85   3.087  -4.760   4.042
  586    HA   ASP  85           HA       ASP  85   3.504  -4.932   6.921
  587    HB2  ASP  85           HB2      ASP  85   2.148  -6.656   5.596
  588    HB3  ASP  85           HB1      ASP  85   3.663  -7.146   4.861
  589    H    THR  86           HN       THR  86   5.443  -4.156   7.437
  590    HA   THR  86           HA       THR  86   7.698  -4.619   5.701
  591    HB   THR  86           HB       THR  86   8.869  -3.209   7.450
  592    HG1  THR  86           HG1      THR  86   7.721  -2.518   9.123
  593   HG21  THR  86          HG21      THR  86   7.971  -1.225   6.498
  594   HG22  THR  86          HG22      THR  86   6.412  -2.015   6.205
  595   HG23  THR  86          HG23      THR  86   7.840  -2.485   5.269
  596    H    THR  87           HN       THR  87   6.274  -6.123   8.335
  597    HA   THR  87           HA       THR  87   8.490  -7.419   9.481
  598    HB   THR  87           HB       THR  87   5.629  -8.343   9.156
  599    HG1  THR  87           HG1      THR  87   5.541  -6.609  10.458
  600   HG21  THR  87          HG21      THR  87   7.791  -9.367  10.987
  601   HG22  THR  87          HG22      THR  87   7.122 -10.216   9.596
  602   HG23  THR  87          HG23      THR  87   6.103  -9.881  10.996
  603    H    ASN  88           HN       ASN  88   6.239  -8.405   6.914
  604    HA   ASN  88           HA       ASN  88   8.055 -10.583   6.163
  605    HB2  ASN  88           HB2      ASN  88   5.203 -10.015   5.346
  606    HB3  ASN  88           HB1      ASN  88   6.142 -11.412   4.830
  607   HD21  ASN  88          HD21      ASN  88   4.537  -9.851   7.498
  608   HD22  ASN  88          HD22      ASN  88   4.491 -11.243   8.532
  609    H    HIS  89           HN       HIS  89   7.280  -7.459   5.282
  610    HA   HIS  89           HA       HIS  89   8.320  -6.101   3.785
  611    HB2  HIS  89           HB2      HIS  89   9.645  -8.673   2.965
  612    HB3  HIS  89           HB1      HIS  89   9.922  -7.172   2.097
  613    HD1  HIS  89           HD1      HIS  89  12.261  -8.530   3.501
  614    HD2  HIS  89           HD2      HIS  89   9.887  -5.607   5.265
  615    HE1  HIS  89           HE1      HIS  89  13.672  -7.519   5.323
  616    HE2  HIS  89           HE2      HIS  89  12.165  -5.859   6.470
  617    H    LYS  90           HN       LYS  90   5.761  -6.862   3.439
  618    HA   LYS  90           HA       LYS  90   5.480  -7.224   0.532
  619    HB2  LYS  90           HB2      LYS  90   4.052  -8.298   2.871
  620    HB3  LYS  90           HB1      LYS  90   3.040  -7.886   1.500
  621    HG2  LYS  90           HG2      LYS  90   4.311  -9.380   0.084
  622    HG3  LYS  90           HG1      LYS  90   5.455  -9.691   1.389
  623    HD2  LYS  90           HD2      LYS  90   2.536 -10.440   1.319
  624    HD3  LYS  90           HD1      LYS  90   3.916 -11.535   1.226
  625    HE2  LYS  90           HE2      LYS  90   4.602 -10.629   3.496
  626    HE3  LYS  90           HE1      LYS  90   3.009  -9.881   3.565
  627    HZ1  LYS  90           HZ1      LYS  90   3.530 -12.790   3.277
  628    HZ2  LYS  90           HZ2      LYS  90   2.004 -12.066   3.325
  629    HZ3  LYS  90           HZ3      LYS  90   3.006 -12.012   4.686
  630    H    LEU  91           HN       LEU  91   4.003  -6.009  -0.573
  631    HA   LEU  91           HA       LEU  91   3.052  -3.512   0.620
  632    HB2  LEU  91           HB2      LEU  91   4.082  -3.733  -1.746
  633    HB3  LEU  91           HB1      LEU  91   2.605  -4.527  -2.169
  634    HG   LEU  91           HG       LEU  91   2.185  -2.448  -2.965
  635   HD11  LEU  91          HD11      LEU  91   0.728  -1.167  -1.441
  636   HD12  LEU  91          HD12      LEU  91   1.233  -2.228  -0.116
  637   HD13  LEU  91          HD13      LEU  91   0.346  -2.888  -1.496
  638   HD21  LEU  91          HD21      LEU  91   3.619  -1.246  -0.636
  639   HD22  LEU  91          HD22      LEU  91   2.890  -0.362  -1.974
  640   HD23  LEU  91          HD23      LEU  91   4.244  -1.451  -2.269
  641    H    ILE  92           HN       ILE  92   1.310  -4.002   1.877
  642    HA   ILE  92           HA       ILE  92  -0.764  -5.729   0.812
  643    HB   ILE  92           HB       ILE  92  -0.042  -4.719   3.518
  644   HG12  ILE  92          HG12      ILE  92  -0.533  -7.222   3.983
  645   HG13  ILE  92          HG11      ILE  92  -0.542  -7.381   2.229
  646   HG21  ILE  92          HG21      ILE  92  -2.756  -5.855   2.818
  647   HG22  ILE  92          HG22      ILE  92  -2.424  -4.214   3.369
  648   HG23  ILE  92          HG23      ILE  92  -2.156  -5.581   4.452
  649   HD11  ILE  92          HD11      ILE  92   1.607  -7.944   3.234
  650   HD12  ILE  92          HD12      ILE  92   1.735  -6.288   3.825
  651   HD13  ILE  92          HD13      ILE  92   1.704  -6.603   2.094
  652    H    SER  93           HN       SER  93  -2.676  -5.009   0.231
  653    HA   SER  93           HA       SER  93  -3.343  -2.221   0.811
  654    HB2  SER  93           HB2      SER  93  -4.649  -3.910  -1.305
  655    HB3  SER  93           HB1      SER  93  -4.599  -2.154  -1.180
  656    HG   SER  93           HG       SER  93  -2.411  -3.883  -1.756
  657    H    THR  94           HN       THR  94  -4.726  -2.120   2.518
  658    HA   THR  94           HA       THR  94  -6.356  -4.480   3.074
  659    HB   THR  94           HB       THR  94  -5.778  -2.061   4.785
  660    HG1  THR  94           HG1      THR  94  -4.376  -4.267   4.331
  661   HG21  THR  94          HG21      THR  94  -7.236  -4.600   5.533
  662   HG22  THR  94          HG22      THR  94  -8.034  -3.072   5.169
  663   HG23  THR  94          HG23      THR  94  -6.959  -3.198   6.567
  664    H    PHE  95           HN       PHE  95  -8.197  -4.508   2.233
  665    HA   PHE  95           HA       PHE  95  -9.755  -2.044   1.909
  666    HB2  PHE  95           HB2      PHE  95  -9.166  -3.460  -0.102
  667    HB3  PHE  95           HB1      PHE  95 -10.123  -4.737   0.648
  668    HD1  PHE  95           HD1      PHE  95 -12.496  -4.743   0.516
  669    HD2  PHE  95           HD2      PHE  95 -10.278  -1.358  -0.822
  670    HE1  PHE  95           HE1      PHE  95 -14.527  -3.812  -0.511
  671    HE2  PHE  95           HE2      PHE  95 -12.309  -0.427  -1.845
  672    HZ   PHE  95           HZ       PHE  95 -14.435  -1.653  -1.690
  673    H    THR  96           HN       THR  96 -10.954  -2.008   3.919
  674    HA   THR  96           HA       THR  96 -12.142  -4.468   4.744
  675    HB   THR  96           HB       THR  96 -13.415  -3.135   6.397
  676    HG1  THR  96           HG1      THR  96 -11.857  -0.882   5.818
  677   HG21  THR  96          HG21      THR  96 -11.572  -2.724   7.800
  678   HG22  THR  96          HG22      THR  96 -10.503  -2.413   6.426
  679   HG23  THR  96          HG23      THR  96 -11.109  -4.057   6.734
  680    HA   PRO  97           HA       PRO  97 -15.355  -4.233   1.674
  681    HB2  PRO  97           HB2      PRO  97 -16.754  -6.276   3.020
  682    HB3  PRO  97           HB1      PRO  97 -15.703  -6.459   1.619
  683    HG2  PRO  97           HG2      PRO  97 -15.186  -7.040   4.450
  684    HG3  PRO  97           HG1      PRO  97 -14.395  -7.677   2.999
  685    HD2  PRO  97           HD2      PRO  97 -13.251  -5.877   4.699
  686    HD3  PRO  97           HD1      PRO  97 -12.822  -6.037   2.990
  687    H    SER  98           HN       SER  98 -17.711  -3.999   1.732
  688    HA   SER  98           HA       SER  98 -18.586  -2.000   3.436
  689    HB2  SER  98           HB2      SER  98 -20.896  -2.694   2.583
  690    HB3  SER  98           HB1      SER  98 -19.693  -2.284   1.361
  691    HG   SER  98           HG       SER  98 -20.986  -4.326   1.126
  692    H    ASN  99           HN       ASN  99 -18.361  -5.347   4.031
  693    HA   ASN  99           HA       ASN  99 -20.377  -5.440   6.101
  694    HB2  ASN  99           HB2      ASN  99 -18.425  -7.366   4.929
  695    HB3  ASN  99           HB1      ASN  99 -19.171  -7.721   6.475
  696   HD21  ASN  99          HD21      ASN  99 -20.293  -9.482   5.693
  697   HD22  ASN  99          HD22      ASN  99 -21.633  -9.332   4.611
  698    H    GLY 100           HN       GLY 100 -17.052  -4.670   5.876
  699    HA2  GLY 100           HA2      GLY 100 -15.609  -3.927   7.536
  700    HA3  GLY 100           HA1      GLY 100 -16.827  -4.336   8.736
  701    H    GLY 101           HN       GLY 101 -16.287  -6.781   6.538
  702    HA2  GLY 101           HA2      GLY 101 -15.113  -8.469   8.573
  703    HA3  GLY 101           HA1      GLY 101 -15.723  -8.983   7.008
  704    H    GLN 102           HN       GLN 102 -13.747 -10.291   7.040
  705    HA   GLN 102           HA       GLN 102 -11.159  -9.365   7.100
  706    HB2  GLN 102           HB2      GLN 102 -12.376 -11.607   5.498
  707    HB3  GLN 102           HB1      GLN 102 -10.648 -11.291   5.510
  708    HG2  GLN 102           HG2      GLN 102 -11.024 -13.000   7.085
  709    HG3  GLN 102           HG1      GLN 102 -10.728 -11.529   8.010
  710   HE21  GLN 102          HE21      GLN 102 -13.073 -13.888   7.049
  711   HE22  GLN 102          HE22      GLN 102 -14.292 -13.451   8.194
  712    H    ALA 103           HN       ALA 103  -9.766  -8.444   5.721
  713    HA   ALA 103           HA       ALA 103 -11.039  -6.770   3.709
  714    HB1  ALA 103           HB1      ALA 103  -8.955  -5.507   3.786
  715    HB2  ALA 103           HB2      ALA 103  -8.279  -6.698   4.907
  716    HB3  ALA 103           HB3      ALA 103  -9.673  -5.722   5.385
  717    H    THR 104           HN       THR 104 -10.254  -6.347   1.784
  718    HA   THR 104           HA       THR 104  -9.249  -8.618   0.299
  719    HB   THR 104           HB       THR 104 -10.773  -6.141  -0.197
  720    HG1  THR 104           HG1      THR 104 -11.189  -8.722  -0.270
  721   HG21  THR 104          HG21      THR 104 -10.409  -6.179  -2.623
  722   HG22  THR 104          HG22      THR 104  -9.146  -7.398  -2.412
  723   HG23  THR 104          HG23      THR 104  -8.932  -5.777  -1.746
  724    H    VAL 105           HN       VAL 105  -7.181  -8.728  -0.447
  725    HA   VAL 105           HA       VAL 105  -5.559  -6.320  -0.004
  726    HB   VAL 105           HB       VAL 105  -4.778  -9.140   0.748
  727   HG11  VAL 105          HG11      VAL 105  -2.733  -8.123   1.628
  728   HG12  VAL 105          HG12      VAL 105  -3.251  -6.556   1.008
  729   HG13  VAL 105          HG13      VAL 105  -2.884  -7.866  -0.111
  730   HG21  VAL 105          HG21      VAL 105  -5.328  -6.714   2.454
  731   HG22  VAL 105          HG22      VAL 105  -4.724  -8.264   3.039
  732   HG23  VAL 105          HG23      VAL 105  -6.345  -8.153   2.333
  733    H    LEU 106           HN       LEU 106  -4.776  -5.675  -1.806
  734    HA   LEU 106           HA       LEU 106  -3.693  -7.484  -3.800
  735    HB2  LEU 106           HB2      LEU 106  -4.076  -4.521  -3.585
  736    HB3  LEU 106           HB1      LEU 106  -2.896  -5.146  -4.721
  737    HG   LEU 106           HG       LEU 106  -4.870  -4.720  -5.935
  738   HD11  LEU 106          HD11      LEU 106  -3.748  -6.805  -6.516
  739   HD12  LEU 106          HD12      LEU 106  -5.488  -6.925  -6.780
  740   HD13  LEU 106          HD13      LEU 106  -4.757  -7.683  -5.368
  741   HD21  LEU 106          HD21      LEU 106  -7.072  -5.589  -5.348
  742   HD22  LEU 106          HD22      LEU 106  -6.434  -4.654  -4.000
  743   HD23  LEU 106          HD23      LEU 106  -6.405  -6.413  -3.941
  744    H    THR 107           HN       THR 107  -1.642  -8.213  -3.668
  745    HA   THR 107           HA       THR 107   0.070  -6.882  -1.672
  746    HB   THR 107           HB       THR 107   0.123  -9.838  -2.175
  747    HG1  THR 107           HG1      THR 107  -2.017  -9.017  -1.484
  748   HG21  THR 107          HG21      THR 107   2.017  -8.812  -0.962
  749   HG22  THR 107          HG22      THR 107   1.088  -9.902   0.066
  750   HG23  THR 107          HG23      THR 107   0.888  -8.157   0.226
  751    H    TYR 108           HN       TYR 108   2.224  -6.790  -1.988
  752    HA   TYR 108           HA       TYR 108   3.431  -8.004  -4.373
  753    HB2  TYR 108           HB2      TYR 108   3.213  -5.810  -5.172
  754    HB3  TYR 108           HB1      TYR 108   3.388  -5.112  -3.590
  755    HD1  TYR 108           HD1      TYR 108   5.373  -4.201  -2.921
  756    HD2  TYR 108           HD2      TYR 108   5.358  -6.859  -6.230
  757    HE1  TYR 108           HE1      TYR 108   7.701  -3.623  -3.359
  758    HE2  TYR 108           HE2      TYR 108   7.714  -6.311  -6.682
  759    HH   TYR 108           HH       TYR 108   9.309  -4.536  -6.257
  760    H    ASP 109           HN       ASP 109   5.623  -8.632  -4.007
  761    HA   ASP 109           HA       ASP 109   6.483  -8.315  -1.211
  762    HB2  ASP 109           HB2      ASP 109   6.074 -10.668  -2.244
  763    HB3  ASP 109           HB1      ASP 109   7.612 -10.395  -3.060
  764    H    TRP 110           HN       TRP 110   8.062  -6.932  -0.908
  765    HA   TRP 110           HA       TRP 110   9.530  -5.874  -3.142
  766    HB2  TRP 110           HB2      TRP 110   9.065  -4.160  -1.696
  767    HB3  TRP 110           HB1      TRP 110   9.195  -5.173  -0.269
  768    HD1  TRP 110           HD1      TRP 110  11.591  -3.524  -2.864
  769    HE1  TRP 110           HE1      TRP 110  13.753  -2.869  -1.610
  770    HE3  TRP 110           HE3      TRP 110  10.465  -5.391   1.751
  771    HZ2  TRP 110           HZ2      TRP 110  14.825  -3.129   0.977
  772    HZ3  TRP 110           HZ3      TRP 110  12.109  -5.146   3.559
  773    HH2  TRP 110           HH2      TRP 110  14.246  -4.037   3.185
  774    H    SER 111           HN       SER 111  10.129  -8.145  -0.560
  775    HA   SER 111           HA       SER 111  12.971  -8.170  -1.121
  776    HB2  SER 111           HB2      SER 111  11.260  -9.544   0.915
  777    HB3  SER 111           HB1      SER 111  12.972  -9.871   0.734
  778    HG   SER 111           HG       SER 111  12.926  -7.335   0.836
  779    H    ALA 112           HN       ALA 112  10.132 -10.210  -1.404
  780    HA   ALA 112           HA       ALA 112   9.722 -12.185  -2.424
  781    HB1  ALA 112           HB1      ALA 112  10.285 -12.217  -4.746
  782    HB2  ALA 112           HB2      ALA 112  11.560 -11.027  -4.490
  783    HB3  ALA 112           HB3      ALA 112   9.873 -10.573  -4.256
  784    H    ASN 113           HN       ASN 113  10.719 -13.561  -0.954
  785    HA   ASN 113           HA       ASN 113  13.468 -14.352  -1.330
  786    HB2  ASN 113           HB2      ASN 113  12.218 -14.265   0.912
  787    HB3  ASN 113           HB1      ASN 113  11.447 -15.765   0.407
  788   HD21  ASN 113          HD21      ASN 113  14.412 -14.247   1.370
  789   HD22  ASN 113          HD22      ASN 113  15.309 -15.701   1.648
  790    H    GLY 114           HN       GLY 114  13.032 -14.887  -3.601
  791    HA2  GLY 114           HA2      GLY 114  13.377 -17.357  -4.407
  792    HA3  GLY 114           HA1      GLY 114  11.659 -17.438  -4.031
  793    H    VAL 115           HN       VAL 115  10.224 -15.975  -5.161
  794    HA   VAL 115           HA       VAL 115  11.294 -15.042  -7.742
  795    HB   VAL 115           HB       VAL 115   8.544 -16.242  -7.325
  796   HG11  VAL 115          HG11      VAL 115   9.947 -15.497  -9.888
  797   HG12  VAL 115          HG12      VAL 115   8.756 -14.481  -9.079
  798   HG13  VAL 115          HG13      VAL 115   8.285 -16.065  -9.707
  799   HG21  VAL 115          HG21      VAL 115   9.353 -18.119  -8.698
  800   HG22  VAL 115          HG22      VAL 115  10.215 -17.988  -7.164
  801   HG23  VAL 115          HG23      VAL 115  10.975 -17.430  -8.655
  802    H    ASN 116           HN       ASN 116  10.322 -13.150  -8.551
  803    HA   ASN 116           HA       ASN 116   9.263 -11.459  -6.449
  804    HB2  ASN 116           HB2      ASN 116  11.113 -10.747  -8.010
  805    HB3  ASN 116           HB1      ASN 116   9.918 -10.714  -9.300
  806   HD21  ASN 116          HD21      ASN 116  10.999  -9.216  -6.355
  807   HD22  ASN 116          HD22      ASN 116  10.091  -7.755  -6.528
  808    H    SER 117           HN       SER 117   7.390 -10.042  -6.887
  809    HA   SER 117           HA       SER 117   5.111 -11.431  -7.674
  810    HB2  SER 117           HB2      SER 117   5.103  -9.430  -6.206
  811    HB3  SER 117           HB1      SER 117   5.498  -8.432  -7.601
  812    HG   SER 117           HG       SER 117   3.523  -8.844  -8.473
  813    H    ASN 118           HN       ASN 118   7.053  -9.081  -9.411
  814    HA   ASN 118           HA       ASN 118   7.308  -8.555 -11.594
  815    HB2  ASN 118           HB2      ASN 118   7.601 -11.029 -11.847
  816    HB3  ASN 118           HB1      ASN 118   5.880 -11.155 -12.193
  817   HD21  ASN 118          HD21      ASN 118   8.974 -10.126 -13.362
  818   HD22  ASN 118          HD22      ASN 118   8.493  -9.879 -15.010
  Start of MODEL    9
    1    H1   HIS   6           HT1      HIS   6 -19.921  -7.229  -3.980
    2    H2   HIS   6           HT2      HIS   6 -21.357  -6.867  -4.787
    3    H3   HIS   6           HT3      HIS   6 -20.434  -5.625  -4.111
    4    HA   HIS   6           HA       HIS   6 -19.627  -7.369  -6.362
    5    HB2  HIS   6           HB2      HIS   6 -21.370  -5.682  -6.916
    6    HB3  HIS   6           HB1      HIS   6 -20.313  -4.416  -6.314
    7    HD1  HIS   6           HD1      HIS   6 -20.870  -6.658  -9.239
    8    HD2  HIS   6           HD2      HIS   6 -18.178  -3.730  -8.033
    9    HE1  HIS   6           HE1      HIS   6 -19.610  -6.004 -11.309
   10    HE2  HIS   6           HE2      HIS   6 -18.060  -4.158 -10.584
   11    H    GLN   7           HN       GLN   7 -18.588  -5.656  -3.658
   12    HA   GLN   7           HA       GLN   7 -16.372  -4.294  -4.787
   13    HB2  GLN   7           HB2      GLN   7 -17.446  -3.640  -2.662
   14    HB3  GLN   7           HB1      GLN   7 -16.766  -5.076  -1.919
   15    HG2  GLN   7           HG2      GLN   7 -15.298  -3.360  -1.322
   16    HG3  GLN   7           HG1      GLN   7 -14.497  -4.187  -2.664
   17   HE21  GLN   7          HE21      GLN   7 -13.297  -2.365  -3.185
   18   HE22  GLN   7          HE22      GLN   7 -13.999  -0.989  -3.964
   19    H    ASP   8           HN       ASP   8 -16.842  -7.559  -3.775
   20    HA   ASP   8           HA       ASP   8 -14.166  -8.187  -3.162
   21    HB2  ASP   8           HB2      ASP   8 -15.988  -9.665  -2.552
   22    HB3  ASP   8           HB1      ASP   8 -16.374  -9.941  -4.245
   23    H    ASN   9           HN       ASN   9 -15.910  -7.947  -6.177
   24    HA   ASN   9           HA       ASN   9 -13.608  -8.714  -7.760
   25    HB2  ASN   9           HB2      ASN   9 -16.299  -7.542  -8.474
   26    HB3  ASN   9           HB1      ASN   9 -15.041  -7.850  -9.665
   27   HD21  ASN   9          HD21      ASN   9 -17.731  -9.000  -9.363
   28   HD22  ASN   9          HD22      ASN   9 -17.493 -10.710  -9.278
   29    H    ALA  10           HN       ALA  10 -15.215  -5.831  -6.648
   30    HA   ALA  10           HA       ALA  10 -13.937  -3.970  -8.348
   31    HB1  ALA  10           HB1      ALA  10 -14.988  -3.434  -5.577
   32    HB2  ALA  10           HB2      ALA  10 -15.997  -3.510  -7.026
   33    HB3  ALA  10           HB3      ALA  10 -14.743  -2.271  -6.883
   34    H    ARG  11           HN       ARG  11 -13.188  -5.115  -5.082
   35    HA   ARG  11           HA       ARG  11 -11.170  -3.347  -4.439
   36    HB2  ARG  11           HB2      ARG  11 -10.315  -5.028  -2.914
   37    HB3  ARG  11           HB1      ARG  11 -12.065  -4.949  -2.832
   38    HG2  ARG  11           HG2      ARG  11 -11.823  -7.209  -2.867
   39    HG3  ARG  11           HG1      ARG  11 -11.867  -6.909  -4.601
   40    HD2  ARG  11           HD2      ARG  11  -9.470  -7.023  -4.747
   41    HD3  ARG  11           HD1      ARG  11  -9.325  -7.145  -2.999
   42    HE   ARG  11           HE       ARG  11 -10.923  -9.257  -3.969
   43   HH11  ARG  11          HH11      ARG  11  -7.585  -8.194  -3.875
   44   HH12  ARG  11          HH12      ARG  11  -6.933  -9.797  -3.947
   45   HH21  ARG  11          HH21      ARG  11 -10.066 -11.376  -4.054
   46   HH22  ARG  11          HH22      ARG  11  -8.348 -11.611  -4.063
   47    H    LYS  12           HN       LYS  12 -11.061  -6.250  -6.344
   48    HA   LYS  12           HA       LYS  12  -8.307  -6.483  -6.614
   49    HB2  LYS  12           HB2      LYS  12  -9.945  -8.216  -7.292
   50    HB3  LYS  12           HB1      LYS  12 -10.428  -7.193  -8.646
   51    HG2  LYS  12           HG2      LYS  12  -8.954  -8.574  -9.670
   52    HG3  LYS  12           HG1      LYS  12  -7.858  -7.293  -9.172
   53    HD2  LYS  12           HD2      LYS  12  -7.400  -8.630  -7.103
   54    HD3  LYS  12           HD1      LYS  12  -8.319  -9.948  -7.835
   55    HE2  LYS  12           HE2      LYS  12  -6.786  -9.760  -9.813
   56    HE3  LYS  12           HE1      LYS  12  -5.817  -8.663  -8.840
   57    HZ1  LYS  12           HZ1      LYS  12  -4.966 -10.928  -8.759
   58    HZ2  LYS  12           HZ2      LYS  12  -6.442 -11.480  -8.147
   59    HZ3  LYS  12           HZ3      LYS  12  -5.488 -10.429  -7.231
   60    H    SER  13           HN       SER  13 -10.693  -4.635  -8.428
   61    HA   SER  13           HA       SER  13  -8.669  -3.777 -10.327
   62    HB2  SER  13           HB2      SER  13 -11.634  -3.218 -10.061
   63    HB3  SER  13           HB1      SER  13 -10.627  -2.614 -11.388
   64    HG   SER  13           HG       SER  13 -10.773  -5.367 -10.733
   65    H    ARG  14           HN       ARG  14 -10.745  -2.309  -7.850
   66    HA   ARG  14           HA       ARG  14  -9.946   0.346  -8.359
   67    HB2  ARG  14           HB2      ARG  14 -11.021   0.898  -6.220
   68    HB3  ARG  14           HB1      ARG  14 -12.042  -0.171  -7.175
   69    HG2  ARG  14           HG2      ARG  14 -12.155  -1.582  -5.460
   70    HG3  ARG  14           HG1      ARG  14 -10.402  -1.787  -5.541
   71    HD2  ARG  14           HD2      ARG  14 -11.310  -1.068  -3.316
   72    HD3  ARG  14           HD1      ARG  14 -10.031  -0.057  -3.965
   73    HE   ARG  14           HE       ARG  14 -12.476   1.032  -4.775
   74   HH11  ARG  14          HH11      ARG  14 -10.700   0.503  -1.813
   75   HH12  ARG  14          HH12      ARG  14 -11.490   1.788  -0.954
   76   HH21  ARG  14          HH21      ARG  14 -13.516   2.728  -3.663
   77   HH22  ARG  14          HH22      ARG  14 -13.082   3.070  -2.019
   78    H    ILE  15           HN       ILE  15  -8.649  -2.144  -6.271
   79    HA   ILE  15           HA       ILE  15  -6.847  -0.278  -5.006
   80    HB   ILE  15           HB       ILE  15  -6.833  -3.291  -4.965
   81   HG12  ILE  15          HG12      ILE  15  -7.818  -1.409  -2.811
   82   HG13  ILE  15          HG11      ILE  15  -8.891  -2.133  -4.008
   83   HG21  ILE  15          HG21      ILE  15  -5.406  -3.014  -2.988
   84   HG22  ILE  15          HG22      ILE  15  -5.454  -1.259  -3.203
   85   HG23  ILE  15          HG23      ILE  15  -4.674  -2.276  -4.417
   86   HD11  ILE  15          HD11      ILE  15  -8.392  -4.323  -3.239
   87   HD12  ILE  15          HD12      ILE  15  -8.814  -3.320  -1.834
   88   HD13  ILE  15          HD13      ILE  15  -7.122  -3.707  -2.170
   89    H    GLN  16           HN       GLN  16  -6.710  -2.915  -7.359
   90    HA   GLN  16           HA       GLN  16  -4.008  -3.214  -7.678
   91    HB2  GLN  16           HB2      GLN  16  -6.258  -4.143  -8.908
   92    HB3  GLN  16           HB1      GLN  16  -5.436  -3.288 -10.202
   93    HG2  GLN  16           HG2      GLN  16  -4.086  -5.320  -8.470
   94    HG3  GLN  16           HG1      GLN  16  -4.924  -5.738  -9.962
   95   HE21  GLN  16          HE21      GLN  16  -2.157  -6.098  -9.289
   96   HE22  GLN  16          HE22      GLN  16  -1.251  -5.231 -10.477
   97    H    SER  17           HN       SER  17  -6.108  -0.887  -9.337
   98    HA   SER  17           HA       SER  17  -4.279   0.062 -11.186
   99    HB2  SER  17           HB2      SER  17  -6.394   1.681  -9.753
  100    HB3  SER  17           HB1      SER  17  -5.666   2.064 -11.313
  101    HG   SER  17           HG       SER  17  -7.709   0.363 -10.724
  102    H    GLU  18           HN       GLU  18  -4.858   1.210  -7.897
  103    HA   GLU  18           HA       GLU  18  -2.607   3.013  -8.071
  104    HB2  GLU  18           HB2      GLU  18  -4.277   2.457  -5.650
  105    HB3  GLU  18           HB1      GLU  18  -3.304   3.875  -6.003
  106    HG2  GLU  18           HG2      GLU  18  -5.569   3.086  -7.755
  107    HG3  GLU  18           HG1      GLU  18  -5.826   4.029  -6.282
  108    H    HIS  19           HN       HIS  19  -3.364  -0.109  -6.722
  109    HA   HIS  19           HA       HIS  19  -1.456  -0.415  -4.746
  110    HB2  HIS  19           HB2      HIS  19  -2.749  -2.293  -4.777
  111    HB3  HIS  19           HB1      HIS  19  -2.972  -2.253  -6.512
  112    HD1  HIS  19           HD1      HIS  19  -0.276  -3.286  -4.008
  113    HD2  HIS  19           HD2      HIS  19  -1.681  -4.230  -7.801
  114    HE1  HIS  19           HE1      HIS  19   1.044  -5.291  -4.734
  115    HE2  HIS  19           HE2      HIS  19   0.070  -5.938  -6.962
  116    H    ARG  20           HN       ARG  20  -1.053  -1.021  -8.225
  117    HA   ARG  20           HA       ARG  20   1.651  -1.755  -8.152
  118    HB2  ARG  20           HB2      ARG  20   0.196  -0.231 -10.328
  119    HB3  ARG  20           HB1      ARG  20   1.670  -1.171 -10.525
  120    HG2  ARG  20           HG2      ARG  20  -0.439  -2.767  -9.353
  121    HG3  ARG  20           HG1      ARG  20  -0.945  -2.046 -10.886
  122    HD2  ARG  20           HD2      ARG  20   0.160  -4.316 -11.025
  123    HD3  ARG  20           HD1      ARG  20   0.837  -3.065 -12.058
  124    HE   ARG  20           HE       ARG  20   2.436  -2.884  -9.937
  125   HH11  ARG  20          HH11      ARG  20   1.294  -5.691 -11.678
  126   HH12  ARG  20          HH12      ARG  20   2.728  -6.616 -11.382
  127   HH21  ARG  20          HH21      ARG  20   4.336  -4.090  -9.558
  128   HH22  ARG  20          HH22      ARG  20   4.465  -5.705 -10.178
  129    H    GLU  21           HN       GLU  21   0.089   1.362  -8.237
  130    HA   GLU  21           HA       GLU  21   2.342   2.995  -8.671
  131    HB2  GLU  21           HB2      GLU  21  -0.082   3.776  -7.069
  132    HB3  GLU  21           HB1      GLU  21   0.903   4.789  -8.109
  133    HG2  GLU  21           HG2      GLU  21  -0.878   2.554  -9.043
  134    HG3  GLU  21           HG1      GLU  21  -1.316   4.264  -9.070
  135    H    LEU  22           HN       LEU  22   0.676   2.018  -5.692
  136    HA   LEU  22           HA       LEU  22   2.309   3.390  -3.893
  137    HB2  LEU  22           HB2      LEU  22   0.678   0.890  -3.573
  138    HB3  LEU  22           HB1      LEU  22   1.671   1.499  -2.265
  139    HG   LEU  22           HG       LEU  22  -0.390   2.384  -1.747
  140   HD11  LEU  22          HD11      LEU  22  -0.246   4.754  -2.142
  141   HD12  LEU  22          HD12      LEU  22   0.783   4.516  -3.552
  142   HD13  LEU  22          HD13      LEU  22   1.387   4.126  -1.937
  143   HD21  LEU  22          HD21      LEU  22  -0.841   3.112  -4.629
  144   HD22  LEU  22          HD22      LEU  22  -1.989   3.220  -3.293
  145   HD23  LEU  22          HD23      LEU  22  -1.446   1.642  -3.861
  146    H    VAL  23           HN       VAL  23   2.770   0.209  -5.378
  147    HA   VAL  23           HA       VAL  23   5.075  -0.286  -3.755
  148    HB   VAL  23           HB       VAL  23   4.740  -2.360  -4.316
  149   HG11  VAL  23          HG11      VAL  23   2.929  -3.111  -5.699
  150   HG12  VAL  23          HG12      VAL  23   2.828  -1.534  -6.482
  151   HG13  VAL  23          HG13      VAL  23   2.395  -1.697  -4.781
  152   HG21  VAL  23          HG21      VAL  23   6.455  -2.108  -5.926
  153   HG22  VAL  23          HG22      VAL  23   5.304  -1.485  -7.117
  154   HG23  VAL  23          HG23      VAL  23   5.210  -3.170  -6.596
  155    H    SER  24           HN       SER  24   4.433   0.903  -6.999
  156    HA   SER  24           HA       SER  24   7.040   1.232  -7.915
  157    HB2  SER  24           HB2      SER  24   4.921   1.783  -9.169
  158    HB3  SER  24           HB1      SER  24   4.795   3.250  -8.196
  159    HG   SER  24           HG       SER  24   6.543   4.079  -9.174
  160    H    ALA  25           HN       ALA  25   5.221   2.890  -5.472
  161    HA   ALA  25           HA       ALA  25   7.226   4.974  -5.082
  162    HB1  ALA  25           HB1      ALA  25   4.886   4.295  -3.308
  163    HB2  ALA  25           HB2      ALA  25   4.754   5.345  -4.728
  164    HB3  ALA  25           HB3      ALA  25   5.794   5.811  -3.360
  165    H    ILE  26           HN       ILE  26   6.263   1.894  -3.584
  166    HA   ILE  26           HA       ILE  26   7.831   2.121  -1.294
  167    HB   ILE  26           HB       ILE  26   6.463  -0.070  -2.670
  168   HG12  ILE  26          HG12      ILE  26   7.128   0.661   0.166
  169   HG13  ILE  26          HG11      ILE  26   5.581   0.821  -0.664
  170   HG21  ILE  26          HG21      ILE  26   8.929  -0.764  -1.092
  171   HG22  ILE  26          HG22      ILE  26   8.732  -0.993  -2.830
  172   HG23  ILE  26          HG23      ILE  26   7.726  -1.901  -1.697
  173   HD11  ILE  26          HD11      ILE  26   5.321  -1.532  -0.755
  174   HD12  ILE  26          HD12      ILE  26   5.679  -1.062   0.917
  175   HD13  ILE  26          HD13      ILE  26   6.933  -1.790  -0.095
  176    H    GLN  27           HN       GLN  27   8.582   0.837  -4.490
  177    HA   GLN  27           HA       GLN  27  11.194  -0.002  -3.935
  178    HB2  GLN  27           HB2      GLN  27  10.004   1.007  -6.538
  179    HB3  GLN  27           HB1      GLN  27  11.493   0.075  -6.397
  180    HG2  GLN  27           HG2      GLN  27  10.211  -1.789  -5.477
  181    HG3  GLN  27           HG1      GLN  27   8.738  -0.848  -5.628
  182   HE21  GLN  27          HE21      GLN  27   7.852  -0.503  -7.649
  183   HE22  GLN  27          HE22      GLN  27   8.329  -1.410  -9.041
  184    H    SER  28           HN       SER  28   9.808   3.069  -4.687
  185    HA   SER  28           HA       SER  28  12.232   4.503  -5.114
  186    HB2  SER  28           HB2      SER  28   9.398   5.353  -4.495
  187    HB3  SER  28           HB1      SER  28  10.673   6.460  -4.972
  188    HG   SER  28           HG       SER  28   9.253   4.605  -6.478
  189    H    TYR  29           HN       TYR  29   9.905   4.277  -2.433
  190    HA   TYR  29           HA       TYR  29  11.191   5.905  -0.561
  191    HB2  TYR  29           HB2      TYR  29   8.851   5.020  -0.465
  192    HB3  TYR  29           HB1      TYR  29   9.502   3.441  -0.062
  193    HD1  TYR  29           HD1      TYR  29   7.470   4.578   1.724
  194    HD2  TYR  29           HD2      TYR  29  11.679   5.251   1.642
  195    HE1  TYR  29           HE1      TYR  29   7.435   5.189   4.101
  196    HE2  TYR  29           HE2      TYR  29  11.638   5.887   4.023
  197    HH   TYR  29           HH       TYR  29   9.013   5.251   6.033
  198    H    ILE  30           HN       ILE  30  11.239   2.365  -0.870
  199    HA   ILE  30           HA       ILE  30  12.916   1.899   1.318
  200    HB   ILE  30           HB       ILE  30  12.399   0.208  -1.120
  201   HG12  ILE  30          HG12      ILE  30  11.128   0.332   1.615
  202   HG13  ILE  30          HG11      ILE  30  10.382   0.750   0.078
  203   HG21  ILE  30          HG21      ILE  30  14.415  -0.537  -0.056
  204   HG22  ILE  30          HG22      ILE  30  13.116  -1.676   0.306
  205   HG23  ILE  30          HG23      ILE  30  13.635  -0.509   1.526
  206   HD11  ILE  30          HD11      ILE  30  11.236  -1.982   0.967
  207   HD12  ILE  30          HD12      ILE  30  10.576  -1.582  -0.623
  208   HD13  ILE  30          HD13      ILE  30   9.586  -1.370   0.831
  209    H    GLY  31           HN       GLY  31  13.668   2.311  -2.116
  210    HA2  GLY  31           HA2      GLY  31  16.410   1.566  -1.835
  211    HA3  GLY  31           HA1      GLY  31  15.697   2.402  -3.215
  212    H    ALA  32           HN       ALA  32  14.694   4.273  -0.885
  213    HA   ALA  32           HA       ALA  32  16.984   6.092  -1.038
  214    HB1  ALA  32           HB1      ALA  32  15.421   7.812  -0.388
  215    HB2  ALA  32           HB2      ALA  32  14.179   6.600  -0.069
  216    HB3  ALA  32           HB3      ALA  32  14.733   6.882  -1.722
  217    H    GLN  33           HN       GLN  33  15.200   4.092   1.114
  218    HA   GLN  33           HA       GLN  33  15.451   5.396   3.503
  219    HB2  GLN  33           HB2      GLN  33  15.118   2.574   2.692
  220    HB3  GLN  33           HB1      GLN  33  15.394   2.969   4.389
  221    HG2  GLN  33           HG2      GLN  33  13.367   4.490   2.876
  222    HG3  GLN  33           HG1      GLN  33  12.993   2.866   3.403
  223   HE21  GLN  33          HE21      GLN  33  11.503   3.433   4.995
  224   HE22  GLN  33          HE22      GLN  33  11.918   4.334   6.412
  225    H    ASP  34           HN       ASP  34  16.642   4.818   5.361
  226    HA   ASP  34           HA       ASP  34  19.452   4.795   5.002
  227    HB2  ASP  34           HB2      ASP  34  18.100   5.848   6.895
  228    HB3  ASP  34           HB1      ASP  34  17.996   4.228   7.564
  229    H    ASP  35           HN       ASP  35  17.037   2.455   5.709
  230    HA   ASP  35           HA       ASP  35  18.982   0.331   5.207
  231    HB2  ASP  35           HB2      ASP  35  16.943  -0.607   7.018
  232    HB3  ASP  35           HB1      ASP  35  18.682  -0.776   7.140
  233    HA   PRO  36           HA       PRO  36  15.392  -0.205   2.484
  234    HB2  PRO  36           HB2      PRO  36  16.673  -1.430   0.515
  235    HB3  PRO  36           HB1      PRO  36  16.944   0.284   0.814
  236    HG2  PRO  36           HG2      PRO  36  18.570  -2.037   1.818
  237    HG3  PRO  36           HG1      PRO  36  19.136  -0.644   0.883
  238    HD2  PRO  36           HD2      PRO  36  19.341  -0.650   3.533
  239    HD3  PRO  36           HD1      PRO  36  18.853   0.826   2.674
  240    H    THR  37           HN       THR  37  17.394  -2.246   4.136
  241    HA   THR  37           HA       THR  37  16.520  -4.766   3.195
  242    HB   THR  37           HB       THR  37  17.901  -5.669   4.955
  243    HG1  THR  37           HG1      THR  37  18.783  -4.069   6.516
  244   HG21  THR  37          HG21      THR  37  19.997  -4.407   4.601
  245   HG22  THR  37          HG22      THR  37  19.060  -3.080   3.901
  246   HG23  THR  37          HG23      THR  37  19.114  -4.651   3.092
  247    H    ASN  38           HN       ASN  38  15.607  -2.645   5.750
  248    HA   ASN  38           HA       ASN  38  12.996  -3.741   5.860
  249    HB2  ASN  38           HB2      ASN  38  14.168  -5.315   7.267
  250    HB3  ASN  38           HB1      ASN  38  14.767  -4.017   8.291
  251   HD21  ASN  38          HD21      ASN  38  12.062  -5.999   7.440
  252   HD22  ASN  38          HD22      ASN  38  11.036  -5.522   8.746
  253    HA   PRO  39           HA       PRO  39  13.621   0.800   6.599
  254    HB2  PRO  39           HB2      PRO  39  11.554   1.446   4.902
  255    HB3  PRO  39           HB1      PRO  39  13.258   1.369   4.446
  256    HG2  PRO  39           HG2      PRO  39  11.108  -0.651   4.057
  257    HG3  PRO  39           HG1      PRO  39  12.424  -0.183   2.981
  258    HD2  PRO  39           HD2      PRO  39  12.506  -2.430   4.404
  259    HD3  PRO  39           HD1      PRO  39  13.963  -1.492   4.065
  260    H    SER  40           HN       SER  40  11.892   2.402   7.135
  261    HA   SER  40           HA       SER  40  10.255   1.727   9.249
  262    HB2  SER  40           HB2      SER  40   9.548   3.882   7.260
  263    HB3  SER  40           HB1      SER  40   9.332   3.897   9.010
  264    HG   SER  40           HG       SER  40  11.766   3.732   9.010
  265    H    GLU  41           HN       GLU  41   7.960   1.479   9.420
  266    HA   GLU  41           HA       GLU  41   6.807  -0.173   7.438
  267    HB2  GLU  41           HB2      GLU  41   5.916  -0.674   9.446
  268    HB3  GLU  41           HB1      GLU  41   5.959   0.988  10.013
  269    HG2  GLU  41           HG2      GLU  41   4.023   1.516   8.720
  270    HG3  GLU  41           HG1      GLU  41   3.976  -0.100   8.030
  271    H    ILE  42           HN       ILE  42   6.338   0.449   5.616
  272    HA   ILE  42           HA       ILE  42   6.160   3.172   4.897
  273    HB   ILE  42           HB       ILE  42   5.968   0.594   3.385
  274   HG12  ILE  42          HG12      ILE  42   8.059   2.716   3.803
  275   HG13  ILE  42          HG11      ILE  42   8.162   0.996   4.149
  276   HG21  ILE  42          HG21      ILE  42   5.987   3.373   2.239
  277   HG22  ILE  42          HG22      ILE  42   4.593   2.300   2.287
  278   HG23  ILE  42          HG23      ILE  42   6.010   1.859   1.336
  279   HD11  ILE  42          HD11      ILE  42   9.486   1.629   2.223
  280   HD12  ILE  42          HD12      ILE  42   8.029   2.225   1.425
  281   HD13  ILE  42          HD13      ILE  42   8.199   0.503   1.788
  282    H    THR  43           HN       THR  43   4.433   4.394   4.544
  283    HA   THR  43           HA       THR  43   1.846   3.070   4.143
  284    HB   THR  43           HB       THR  43   0.723   4.791   5.474
  285    HG1  THR  43           HG1      THR  43   2.005   6.216   6.739
  286   HG21  THR  43          HG21      THR  43   2.942   3.378   6.977
  287   HG22  THR  43          HG22      THR  43   1.354   2.710   6.595
  288   HG23  THR  43          HG23      THR  43   1.492   4.070   7.710
  289    H    LEU  44           HN       LEU  44   0.212   4.655   3.348
  290    HA   LEU  44           HA       LEU  44   1.091   5.645   0.883
  291    HB2  LEU  44           HB2      LEU  44  -1.418   6.342   2.340
  292    HB3  LEU  44           HB1      LEU  44  -1.152   6.399   0.621
  293    HG   LEU  44           HG       LEU  44  -1.441   4.008   2.375
  294   HD11  LEU  44          HD11      LEU  44  -3.307   5.379   1.061
  295   HD12  LEU  44          HD12      LEU  44  -3.383   3.643   1.343
  296   HD13  LEU  44          HD13      LEU  44  -2.812   4.255  -0.206
  297   HD21  LEU  44          HD21      LEU  44  -0.961   2.748   0.190
  298   HD22  LEU  44          HD22      LEU  44   0.406   3.390   1.093
  299   HD23  LEU  44          HD23      LEU  44  -0.187   4.239  -0.332
  300    H    ALA  45           HN       ALA  45   0.356   7.121   3.925
  301    HA   ALA  45           HA       ALA  45   0.533   9.814   3.138
  302    HB1  ALA  45           HB1      ALA  45  -0.620   9.113   5.145
  303    HB2  ALA  45           HB2      ALA  45   0.684  10.234   5.566
  304    HB3  ALA  45           HB3      ALA  45   0.900   8.497   5.825
  305    H    LYS  46           HN       LYS  46   2.899   7.409   3.898
  306    HA   LYS  46           HA       LYS  46   5.114   9.266   4.079
  307    HB2  LYS  46           HB2      LYS  46   4.931   6.281   4.058
  308    HB3  LYS  46           HB1      LYS  46   6.424   7.155   4.232
  309    HG2  LYS  46           HG2      LYS  46   5.680   8.098   6.316
  310    HG3  LYS  46           HG1      LYS  46   4.099   7.334   6.113
  311    HD2  LYS  46           HD2      LYS  46   5.371   5.130   5.990
  312    HD3  LYS  46           HD1      LYS  46   6.758   6.029   6.613
  313    HE2  LYS  46           HE2      LYS  46   4.059   5.865   7.924
  314    HE3  LYS  46           HE1      LYS  46   5.459   4.881   8.358
  315    HZ1  LYS  46           HZ1      LYS  46   6.645   6.948   8.898
  316    HZ2  LYS  46           HZ2      LYS  46   5.268   6.730   9.853
  317    HZ3  LYS  46           HZ3      LYS  46   5.238   7.832   8.572
  318    H    LEU  47           HN       LEU  47   3.683   7.029   1.808
  319    HA   LEU  47           HA       LEU  47   5.857   6.966   0.002
  320    HB2  LEU  47           HB2      LEU  47   2.993   6.114  -0.108
  321    HB3  LEU  47           HB1      LEU  47   4.008   6.030  -1.538
  322    HG   LEU  47           HG       LEU  47   4.525   4.624   1.079
  323   HD11  LEU  47          HD11      LEU  47   3.604   3.574  -1.591
  324   HD12  LEU  47          HD12      LEU  47   2.642   3.674  -0.115
  325   HD13  LEU  47          HD13      LEU  47   4.031   2.589  -0.192
  326   HD21  LEU  47          HD21      LEU  47   6.009   4.527  -1.545
  327   HD22  LEU  47          HD22      LEU  47   6.316   3.482  -0.159
  328   HD23  LEU  47          HD23      LEU  47   6.600   5.217  -0.034
  329    H    ALA  48           HN       ALA  48   3.642   9.361   0.651
  330    HA   ALA  48           HA       ALA  48   2.725  10.409  -1.666
  331    HB1  ALA  48           HB1      ALA  48   2.547  12.495  -0.604
  332    HB2  ALA  48           HB2      ALA  48   3.925  12.173   0.440
  333    HB3  ALA  48           HB3      ALA  48   2.415  11.292   0.681
  334    HA   PRO  49           HA       PRO  49   6.748  12.952  -2.536
  335    HB2  PRO  49           HB2      PRO  49   8.811  11.517  -0.988
  336    HB3  PRO  49           HB1      PRO  49   8.513  13.244  -1.126
  337    HG2  PRO  49           HG2      PRO  49   7.931  11.994   1.127
  338    HG3  PRO  49           HG1      PRO  49   6.802  13.200   0.468
  339    HD2  PRO  49           HD2      PRO  49   6.732  10.220   0.176
  340    HD3  PRO  49           HD1      PRO  49   5.441  11.299   0.727
  341    H    TYR  50           HN       TYR  50   6.633   9.549  -2.302
  342    HA   TYR  50           HA       TYR  50   8.741   9.169  -4.308
  343    HB2  TYR  50           HB2      TYR  50   7.325   7.092  -2.641
  344    HB3  TYR  50           HB1      TYR  50   8.760   6.858  -3.626
  345    HD1  TYR  50           HD1      TYR  50  10.861   8.062  -2.989
  346    HD2  TYR  50           HD2      TYR  50   7.506   7.791  -0.402
  347    HE1  TYR  50           HE1      TYR  50  12.313   8.589  -1.067
  348    HE2  TYR  50           HE2      TYR  50   8.934   8.321   1.528
  349    HH   TYR  50           HH       TYR  50  11.257   8.224   2.175
  350    H    MET  51           HN       MET  51   5.425   9.444  -4.108
  351    HA   MET  51           HA       MET  51   4.674   7.363  -5.901
  352    HB2  MET  51           HB2      MET  51   3.201   9.860  -5.088
  353    HB3  MET  51           HB1      MET  51   2.513   8.571  -6.065
  354    HG2  MET  51           HG2      MET  51   3.566   8.232  -3.287
  355    HG3  MET  51           HG1      MET  51   1.874   8.487  -3.699
  356    HE1  MET  51           HE1      MET  51   2.127   6.088  -6.537
  357    HE2  MET  51           HE2      MET  51   0.982   7.172  -5.737
  358    HE3  MET  51           HE3      MET  51   0.830   5.415  -5.539
  359    H    SER  52           HN       SER  52   4.461   7.338  -7.964
  360    HA   SER  52           HA       SER  52   5.177   9.722  -9.528
  361    HB2  SER  52           HB2      SER  52   5.039   6.834 -10.437
  362    HB3  SER  52           HB1      SER  52   5.659   8.197 -11.372
  363    HG   SER  52           HG       SER  52   7.344   8.408  -9.901
  364    H    LYS  53           HN       LYS  53   2.684   7.566  -8.714
  365    HA   LYS  53           HA       LYS  53   0.832   8.247 -10.744
  366    HB2  LYS  53           HB2      LYS  53   0.528   6.171  -9.749
  367    HB3  LYS  53           HB1      LYS  53   0.899   6.770  -8.148
  368    HG2  LYS  53           HG2      LYS  53  -1.585   7.675  -9.462
  369    HG3  LYS  53           HG1      LYS  53  -1.504   6.047  -8.819
  370    HD2  LYS  53           HD2      LYS  53  -0.734   7.030  -6.658
  371    HD3  LYS  53           HD1      LYS  53  -1.097   8.627  -7.331
  372    HE2  LYS  53           HE2      LYS  53  -3.433   7.750  -7.751
  373    HE3  LYS  53           HE1      LYS  53  -2.998   6.365  -6.743
  374    HZ1  LYS  53           HZ1      LYS  53  -4.150   8.106  -5.517
  375    HZ2  LYS  53           HZ2      LYS  53  -2.919   9.211  -5.888
  376    HZ3  LYS  53           HZ3      LYS  53  -2.587   7.862  -4.921
  377    H    ASN  54           HN       ASN  54  -1.212   9.360 -10.206
  378    HA   ASN  54           HA       ASN  54  -1.273  11.896  -9.427
  379    HB2  ASN  54           HB2      ASN  54  -3.163  10.548 -10.191
  380    HB3  ASN  54           HB1      ASN  54  -3.335   9.902  -8.575
  381   HD21  ASN  54          HD21      ASN  54  -5.441  10.719  -8.434
  382   HD22  ASN  54          HD22      ASN  54  -5.736  12.403  -8.166
  383    H    ALA  55           HN       ALA  55   0.087  12.382  -7.887
  384    HA   ALA  55           HA       ALA  55  -0.890  12.549  -5.228
  385    HB1  ALA  55           HB1      ALA  55   1.513  10.822  -5.761
  386    HB2  ALA  55           HB2      ALA  55  -0.069  10.262  -5.219
  387    HB3  ALA  55           HB3      ALA  55   0.913  11.291  -4.169
  388    H    LYS  56           HN       LYS  56   0.321  13.975  -3.963
  389    HA   LYS  56           HA       LYS  56   2.645  15.258  -5.162
  390    HB2  LYS  56           HB2      LYS  56   0.208  16.718  -4.150
  391    HB3  LYS  56           HB1      LYS  56   1.733  17.494  -4.534
  392    HG2  LYS  56           HG2      LYS  56   0.346  15.871  -6.613
  393    HG3  LYS  56           HG1      LYS  56  -0.234  17.492  -6.242
  394    HD2  LYS  56           HD2      LYS  56   1.265  17.776  -8.029
  395    HD3  LYS  56           HD1      LYS  56   2.163  18.260  -6.597
  396    HE2  LYS  56           HE2      LYS  56   3.403  16.244  -6.581
  397    HE3  LYS  56           HE1      LYS  56   2.347  15.506  -7.786
  398    HZ1  LYS  56           HZ1      LYS  56   4.137  17.829  -8.253
  399    HZ2  LYS  56           HZ2      LYS  56   3.142  17.100  -9.408
  400    HZ3  LYS  56           HZ3      LYS  56   4.440  16.242  -8.751
  401    H    ASN  57           HN       ASN  57   0.526  15.912  -2.394
  402    HA   ASN  57           HA       ASN  57   2.759  15.263  -0.598
  403    HB2  ASN  57           HB2      ASN  57   0.350  17.041  -0.153
  404    HB3  ASN  57           HB1      ASN  57   1.477  16.581   1.117
  405   HD21  ASN  57          HD21      ASN  57   0.955  18.536  -1.680
  406   HD22  ASN  57          HD22      ASN  57   2.386  19.496  -1.533
  407    H    GLU  58           HN       GLU  58   1.386  14.856   1.711
  408    HA   GLU  58           HA       GLU  58   0.486  12.222   1.437
  409    HB2  GLU  58           HB2      GLU  58   0.856  12.295   3.624
  410    HB3  GLU  58           HB1      GLU  58   0.996  14.043   3.539
  411    HG2  GLU  58           HG2      GLU  58  -1.386  14.268   3.814
  412    HG3  GLU  58           HG1      GLU  58  -1.544  12.515   3.913
  413    H    ASP  59           HN       ASP  59  -1.257  15.241   1.807
  414    HA   ASP  59           HA       ASP  59  -3.868  14.182   1.699
  415    HB2  ASP  59           HB2      ASP  59  -3.499  16.405   2.528
  416    HB3  ASP  59           HB1      ASP  59  -2.750  16.894   1.020
  417    H    GLY  60           HN       GLY  60  -1.485  14.900  -0.677
  418    HA2  GLY  60           HA2      GLY  60  -3.244  14.900  -2.935
  419    HA3  GLY  60           HA1      GLY  60  -1.489  14.856  -2.978
  420    H    ILE  61           HN       ILE  61  -1.155  12.497  -1.400
  421    HA   ILE  61           HA       ILE  61  -1.550  10.621  -3.510
  422    HB   ILE  61           HB       ILE  61   0.564  10.566  -2.457
  423   HG12  ILE  61          HG12      ILE  61   0.794   8.320  -1.824
  424   HG13  ILE  61          HG11      ILE  61  -0.870   8.216  -1.257
  425   HG21  ILE  61          HG21      ILE  61   0.027  11.628  -0.360
  426   HG22  ILE  61          HG22      ILE  61   0.914  10.128  -0.086
  427   HG23  ILE  61          HG23      ILE  61  -0.828  10.182   0.175
  428   HD11  ILE  61          HD11      ILE  61  -0.306   7.119  -3.491
  429   HD12  ILE  61          HD12      ILE  61  -0.207   8.758  -4.133
  430   HD13  ILE  61          HD13      ILE  61  -1.722   8.175  -3.427
  431    H    VAL  62           HN       VAL  62  -2.393  10.669  -0.108
  432    HA   VAL  62           HA       VAL  62  -3.547   8.106  -0.151
  433    HB   VAL  62           HB       VAL  62  -3.831  10.332   1.863
  434   HG11  VAL  62          HG11      VAL  62  -4.410   7.390   2.113
  435   HG12  VAL  62          HG12      VAL  62  -5.584   8.711   2.199
  436   HG13  VAL  62          HG13      VAL  62  -4.350   8.533   3.454
  437   HG21  VAL  62          HG21      VAL  62  -1.695   8.573   1.132
  438   HG22  VAL  62          HG22      VAL  62  -2.203   8.295   2.805
  439   HG23  VAL  62          HG23      VAL  62  -1.707   9.915   2.286
  440    H    ASN  63           HN       ASN  63  -4.960  11.328  -0.193
  441    HA   ASN  63           HA       ASN  63  -7.651  10.542  -0.105
  442    HB2  ASN  63           HB2      ASN  63  -7.072  12.832   0.310
  443    HB3  ASN  63           HB1      ASN  63  -6.357  13.002  -1.287
  444   HD21  ASN  63          HD21      ASN  63  -7.638  13.492  -2.998
  445   HD22  ASN  63          HD22      ASN  63  -9.336  13.792  -2.878
  446    H    SER  64           HN       SER  64  -5.382  10.742  -2.746
  447    HA   SER  64           HA       SER  64  -7.394  10.369  -4.778
  448    HB2  SER  64           HB2      SER  64  -4.379  10.160  -5.043
  449    HB3  SER  64           HB1      SER  64  -5.552  10.379  -6.346
  450    HG   SER  64           HG       SER  64  -4.437  12.232  -4.692
  451    H    LEU  65           HN       LEU  65  -5.659   8.371  -2.676
  452    HA   LEU  65           HA       LEU  65  -5.734   6.021  -4.368
  453    HB2  LEU  65           HB2      LEU  65  -4.858   6.499  -1.540
  454    HB3  LEU  65           HB1      LEU  65  -4.905   4.903  -2.266
  455    HG   LEU  65           HG       LEU  65  -3.289   7.198  -3.322
  456   HD11  LEU  65          HD11      LEU  65  -2.266   4.788  -1.872
  457   HD12  LEU  65          HD12      LEU  65  -2.695   6.268  -1.017
  458   HD13  LEU  65          HD13      LEU  65  -1.427   6.292  -2.238
  459   HD21  LEU  65          HD21      LEU  65  -3.832   5.620  -5.029
  460   HD22  LEU  65          HD22      LEU  65  -3.428   4.268  -3.970
  461   HD23  LEU  65          HD23      LEU  65  -2.157   5.354  -4.545
  462    H    ALA  66           HN       ALA  66  -6.722   4.041  -3.673
  463    HA   ALA  66           HA       ALA  66  -9.407   4.113  -3.116
  464    HB1  ALA  66           HB1      ALA  66  -9.293   1.751  -2.608
  465    HB2  ALA  66           HB2      ALA  66  -7.549   1.866  -2.340
  466    HB3  ALA  66           HB3      ALA  66  -8.207   2.104  -3.963
  467    H    LYS  67           HN       LYS  67 -10.658   4.068  -1.413
  468    HA   LYS  67           HA       LYS  67  -9.372   4.429   1.194
  469    HB2  LYS  67           HB2      LYS  67 -11.989   5.504   0.162
  470    HB3  LYS  67           HB1      LYS  67 -11.435   5.674   1.819
  471    HG2  LYS  67           HG2      LYS  67 -10.333   6.934  -0.663
  472    HG3  LYS  67           HG1      LYS  67 -10.894   7.708   0.820
  473    HD2  LYS  67           HD2      LYS  67  -8.959   6.356   1.921
  474    HD3  LYS  67           HD1      LYS  67  -8.337   6.271   0.268
  475    HE2  LYS  67           HE2      LYS  67  -7.359   8.147   1.485
  476    HE3  LYS  67           HE1      LYS  67  -8.357   8.710   0.143
  477    HZ1  LYS  67           HZ1      LYS  67 -10.125   9.218   1.681
  478    HZ2  LYS  67           HZ2      LYS  67  -8.711   9.992   2.182
  479    HZ3  LYS  67           HZ3      LYS  67  -9.234   8.598   2.976
  480    H    ASP  68           HN       ASP  68 -10.051   3.280   2.911
  481    HA   ASP  68           HA       ASP  68 -11.695   0.959   2.331
  482    HB2  ASP  68           HB2      ASP  68 -10.644  -0.047   4.097
  483    HB3  ASP  68           HB1      ASP  68  -9.476   1.251   3.880
  484    H    LYS  69           HN       LYS  69 -13.401   0.401   4.110
  485    HA   LYS  69           HA       LYS  69 -15.142   2.712   4.147
  486    HB2  LYS  69           HB2      LYS  69 -15.930   0.498   3.359
  487    HB3  LYS  69           HB1      LYS  69 -15.746  -0.093   4.998
  488    HG2  LYS  69           HG2      LYS  69 -18.043   0.408   4.677
  489    HG3  LYS  69           HG1      LYS  69 -17.373   1.643   5.742
  490    HD2  LYS  69           HD2      LYS  69 -18.829   2.669   4.099
  491    HD3  LYS  69           HD1      LYS  69 -17.160   3.159   3.805
  492    HE2  LYS  69           HE2      LYS  69 -16.965   1.583   1.994
  493    HE3  LYS  69           HE1      LYS  69 -18.558   0.919   2.349
  494    HZ1  LYS  69           HZ1      LYS  69 -19.565   2.981   1.704
  495    HZ2  LYS  69           HZ2      LYS  69 -18.544   2.465   0.457
  496    HZ3  LYS  69           HZ3      LYS  69 -18.056   3.713   1.484
  497    H    SER  70           HN       SER  70 -13.628   0.566   6.534
  498    HA   SER  70           HA       SER  70 -15.236   1.885   8.607
  499    HB2  SER  70           HB2      SER  70 -13.855  -0.791   8.672
  500    HB3  SER  70           HB1      SER  70 -14.857  -0.126   9.958
  501    HG   SER  70           HG       SER  70 -15.579  -1.274   7.539
  502    H    GLY  71           HN       GLY  71 -11.934   1.103   7.717
  503    HA2  GLY  71           HA2      GLY  71  -9.935   1.822   8.613
  504    HA3  GLY  71           HA1      GLY  71 -10.849   2.876   9.681
  505    H    ASN  72           HN       ASN  72 -11.990  -0.238   9.877
  506    HA   ASN  72           HA       ASN  72 -11.432  -0.417  12.620
  507    HB2  ASN  72           HB2      ASN  72 -13.390  -1.464  11.501
  508    HB3  ASN  72           HB1      ASN  72 -12.308  -2.645  10.769
  509   HD21  ASN  72          HD21      ASN  72 -13.227  -4.408  11.762
  510   HD22  ASN  72          HD22      ASN  72 -13.085  -4.707  13.459
  511    H    SER  73           HN       SER  73  -9.762  -1.701   9.831
  512    HA   SER  73           HA       SER  73  -8.295  -3.660  11.343
  513    HB2  SER  73           HB2      SER  73  -8.930  -4.035   8.977
  514    HB3  SER  73           HB1      SER  73  -7.865  -2.714   8.500
  515    HG   SER  73           HG       SER  73  -6.268  -4.126   9.827
  516    H    SER  74           HN       SER  74  -8.020  -0.367  11.037
  517    HA   SER  74           HA       SER  74  -6.401   1.178  11.392
  518    HB2  SER  74           HB2      SER  74  -6.221  -0.147  13.518
  519    HB3  SER  74           HB1      SER  74  -4.916  -1.069  12.778
  520    HG   SER  74           HG       SER  74  -4.919   1.487  13.814
  521    H    THR  75           HN       THR  75  -5.914   1.367   9.175
  522    HA   THR  75           HA       THR  75  -3.840  -0.358   8.063
  523    HB   THR  75           HB       THR  75  -5.954   0.026   6.803
  524    HG1  THR  75           HG1      THR  75  -3.467   0.827   5.683
  525   HG21  THR  75          HG21      THR  75  -6.372   2.149   5.745
  526   HG22  THR  75          HG22      THR  75  -4.883   2.821   6.410
  527   HG23  THR  75          HG23      THR  75  -6.222   2.405   7.485
  528    H    SER  76           HN       SER  76  -3.905   2.480   9.704
  529    HA   SER  76           HA       SER  76  -2.338   4.059  10.137
  530    HB2  SER  76           HB2      SER  76  -0.603   2.663   8.091
  531    HB3  SER  76           HB1      SER  76  -0.069   3.831   9.301
  532    HG   SER  76           HG       SER  76  -1.375   1.947  10.600
  533    H    ALA  77           HN       ALA  77  -2.763   3.361   6.678
  534    HA   ALA  77           HA       ALA  77  -2.210   6.060   5.862
  535    HB1  ALA  77           HB1      ALA  77  -1.954   4.178   4.307
  536    HB2  ALA  77           HB2      ALA  77  -3.060   5.418   3.692
  537    HB3  ALA  77           HB3      ALA  77  -3.699   3.910   4.369
  538    HA   PRO  78           HA       PRO  78  -5.902   7.843   7.482
  539    HB2  PRO  78           HB2      PRO  78  -5.303   9.731   5.261
  540    HB3  PRO  78           HB1      PRO  78  -5.704  10.089   6.941
  541    HG2  PRO  78           HG2      PRO  78  -3.208  10.275   6.143
  542    HG3  PRO  78           HG1      PRO  78  -3.571   9.459   7.671
  543    HD2  PRO  78           HD2      PRO  78  -2.888   8.270   5.026
  544    HD3  PRO  78           HD1      PRO  78  -2.366   7.780   6.649
  545    H    GLY  79           HN       GLY  79  -7.620   6.618   6.973
  546    HA2  GLY  79           HA2      GLY  79  -9.599   6.073   5.963
  547    HA3  GLY  79           HA1      GLY  79  -9.349   7.439   4.894
  548    H    SER  80           HN       SER  80  -6.682   5.469   4.539
  549    HA   SER  80           HA       SER  80  -7.732   4.716   1.912
  550    HB2  SER  80           HB2      SER  80  -5.205   5.632   2.959
  551    HB3  SER  80           HB1      SER  80  -5.025   4.191   1.968
  552    HG   SER  80           HG       SER  80  -6.550   5.485   0.500
  553    H    ALA  81           HN       ALA  81  -7.015   2.805   0.893
  554    HA   ALA  81           HA       ALA  81  -7.176   0.521   2.679
  555    HB1  ALA  81           HB1      ALA  81  -7.559   0.704  -0.300
  556    HB2  ALA  81           HB2      ALA  81  -8.846   0.818   0.901
  557    HB3  ALA  81           HB3      ALA  81  -7.934  -0.687   0.721
  558    H    HIS  82           HN       HIS  82  -4.625   1.621   2.705
  559    HA   HIS  82           HA       HIS  82  -3.201  -0.681   1.676
  560    HB2  HIS  82           HB2      HIS  82  -2.733   2.068   0.702
  561    HB3  HIS  82           HB1      HIS  82  -1.320   1.104   1.036
  562    HD1  HIS  82           HD1      HIS  82  -1.151  -1.173  -0.375
  563    HD2  HIS  82           HD2      HIS  82  -3.933   1.636  -1.684
  564    HE1  HIS  82           HE1      HIS  82  -1.683  -1.801  -2.753
  565    HE2  HIS  82           HE2      HIS  82  -3.481  -0.185  -3.466
  566    H    GLN  83           HN       GLN  83  -1.927  -1.505   3.128
  567    HA   GLN  83           HA       GLN  83  -0.276   0.208   4.805
  568    HB2  GLN  83           HB2      GLN  83  -2.091  -0.272   6.321
  569    HB3  GLN  83           HB1      GLN  83  -2.078  -1.973   5.878
  570    HG2  GLN  83           HG2      GLN  83   0.138  -2.219   6.888
  571    HG3  GLN  83           HG1      GLN  83   0.119  -0.515   7.336
  572   HE21  GLN  83          HE21      GLN  83  -1.095   0.152   9.060
  573   HE22  GLN  83          HE22      GLN  83  -1.884  -0.941  10.147
  574    H    ILE  84           HN       ILE  84   1.760  -0.499   4.640
  575    HA   ILE  84           HA       ILE  84   2.197  -2.989   3.262
  576    HB   ILE  84           HB       ILE  84   3.750  -0.518   3.801
  577   HG12  ILE  84          HG12      ILE  84   3.914  -1.553   1.175
  578   HG13  ILE  84          HG11      ILE  84   2.256  -1.735   1.711
  579   HG21  ILE  84          HG21      ILE  84   5.773  -1.468   2.880
  580   HG22  ILE  84          HG22      ILE  84   4.999  -3.042   2.719
  581   HG23  ILE  84          HG23      ILE  84   5.308  -2.372   4.320
  582   HD11  ILE  84          HD11      ILE  84   2.350   0.701   2.364
  583   HD12  ILE  84          HD12      ILE  84   2.385   0.347   0.637
  584   HD13  ILE  84          HD13      ILE  84   3.874   0.775   1.477
  585    H    ASP  85           HN       ASP  85   3.457  -4.650   3.959
  586    HA   ASP  85           HA       ASP  85   3.862  -4.827   6.863
  587    HB2  ASP  85           HB2      ASP  85   2.496  -6.584   5.541
  588    HB3  ASP  85           HB1      ASP  85   4.034  -7.079   4.861
  589    H    THR  86           HN       THR  86   5.876  -4.344   7.491
  590    HA   THR  86           HA       THR  86   8.012  -4.577   5.569
  591    HB   THR  86           HB       THR  86   9.385  -3.560   7.415
  592    HG1  THR  86           HG1      THR  86   8.433  -3.010   9.281
  593   HG21  THR  86          HG21      THR  86   8.410  -2.255   5.630
  594   HG22  THR  86          HG22      THR  86   8.314  -1.359   7.152
  595   HG23  THR  86          HG23      THR  86   6.876  -2.166   6.509
  596    H    THR  87           HN       THR  87   6.718  -6.348   8.205
  597    HA   THR  87           HA       THR  87   8.900  -7.824   9.085
  598    HB   THR  87           HB       THR  87   6.060  -8.807   8.746
  599    HG1  THR  87           HG1      THR  87   7.329  -7.177  10.679
  600   HG21  THR  87          HG21      THR  87   8.260  -9.684  10.613
  601   HG22  THR  87          HG22      THR  87   7.658 -10.589   9.226
  602   HG23  THR  87          HG23      THR  87   6.607 -10.296  10.612
  603    H    ASN  88           HN       ASN  88   6.543  -8.714   6.538
  604    HA   ASN  88           HA       ASN  88   8.487 -10.662   5.531
  605    HB2  ASN  88           HB2      ASN  88   5.555 -10.297   5.205
  606    HB3  ASN  88           HB1      ASN  88   6.441 -11.087   3.903
  607   HD21  ASN  88          HD21      ASN  88   7.392 -13.075   4.267
  608   HD22  ASN  88          HD22      ASN  88   6.995 -14.058   5.634
  609    H    HIS  89           HN       HIS  89   7.661  -7.497   5.040
  610    HA   HIS  89           HA       HIS  89   8.642  -5.962   3.669
  611    HB2  HIS  89           HB2      HIS  89  10.267  -8.256   3.322
  612    HB3  HIS  89           HB1      HIS  89   9.967  -7.604   1.715
  613    HD1  HIS  89           HD1      HIS  89  12.268  -6.696   1.322
  614    HD2  HIS  89           HD2      HIS  89  10.605  -5.296   4.878
  615    HE1  HIS  89           HE1      HIS  89  13.769  -4.844   2.100
  616    HE2  HIS  89           HE2      HIS  89  12.912  -4.270   4.377
  617    H    LYS  90           HN       LYS  90   6.096  -6.818   3.304
  618    HA   LYS  90           HA       LYS  90   5.709  -7.084   0.399
  619    HB2  LYS  90           HB2      LYS  90   4.289  -8.057   2.810
  620    HB3  LYS  90           HB1      LYS  90   3.341  -7.797   1.369
  621    HG2  LYS  90           HG2      LYS  90   4.835  -9.350   0.159
  622    HG3  LYS  90           HG1      LYS  90   5.727  -9.620   1.660
  623    HD2  LYS  90           HD2      LYS  90   2.831 -10.262   1.131
  624    HD3  LYS  90           HD1      LYS  90   4.148 -11.412   1.356
  625    HE2  LYS  90           HE2      LYS  90   4.447 -10.638   3.641
  626    HE3  LYS  90           HE1      LYS  90   3.174  -9.445   3.423
  627    HZ1  LYS  90           HZ1      LYS  90   1.590 -11.235   3.089
  628    HZ2  LYS  90           HZ2      LYS  90   2.372 -11.419   4.578
  629    HZ3  LYS  90           HZ3      LYS  90   2.811 -12.390   3.268
  630    H    LEU  91           HN       LEU  91   4.333  -5.761  -0.656
  631    HA   LEU  91           HA       LEU  91   3.243  -3.419   0.716
  632    HB2  LEU  91           HB2      LEU  91   4.458  -3.073  -1.374
  633    HB3  LEU  91           HB1      LEU  91   3.395  -4.148  -2.209
  634    HG   LEU  91           HG       LEU  91   2.340  -2.338  -2.917
  635   HD11  LEU  91          HD11      LEU  91   0.607  -2.864  -1.381
  636   HD12  LEU  91          HD12      LEU  91   0.798  -1.111  -1.402
  637   HD13  LEU  91          HD13      LEU  91   1.454  -2.056  -0.061
  638   HD21  LEU  91          HD21      LEU  91   4.304  -1.037  -2.294
  639   HD22  LEU  91          HD22      LEU  91   3.548  -0.690  -0.739
  640   HD23  LEU  91          HD23      LEU  91   2.805  -0.118  -2.230
  641    H    ILE  92           HN       ILE  92   1.482  -3.966   1.770
  642    HA   ILE  92           HA       ILE  92  -0.543  -5.679   0.561
  643    HB   ILE  92           HB       ILE  92   0.113  -4.751   3.322
  644   HG12  ILE  92          HG12      ILE  92  -0.410  -7.303   3.662
  645   HG13  ILE  92          HG11      ILE  92  -0.212  -7.366   1.913
  646   HG21  ILE  92          HG21      ILE  92  -1.989  -5.723   4.187
  647   HG22  ILE  92          HG22      ILE  92  -2.570  -5.878   2.532
  648   HG23  ILE  92          HG23      ILE  92  -2.251  -4.280   3.206
  649   HD11  ILE  92          HD11      ILE  92   2.012  -6.514   2.089
  650   HD12  ILE  92          HD12      ILE  92   1.826  -7.919   3.140
  651   HD13  ILE  92          HD13      ILE  92   1.825  -6.295   3.826
  652    H    SER  93           HN       SER  93  -2.560  -4.915   0.028
  653    HA   SER  93           HA       SER  93  -3.168  -2.148   0.753
  654    HB2  SER  93           HB2      SER  93  -4.929  -2.186  -0.840
  655    HB3  SER  93           HB1      SER  93  -3.579  -2.998  -1.628
  656    HG   SER  93           HG       SER  93  -5.610  -4.375  -0.210
  657    H    THR  94           HN       THR  94  -4.532  -1.805   2.483
  658    HA   THR  94           HA       THR  94  -5.912  -4.197   3.453
  659    HB   THR  94           HB       THR  94  -5.076  -1.693   4.905
  660    HG1  THR  94           HG1      THR  94  -3.973  -4.145   4.499
  661   HG21  THR  94          HG21      THR  94  -7.286  -2.525   5.673
  662   HG22  THR  94          HG22      THR  94  -6.034  -2.684   6.909
  663   HG23  THR  94          HG23      THR  94  -6.552  -4.096   5.986
  664    H    PHE  95           HN       PHE  95  -7.879  -4.251   2.684
  665    HA   PHE  95           HA       PHE  95  -9.411  -1.755   2.466
  666    HB2  PHE  95           HB2      PHE  95  -9.244  -3.236   0.438
  667    HB3  PHE  95           HB1      PHE  95 -10.098  -4.462   1.357
  668    HD1  PHE  95           HD1      PHE  95 -12.420  -4.470   1.558
  669    HD2  PHE  95           HD2      PHE  95 -10.445  -1.036  -0.005
  670    HE1  PHE  95           HE1      PHE  95 -14.593  -3.508   0.934
  671    HE2  PHE  95           HE2      PHE  95 -12.621  -0.072  -0.630
  672    HZ   PHE  95           HZ       PHE  95 -14.695  -1.306  -0.159
  673    H    THR  96           HN       THR  96 -10.271  -1.508   4.494
  674    HA   THR  96           HA       THR  96 -11.316  -3.798   5.857
  675    HB   THR  96           HB       THR  96 -11.968  -1.065   6.809
  676    HG1  THR  96           HG1      THR  96  -9.923  -0.496   6.584
  677   HG21  THR  96          HG21      THR  96 -12.571  -3.023   8.083
  678   HG22  THR  96          HG22      THR  96 -11.322  -2.112   8.931
  679   HG23  THR  96          HG23      THR  96 -10.899  -3.581   8.047
  680    HA   PRO  97           HA       PRO  97 -15.041  -3.437   3.348
  681    HB2  PRO  97           HB2      PRO  97 -16.283  -5.519   4.718
  682    HB3  PRO  97           HB1      PRO  97 -15.318  -5.677   3.252
  683    HG2  PRO  97           HG2      PRO  97 -14.603  -6.214   6.072
  684    HG3  PRO  97           HG1      PRO  97 -14.019  -6.985   4.589
  685    HD2  PRO  97           HD2      PRO  97 -12.563  -5.224   6.003
  686    HD3  PRO  97           HD1      PRO  97 -12.406  -5.405   4.254
  687    H    SER  98           HN       SER  98 -17.319  -3.184   3.716
  688    HA   SER  98           HA       SER  98 -17.875  -1.319   5.772
  689    HB2  SER  98           HB2      SER  98 -19.883  -2.737   4.017
  690    HB3  SER  98           HB1      SER  98 -20.047  -1.154   4.779
  691    HG   SER  98           HG       SER  98 -19.106  -1.684   2.382
  692    H    ASN  99           HN       ASN  99 -17.950  -4.696   5.681
  693    HA   ASN  99           HA       ASN  99 -19.904  -5.018   7.788
  694    HB2  ASN  99           HB2      ASN  99 -18.123  -6.838   6.234
  695    HB3  ASN  99           HB1      ASN  99 -18.801  -7.395   7.754
  696   HD21  ASN  99          HD21      ASN  99 -21.017  -7.749   7.902
  697   HD22  ASN  99          HD22      ASN  99 -22.037  -7.818   6.508
  698    H    GLY 100           HN       GLY 100 -16.582  -4.395   7.508
  699    HA2  GLY 100           HA2      GLY 100 -15.151  -3.711   9.223
  700    HA3  GLY 100           HA1      GLY 100 -16.311  -4.321  10.395
  701    H    GLY 101           HN       GLY 101 -15.837  -6.609   8.060
  702    HA2  GLY 101           HA2      GLY 101 -14.412  -8.336   9.852
  703    HA3  GLY 101           HA1      GLY 101 -14.997  -8.747   8.247
  704    H    GLN 102           HN       GLN 102 -12.911  -9.891   8.176
  705    HA   GLN 102           HA       GLN 102 -10.412  -8.694   8.237
  706    HB2  GLN 102           HB2      GLN 102 -11.432 -11.008   6.597
  707    HB3  GLN 102           HB1      GLN 102  -9.739 -10.534   6.633
  708    HG2  GLN 102           HG2      GLN 102  -9.666 -10.928   9.026
  709    HG3  GLN 102           HG1      GLN 102 -11.372 -11.377   9.016
  710   HE21  GLN 102          HE21      GLN 102  -9.029 -12.933   9.805
  711   HE22  GLN 102          HE22      GLN 102  -9.049 -14.350   8.817
  712    H    ALA 103           HN       ALA 103  -9.206  -7.551   6.886
  713    HA   ALA 103           HA       ALA 103 -10.556  -6.114   4.779
  714    HB1  ALA 103           HB1      ALA 103  -8.498  -4.833   4.617
  715    HB2  ALA 103           HB2      ALA 103  -7.703  -5.951   5.739
  716    HB3  ALA 103           HB3      ALA 103  -9.058  -4.955   6.292
  717    H    THR 104           HN       THR 104  -9.754  -5.793   2.772
  718    HA   THR 104           HA       THR 104  -8.995  -8.274   1.455
  719    HB   THR 104           HB       THR 104 -10.709  -6.005   0.926
  720    HG1  THR 104           HG1      THR 104 -10.539  -8.537  -0.364
  721   HG21  THR 104          HG21      THR 104  -8.742  -6.795  -1.166
  722   HG22  THR 104          HG22      THR 104  -9.291  -5.180  -0.695
  723   HG23  THR 104          HG23      THR 104 -10.360  -6.254  -1.595
  724    H    VAL 105           HN       VAL 105  -7.208  -8.412   0.032
  725    HA   VAL 105           HA       VAL 105  -5.313  -6.183   0.309
  726    HB   VAL 105           HB       VAL 105  -4.694  -9.086   0.846
  727   HG11  VAL 105          HG11      VAL 105  -2.795  -8.098  -0.195
  728   HG12  VAL 105          HG12      VAL 105  -2.463  -8.201   1.534
  729   HG13  VAL 105          HG13      VAL 105  -2.920  -6.660   0.812
  730   HG21  VAL 105          HG21      VAL 105  -4.299  -8.403   3.134
  731   HG22  VAL 105          HG22      VAL 105  -5.941  -7.945   2.657
  732   HG23  VAL 105          HG23      VAL 105  -4.664  -6.727   2.724
  733    H    LEU 106           HN       LEU 106  -4.405  -5.583  -1.473
  734    HA   LEU 106           HA       LEU 106  -3.745  -7.493  -3.612
  735    HB2  LEU 106           HB2      LEU 106  -4.187  -4.563  -3.456
  736    HB3  LEU 106           HB1      LEU 106  -2.911  -5.092  -4.538
  737    HG   LEU 106           HG       LEU 106  -4.908  -4.757  -5.791
  738   HD11  LEU 106          HD11      LEU 106  -5.202  -6.942  -6.813
  739   HD12  LEU 106          HD12      LEU 106  -4.472  -7.721  -5.410
  740   HD13  LEU 106          HD13      LEU 106  -3.503  -6.660  -6.432
  741   HD21  LEU 106          HD21      LEU 106  -6.994  -5.921  -5.323
  742   HD22  LEU 106          HD22      LEU 106  -6.496  -4.999  -3.904
  743   HD23  LEU 106          HD23      LEU 106  -6.258  -6.745  -3.949
  744    H    THR 107           HN       THR 107  -1.785  -8.422  -3.242
  745    HA   THR 107           HA       THR 107   0.124  -6.914  -1.607
  746    HB   THR 107           HB       THR 107   0.247  -9.848  -2.241
  747    HG1  THR 107           HG1      THR 107  -1.684  -9.543  -1.163
  748   HG21  THR 107          HG21      THR 107   2.297  -8.716  -1.359
  749   HG22  THR 107          HG22      THR 107   1.670  -9.986  -0.312
  750   HG23  THR 107          HG23      THR 107   1.382  -8.292   0.093
  751    H    TYR 108           HN       TYR 108   2.202  -6.647  -2.121
  752    HA   TYR 108           HA       TYR 108   3.315  -7.838  -4.554
  753    HB2  TYR 108           HB2      TYR 108   3.093  -5.710  -5.434
  754    HB3  TYR 108           HB1      TYR 108   3.125  -4.944  -3.858
  755    HD1  TYR 108           HD1      TYR 108   5.143  -4.116  -2.937
  756    HD2  TYR 108           HD2      TYR 108   5.245  -6.396  -6.519
  757    HE1  TYR 108           HE1      TYR 108   7.463  -3.415  -3.292
  758    HE2  TYR 108           HE2      TYR 108   7.579  -5.722  -6.889
  759    HH   TYR 108           HH       TYR 108   9.444  -4.156  -4.483
  760    H    ASP 109           HN       ASP 109   5.527  -8.400  -4.303
  761    HA   ASP 109           HA       ASP 109   6.517  -8.074  -1.545
  762    HB2  ASP 109           HB2      ASP 109   6.033 -10.441  -2.660
  763    HB3  ASP 109           HB1      ASP 109   7.631 -10.175  -3.340
  764    H    TRP 110           HN       TRP 110   8.129  -6.682  -1.370
  765    HA   TRP 110           HA       TRP 110   9.501  -5.675  -3.658
  766    HB2  TRP 110           HB2      TRP 110   9.307  -4.033  -2.056
  767    HB3  TRP 110           HB1      TRP 110   9.568  -5.141  -0.720
  768    HD1  TRP 110           HD1      TRP 110  11.981  -5.319   0.233
  769    HE1  TRP 110           HE1      TRP 110  14.212  -4.141  -0.274
  770    HE3  TRP 110           HE3      TRP 110  10.699  -3.017  -4.136
  771    HZ2  TRP 110           HZ2      TRP 110  15.282  -2.457  -2.264
  772    HZ3  TRP 110           HZ3      TRP 110  12.385  -1.637  -5.281
  773    HH2  TRP 110           HH2      TRP 110  14.629  -1.366  -4.362
  774    H    SER 111           HN       SER 111  10.248  -8.008  -1.161
  775    HA   SER 111           HA       SER 111  12.942  -8.346  -2.204
  776    HB2  SER 111           HB2      SER 111  11.528  -9.280   0.258
  777    HB3  SER 111           HB1      SER 111  13.106  -9.879  -0.192
  778    HG   SER 111           HG       SER 111  13.905  -7.770  -0.066
  779    H    ALA 112           HN       ALA 112   9.867  -9.801  -2.145
  780    HA   ALA 112           HA       ALA 112   8.951 -11.634  -3.061
  781    HB1  ALA 112           HB1      ALA 112   9.862 -10.665  -5.053
  782    HB2  ALA 112           HB2      ALA 112   9.939 -12.427  -5.135
  783    HB3  ALA 112           HB3      ALA 112  11.393 -11.489  -4.785
  784    H    ASN 113           HN       ASN 113   9.908 -12.205  -0.795
  785    HA   ASN 113           HA       ASN 113  11.878 -14.313  -0.850
  786    HB2  ASN 113           HB2      ASN 113  11.427 -14.410   1.636
  787    HB3  ASN 113           HB1      ASN 113  12.017 -12.864   1.043
  788   HD21  ASN 113          HD21      ASN 113  10.611 -11.099   0.974
  789   HD22  ASN 113          HD22      ASN 113   9.138 -11.063   1.879
  790    H    GLY 114           HN       GLY 114   9.945 -15.087  -2.452
  791    HA2  GLY 114           HA2      GLY 114   7.993 -16.742  -1.141
  792    HA3  GLY 114           HA1      GLY 114   8.372 -16.718  -2.858
  793    H    VAL 115           HN       VAL 115   9.544 -17.842   0.265
  794    HA   VAL 115           HA       VAL 115  11.005 -19.986  -1.113
  795    HB   VAL 115           HB       VAL 115  12.531 -18.367  -0.037
  796   HG11  VAL 115          HG11      VAL 115  11.149 -19.145   2.525
  797   HG12  VAL 115          HG12      VAL 115  11.068 -17.573   1.731
  798   HG13  VAL 115          HG13      VAL 115  12.597 -18.147   2.394
  799   HG21  VAL 115          HG21      VAL 115  13.322 -20.612  -0.190
  800   HG22  VAL 115          HG22      VAL 115  12.403 -21.096   1.235
  801   HG23  VAL 115          HG23      VAL 115  13.773 -19.994   1.399
  802    H    ASN 116           HN       ASN 116  11.058 -22.022   0.027
  803    HA   ASN 116           HA       ASN 116   8.471 -22.501   1.213
  804    HB2  ASN 116           HB2      ASN 116   9.542 -23.938  -0.591
  805    HB3  ASN 116           HB1      ASN 116  10.640 -24.528   0.649
  806   HD21  ASN 116          HD21      ASN 116   9.942 -26.623   0.536
  807   HD22  ASN 116          HD22      ASN 116   8.381 -27.132   1.081
  808    H    SER 117           HN       SER 117   9.832 -20.993   2.937
  809    HA   SER 117           HA       SER 117  10.572 -20.780   5.072
  810    HB2  SER 117           HB2      SER 117   8.433 -22.105   5.376
  811    HB3  SER 117           HB1      SER 117   9.432 -23.550   5.496
  812    HG   SER 117           HG       SER 117   9.933 -23.024   7.462
  813    H    ASN 118           HN       ASN 118  12.597 -21.456   3.439
  814    HA   ASN 118           HA       ASN 118  14.010 -23.727   4.610
  815    HB2  ASN 118           HB2      ASN 118  14.659 -22.009   2.207
  816    HB3  ASN 118           HB1      ASN 118  15.659 -23.341   2.776
  817   HD21  ASN 118          HD21      ASN 118  14.916 -25.456   2.539
  818   HD22  ASN 118          HD22      ASN 118  13.635 -25.857   1.448
  Start of MODEL   10
    1    H1   HIS   6           HT1      HIS   6 -21.599  -6.596  -6.187
    2    H2   HIS   6           HT2      HIS   6 -20.954  -5.272  -5.368
    3    H3   HIS   6           HT3      HIS   6 -20.145  -6.755  -5.341
    4    HA   HIS   6           HA       HIS   6 -19.783  -6.631  -7.711
    5    HB2  HIS   6           HB2      HIS   6 -20.205  -4.505  -8.894
    6    HB3  HIS   6           HB1      HIS   6 -21.689  -5.263  -8.339
    7    HD1  HIS   6           HD1      HIS   6 -23.269  -3.776  -7.144
    8    HD2  HIS   6           HD2      HIS   6 -19.394  -2.265  -7.119
    9    HE1  HIS   6           HE1      HIS   6 -23.436  -1.494  -6.102
   10    HE2  HIS   6           HE2      HIS   6 -21.065  -0.656  -5.976
   11    H    GLN   7           HN       GLN   7 -19.141  -4.886  -4.865
   12    HA   GLN   7           HA       GLN   7 -16.839  -3.509  -5.920
   13    HB2  GLN   7           HB2      GLN   7 -17.948  -2.388  -4.143
   14    HB3  GLN   7           HB1      GLN   7 -17.891  -3.827  -3.138
   15    HG2  GLN   7           HG2      GLN   7 -15.514  -3.663  -2.891
   16    HG3  GLN   7           HG1      GLN   7 -15.447  -2.325  -4.044
   17   HE21  GLN   7          HE21      GLN   7 -16.160  -0.296  -3.418
   18   HE22  GLN   7          HE22      GLN   7 -16.388   0.126  -1.758
   19    H    ASP   8           HN       ASP   8 -17.490  -6.531  -4.306
   20    HA   ASP   8           HA       ASP   8 -14.955  -7.018  -3.256
   21    HB2  ASP   8           HB2      ASP   8 -16.847  -8.418  -2.697
   22    HB3  ASP   8           HB1      ASP   8 -16.975  -8.973  -4.360
   23    H    ASN   9           HN       ASN   9 -16.214  -7.435  -6.496
   24    HA   ASN   9           HA       ASN   9 -13.719  -8.396  -7.571
   25    HB2  ASN   9           HB2      ASN   9 -16.256  -7.364  -8.827
   26    HB3  ASN   9           HB1      ASN   9 -14.841  -7.794  -9.781
   27   HD21  ASN   9          HD21      ASN   9 -14.276  -9.947 -10.012
   28   HD22  ASN   9          HD22      ASN   9 -15.332 -11.236  -9.551
   29    H    ALA  10           HN       ALA  10 -15.379  -5.338  -7.232
   30    HA   ALA  10           HA       ALA  10 -13.853  -3.807  -9.031
   31    HB1  ALA  10           HB1      ALA  10 -14.731  -1.868  -7.922
   32    HB2  ALA  10           HB2      ALA  10 -15.225  -2.844  -6.535
   33    HB3  ALA  10           HB3      ALA  10 -16.009  -3.078  -8.101
   34    H    ARG  11           HN       ARG  11 -13.531  -4.322  -5.546
   35    HA   ARG  11           HA       ARG  11 -11.560  -2.489  -4.932
   36    HB2  ARG  11           HB2      ARG  11 -11.733  -5.310  -3.911
   37    HB3  ARG  11           HB1      ARG  11 -10.866  -3.982  -3.144
   38    HG2  ARG  11           HG2      ARG  11 -12.828  -2.942  -2.472
   39    HG3  ARG  11           HG1      ARG  11 -13.814  -3.862  -3.617
   40    HD2  ARG  11           HD2      ARG  11 -13.230  -5.924  -2.387
   41    HD3  ARG  11           HD1      ARG  11 -12.384  -4.939  -1.197
   42    HE   ARG  11           HE       ARG  11 -14.909  -3.906  -1.249
   43   HH11  ARG  11          HH11      ARG  11 -13.498  -7.057  -0.684
   44   HH12  ARG  11          HH12      ARG  11 -14.784  -7.593   0.348
   45   HH21  ARG  11          HH21      ARG  11 -16.595  -4.592   0.151
   46   HH22  ARG  11          HH22      ARG  11 -16.549  -6.192   0.819
   47    H    LYS  12           HN       LYS  12 -11.174  -5.831  -5.936
   48    HA   LYS  12           HA       LYS  12  -8.489  -6.115  -6.183
   49    HB2  LYS  12           HB2      LYS  12 -10.213  -7.819  -6.740
   50    HB3  LYS  12           HB1      LYS  12 -10.478  -6.987  -8.272
   51    HG2  LYS  12           HG2      LYS  12  -9.063  -8.727  -8.805
   52    HG3  LYS  12           HG1      LYS  12  -7.971  -7.356  -8.641
   53    HD2  LYS  12           HD2      LYS  12  -7.574  -8.089  -6.274
   54    HD3  LYS  12           HD1      LYS  12  -8.477  -9.559  -6.651
   55    HE2  LYS  12           HE2      LYS  12  -6.900 -10.028  -8.475
   56    HE3  LYS  12           HE1      LYS  12  -6.002  -8.582  -8.024
   57    HZ1  LYS  12           HZ1      LYS  12  -4.994 -10.584  -7.115
   58    HZ2  LYS  12           HZ2      LYS  12  -6.420 -10.951  -6.287
   59    HZ3  LYS  12           HZ3      LYS  12  -5.537  -9.571  -5.875
   60    H    SER  13           HN       SER  13 -10.630  -4.464  -8.465
   61    HA   SER  13           HA       SER  13  -8.437  -3.937 -10.289
   62    HB2  SER  13           HB2      SER  13 -11.367  -3.187 -10.340
   63    HB3  SER  13           HB1      SER  13 -10.230  -2.859 -11.652
   64    HG   SER  13           HG       SER  13  -9.844  -5.270 -11.467
   65    H    ARG  14           HN       ARG  14 -10.627  -2.074  -8.212
   66    HA   ARG  14           HA       ARG  14  -9.683   0.471  -8.976
   67    HB2  ARG  14           HB2      ARG  14 -10.885   1.301  -6.999
   68    HB3  ARG  14           HB1      ARG  14 -11.873   0.194  -7.946
   69    HG2  ARG  14           HG2      ARG  14 -12.245  -1.003  -6.128
   70    HG3  ARG  14           HG1      ARG  14 -10.515  -1.349  -6.043
   71    HD2  ARG  14           HD2      ARG  14 -11.823  -0.231  -4.043
   72    HD3  ARG  14           HD1      ARG  14 -10.146   0.164  -4.394
   73    HE   ARG  14           HE       ARG  14 -11.114   2.133  -5.656
   74   HH11  ARG  14          HH11      ARG  14 -12.838   0.690  -2.962
   75   HH12  ARG  14          HH12      ARG  14 -13.639   2.164  -2.531
   76   HH21  ARG  14          HH21      ARG  14 -12.176   4.049  -5.100
   77   HH22  ARG  14          HH22      ARG  14 -13.280   4.069  -3.759
   78    H    ILE  15           HN       ILE  15  -8.694  -1.765  -6.440
   79    HA   ILE  15           HA       ILE  15  -6.914   0.125  -5.226
   80    HB   ILE  15           HB       ILE  15  -7.144  -2.862  -4.971
   81   HG12  ILE  15          HG12      ILE  15  -8.049  -0.666  -3.087
   82   HG13  ILE  15          HG11      ILE  15  -9.107  -1.506  -4.216
   83   HG21  ILE  15          HG21      ILE  15  -4.891  -2.038  -4.398
   84   HG22  ILE  15          HG22      ILE  15  -5.747  -2.649  -2.979
   85   HG23  ILE  15          HG23      ILE  15  -5.607  -0.909  -3.246
   86   HD11  ILE  15          HD11      ILE  15  -7.663  -2.662  -1.858
   87   HD12  ILE  15          HD12      ILE  15  -8.495  -3.629  -3.083
   88   HD13  ILE  15          HD13      ILE  15  -9.405  -2.482  -2.090
   89    H    GLN  16           HN       GLN  16  -6.734  -2.650  -7.355
   90    HA   GLN  16           HA       GLN  16  -4.125  -3.148  -7.745
   91    HB2  GLN  16           HB2      GLN  16  -6.377  -3.842  -8.963
   92    HB3  GLN  16           HB1      GLN  16  -5.702  -2.790 -10.201
   93    HG2  GLN  16           HG2      GLN  16  -3.610  -4.139 -10.101
   94    HG3  GLN  16           HG1      GLN  16  -4.463  -5.250  -9.030
   95   HE21  GLN  16          HE21      GLN  16  -4.205  -4.020 -12.266
   96   HE22  GLN  16          HE22      GLN  16  -5.158  -5.248 -13.025
   97    H    SER  17           HN       SER  17  -5.904  -0.536  -9.375
   98    HA   SER  17           HA       SER  17  -3.905   0.472 -10.988
   99    HB2  SER  17           HB2      SER  17  -5.930   2.140  -9.484
  100    HB3  SER  17           HB1      SER  17  -5.154   2.537 -11.018
  101    HG   SER  17           HG       SER  17  -6.201   0.358 -11.630
  102    H    GLU  18           HN       GLU  18  -4.758   1.622  -7.749
  103    HA   GLU  18           HA       GLU  18  -2.471   3.282  -7.472
  104    HB2  GLU  18           HB2      GLU  18  -4.403   2.181  -5.435
  105    HB3  GLU  18           HB1      GLU  18  -3.201   3.429  -5.123
  106    HG2  GLU  18           HG2      GLU  18  -5.315   3.666  -7.225
  107    HG3  GLU  18           HG1      GLU  18  -5.502   4.277  -5.581
  108    H    HIS  19           HN       HIS  19  -3.236  -0.020  -6.456
  109    HA   HIS  19           HA       HIS  19  -1.228  -0.578  -4.675
  110    HB2  HIS  19           HB2      HIS  19  -2.686  -2.342  -4.943
  111    HB3  HIS  19           HB1      HIS  19  -2.696  -2.236  -6.694
  112    HD1  HIS  19           HD1      HIS  19  -0.103  -3.201  -4.034
  113    HD2  HIS  19           HD2      HIS  19  -1.472  -4.349  -7.781
  114    HE1  HIS  19           HE1      HIS  19   1.241  -5.228  -4.648
  115    HE2  HIS  19           HE2      HIS  19   0.321  -5.973  -6.869
  116    H    ARG  20           HN       ARG  20  -0.950  -1.014  -8.214
  117    HA   ARG  20           HA       ARG  20   1.747  -1.718  -8.258
  118    HB2  ARG  20           HB2      ARG  20   0.272  -0.079 -10.328
  119    HB3  ARG  20           HB1      ARG  20   1.720  -1.041 -10.593
  120    HG2  ARG  20           HG2      ARG  20  -0.275  -2.714  -9.452
  121    HG3  ARG  20           HG1      ARG  20  -0.982  -1.833 -10.808
  122    HD2  ARG  20           HD2      ARG  20  -0.017  -3.938 -11.545
  123    HD3  ARG  20           HD1      ARG  20   0.842  -2.570 -12.241
  124    HE   ARG  20           HE       ARG  20   2.353  -3.098 -10.109
  125   HH11  ARG  20          HH11      ARG  20   0.960  -5.265 -12.480
  126   HH12  ARG  20          HH12      ARG  20   2.296  -6.368 -12.441
  127   HH21  ARG  20          HH21      ARG  20   4.104  -4.538 -10.049
  128   HH22  ARG  20          HH22      ARG  20   4.096  -5.951 -11.058
  129    H    GLU  21           HN       GLU  21   0.235   1.488  -8.374
  130    HA   GLU  21           HA       GLU  21   2.519   3.058  -8.624
  131    HB2  GLU  21           HB2      GLU  21   0.111   3.746  -6.947
  132    HB3  GLU  21           HB1      GLU  21   1.203   4.859  -7.747
  133    HG2  GLU  21           HG2      GLU  21  -0.701   2.983  -9.096
  134    HG3  GLU  21           HG1      GLU  21  -0.954   4.717  -8.872
  135    H    LEU  22           HN       LEU  22   0.862   1.975  -5.646
  136    HA   LEU  22           HA       LEU  22   2.520   3.355  -3.863
  137    HB2  LEU  22           HB2      LEU  22   0.697   1.011  -3.532
  138    HB3  LEU  22           HB1      LEU  22   1.747   1.489  -2.214
  139    HG   LEU  22           HG       LEU  22  -0.303   2.529  -1.743
  140   HD11  LEU  22          HD11      LEU  22   0.152   4.897  -1.927
  141   HD12  LEU  22          HD12      LEU  22   1.312   4.616  -3.221
  142   HD13  LEU  22          HD13      LEU  22   1.654   4.039  -1.588
  143   HD21  LEU  22          HD21      LEU  22  -1.361   4.031  -3.515
  144   HD22  LEU  22          HD22      LEU  22  -1.557   2.286  -3.679
  145   HD23  LEU  22          HD23      LEU  22  -0.377   3.142  -4.673
  146    H    VAL  23           HN       VAL  23   2.894   0.130  -5.263
  147    HA   VAL  23           HA       VAL  23   5.151  -0.377  -3.556
  148    HB   VAL  23           HB       VAL  23   4.808  -2.467  -4.037
  149   HG11  VAL  23          HG11      VAL  23   2.463  -1.736  -4.465
  150   HG12  VAL  23          HG12      VAL  23   2.925  -3.234  -5.276
  151   HG13  VAL  23          HG13      VAL  23   2.847  -1.727  -6.186
  152   HG21  VAL  23          HG21      VAL  23   5.245  -3.404  -6.237
  153   HG22  VAL  23          HG22      VAL  23   6.483  -2.242  -5.732
  154   HG23  VAL  23          HG23      VAL  23   5.245  -1.773  -6.913
  155    H    SER  24           HN       SER  24   4.606   0.686  -6.872
  156    HA   SER  24           HA       SER  24   7.278   0.863  -7.683
  157    HB2  SER  24           HB2      SER  24   5.253   1.373  -9.109
  158    HB3  SER  24           HB1      SER  24   5.115   2.911  -8.254
  159    HG   SER  24           HG       SER  24   7.181   3.462  -9.039
  160    H    ALA  25           HN       ALA  25   5.349   2.690  -5.469
  161    HA   ALA  25           HA       ALA  25   7.275   4.826  -5.100
  162    HB1  ALA  25           HB1      ALA  25   4.956   4.117  -3.316
  163    HB2  ALA  25           HB2      ALA  25   4.785   5.097  -4.777
  164    HB3  ALA  25           HB3      ALA  25   5.791   5.668  -3.434
  165    H    ILE  26           HN       ILE  26   6.371   1.796  -3.440
  166    HA   ILE  26           HA       ILE  26   7.978   2.143  -1.200
  167    HB   ILE  26           HB       ILE  26   6.745  -0.186  -2.533
  168   HG12  ILE  26          HG12      ILE  26   7.218   0.715   0.295
  169   HG13  ILE  26          HG11      ILE  26   5.712   0.783  -0.618
  170   HG21  ILE  26          HG21      ILE  26   9.075  -0.966  -2.513
  171   HG22  ILE  26          HG22      ILE  26   8.065  -1.871  -1.380
  172   HG23  ILE  26          HG23      ILE  26   9.160  -0.625  -0.783
  173   HD11  ILE  26          HD11      ILE  26   5.691  -1.012   1.012
  174   HD12  ILE  26          HD12      ILE  26   7.129  -1.712   0.261
  175   HD13  ILE  26          HD13      ILE  26   5.617  -1.632  -0.644
  176    H    GLN  27           HN       GLN  27   8.701   0.766  -4.353
  177    HA   GLN  27           HA       GLN  27  11.380   0.125  -3.883
  178    HB2  GLN  27           HB2      GLN  27  10.003   0.900  -6.465
  179    HB3  GLN  27           HB1      GLN  27  11.552   0.067  -6.346
  180    HG2  GLN  27           HG2      GLN  27  10.427  -1.810  -5.243
  181    HG3  GLN  27           HG1      GLN  27   8.898  -0.959  -5.375
  182   HE21  GLN  27          HE21      GLN  27   7.880  -0.812  -7.338
  183   HE22  GLN  27          HE22      GLN  27   8.336  -1.764  -8.706
  184    H    SER  28           HN       SER  28   9.815   3.100  -4.862
  185    HA   SER  28           HA       SER  28  12.182   4.595  -5.348
  186    HB2  SER  28           HB2      SER  28   9.324   5.381  -4.778
  187    HB3  SER  28           HB1      SER  28  10.572   6.528  -5.230
  188    HG   SER  28           HG       SER  28  10.463   4.376  -6.906
  189    H    TYR  29           HN       TYR  29   9.859   4.608  -2.642
  190    HA   TYR  29           HA       TYR  29  11.093   6.294  -0.849
  191    HB2  TYR  29           HB2      TYR  29   8.852   5.247  -0.615
  192    HB3  TYR  29           HB1      TYR  29   9.619   3.708  -0.273
  193    HD1  TYR  29           HD1      TYR  29   7.559   4.804   1.586
  194    HD2  TYR  29           HD2      TYR  29  11.763   5.479   1.421
  195    HE1  TYR  29           HE1      TYR  29   7.572   5.402   3.967
  196    HE2  TYR  29           HE2      TYR  29  11.773   6.078   3.808
  197    HH   TYR  29           HH       TYR  29   9.130   5.478   5.852
  198    H    ILE  30           HN       ILE  30  11.447   2.778  -1.068
  199    HA   ILE  30           HA       ILE  30  13.345   2.524   0.970
  200    HB   ILE  30           HB       ILE  30  12.638   0.754  -1.353
  201   HG12  ILE  30          HG12      ILE  30  11.869   0.797   1.570
  202   HG13  ILE  30          HG11      ILE  30  10.838   1.187   0.204
  203   HG21  ILE  30          HG21      ILE  30  14.843   0.131  -0.723
  204   HG22  ILE  30          HG22      ILE  30  13.736  -1.059  -0.031
  205   HG23  ILE  30          HG23      ILE  30  14.437   0.198   0.989
  206   HD11  ILE  30          HD11      ILE  30  11.055  -1.148  -0.559
  207   HD12  ILE  30          HD12      ILE  30  10.263  -0.967   1.008
  208   HD13  ILE  30          HD13      ILE  30  11.944  -1.507   0.924
  209    H    GLY  31           HN       GLY  31  13.726   3.004  -2.510
  210    HA2  GLY  31           HA2      GLY  31  16.552   2.588  -2.511
  211    HA3  GLY  31           HA1      GLY  31  15.616   3.353  -3.789
  212    H    ALA  32           HN       ALA  32  14.583   5.105  -1.435
  213    HA   ALA  32           HA       ALA  32  16.646   7.156  -1.699
  214    HB1  ALA  32           HB1      ALA  32  13.922   7.420  -0.467
  215    HB2  ALA  32           HB2      ALA  32  14.219   7.600  -2.198
  216    HB3  ALA  32           HB3      ALA  32  14.976   8.711  -1.051
  217    H    GLN  33           HN       GLN  33  15.333   4.947   0.568
  218    HA   GLN  33           HA       GLN  33  15.580   6.304   2.946
  219    HB2  GLN  33           HB2      GLN  33  15.636   3.428   2.207
  220    HB3  GLN  33           HB1      GLN  33  15.865   3.934   3.877
  221    HG2  GLN  33           HG2      GLN  33  13.615   5.105   2.391
  222    HG3  GLN  33           HG1      GLN  33  13.492   3.429   2.872
  223   HE21  GLN  33          HE21      GLN  33  13.727   6.716   3.949
  224   HE22  GLN  33          HE22      GLN  33  13.279   6.428   5.596
  225    H    ASP  34           HN       ASP  34  17.019   6.075   4.656
  226    HA   ASP  34           HA       ASP  34  19.699   6.559   4.118
  227    HB2  ASP  34           HB2      ASP  34  18.425   7.140   6.196
  228    HB3  ASP  34           HB1      ASP  34  18.566   5.456   6.676
  229    H    ASP  35           HN       ASP  35  17.977   3.669   4.836
  230    HA   ASP  35           HA       ASP  35  20.125   2.143   3.599
  231    HB2  ASP  35           HB2      ASP  35  18.846   1.170   6.173
  232    HB3  ASP  35           HB1      ASP  35  19.947   0.260   5.163
  233    HA   PRO  36           HA       PRO  36  16.309   0.870   1.584
  234    HB2  PRO  36           HB2      PRO  36  17.464  -0.218  -0.539
  235    HB3  PRO  36           HB1      PRO  36  17.501   1.529  -0.311
  236    HG2  PRO  36           HG2      PRO  36  19.603  -0.469   0.472
  237    HG3  PRO  36           HG1      PRO  36  19.799   0.955  -0.564
  238    HD2  PRO  36           HD2      PRO  36  20.397   1.106   2.017
  239    HD3  PRO  36           HD1      PRO  36  19.532   2.440   1.224
  240    H    THR  37           HN       THR  37  18.719  -0.731   3.071
  241    HA   THR  37           HA       THR  37  18.210  -3.394   2.206
  242    HB   THR  37           HB       THR  37  19.974  -4.004   3.708
  243    HG1  THR  37           HG1      THR  37  20.593  -2.694   5.400
  244   HG21  THR  37          HG21      THR  37  21.735  -2.417   3.107
  245   HG22  THR  37          HG22      THR  37  20.516  -1.211   2.682
  246   HG23  THR  37          HG23      THR  37  20.666  -2.692   1.730
  247    H    ASN  38           HN       ASN  38  17.271  -1.374   4.833
  248    HA   ASN  38           HA       ASN  38  15.077  -3.112   5.466
  249    HB2  ASN  38           HB2      ASN  38  17.072  -3.982   6.733
  250    HB3  ASN  38           HB1      ASN  38  17.057  -2.476   7.649
  251   HD21  ASN  38          HD21      ASN  38  15.472  -5.505   7.071
  252   HD22  ASN  38          HD22      ASN  38  14.378  -5.428   8.410
  253    HA   PRO  39           HA       PRO  39  14.520   1.551   5.870
  254    HB2  PRO  39           HB2      PRO  39  12.146   1.438   4.455
  255    HB3  PRO  39           HB1      PRO  39  13.720   1.883   3.798
  256    HG2  PRO  39           HG2      PRO  39  12.294  -0.725   3.664
  257    HG3  PRO  39           HG1      PRO  39  13.305   0.070   2.462
  258    HD2  PRO  39           HD2      PRO  39  14.191  -1.981   3.903
  259    HD3  PRO  39           HD1      PRO  39  15.252  -0.660   3.409
  260    H    SER  40           HN       SER  40  12.439   2.659   6.517
  261    HA   SER  40           HA       SER  40  11.406   1.447   8.881
  262    HB2  SER  40           HB2      SER  40  10.583   3.975   7.435
  263    HB3  SER  40           HB1      SER  40  10.063   3.520   9.055
  264    HG   SER  40           HG       SER  40  12.347   3.486   9.608
  265    H    GLU  41           HN       GLU  41   8.884   1.806   9.207
  266    HA   GLU  41           HA       GLU  41   7.512   0.073   7.406
  267    HB2  GLU  41           HB2      GLU  41   6.676  -0.103   9.559
  268    HB3  GLU  41           HB1      GLU  41   6.810   1.620   9.864
  269    HG2  GLU  41           HG2      GLU  41   4.919   2.043   8.461
  270    HG3  GLU  41           HG1      GLU  41   4.759   0.329   8.091
  271    H    ILE  42           HN       ILE  42   6.271   0.556   5.751
  272    HA   ILE  42           HA       ILE  42   6.435   3.321   4.862
  273    HB   ILE  42           HB       ILE  42   6.284   0.696   3.430
  274   HG12  ILE  42          HG12      ILE  42   8.297   2.915   3.713
  275   HG13  ILE  42          HG11      ILE  42   8.475   1.216   4.132
  276   HG21  ILE  42          HG21      ILE  42   4.810   2.248   2.293
  277   HG22  ILE  42          HG22      ILE  42   6.259   1.938   1.341
  278   HG23  ILE  42          HG23      ILE  42   6.099   3.447   2.235
  279   HD11  ILE  42          HD11      ILE  42   8.246   2.327   1.364
  280   HD12  ILE  42          HD12      ILE  42   8.462   0.626   1.789
  281   HD13  ILE  42          HD13      ILE  42   9.732   1.796   2.151
  282    H    THR  43           HN       THR  43   4.658   4.487   4.398
  283    HA   THR  43           HA       THR  43   2.086   3.094   4.194
  284    HB   THR  43           HB       THR  43   0.982   4.859   5.507
  285    HG1  THR  43           HG1      THR  43   2.439   6.199   6.814
  286   HG21  THR  43          HG21      THR  43   1.782   4.155   7.726
  287   HG22  THR  43          HG22      THR  43   3.228   3.466   6.981
  288   HG23  THR  43          HG23      THR  43   1.640   2.782   6.625
  289    H    LEU  44           HN       LEU  44   0.357   4.640   3.437
  290    HA   LEU  44           HA       LEU  44   1.130   5.576   0.907
  291    HB2  LEU  44           HB2      LEU  44  -1.378   6.238   2.393
  292    HB3  LEU  44           HB1      LEU  44  -1.134   6.268   0.675
  293    HG   LEU  44           HG       LEU  44  -1.342   3.908   2.464
  294   HD11  LEU  44          HD11      LEU  44  -3.250   5.186   1.117
  295   HD12  LEU  44          HD12      LEU  44  -3.277   3.460   1.466
  296   HD13  LEU  44          HD13      LEU  44  -2.724   4.029  -0.110
  297   HD21  LEU  44          HD21      LEU  44  -0.060   4.125  -0.215
  298   HD22  LEU  44          HD22      LEU  44  -0.868   2.641   0.261
  299   HD23  LEU  44          HD23      LEU  44   0.486   3.246   1.211
  300    H    ALA  45           HN       ALA  45   0.502   7.109   3.934
  301    HA   ALA  45           HA       ALA  45   0.584   9.791   3.069
  302    HB1  ALA  45           HB1      ALA  45   1.078   8.552   5.775
  303    HB2  ALA  45           HB2      ALA  45  -0.478   9.140   5.140
  304    HB3  ALA  45           HB3      ALA  45   0.836  10.279   5.476
  305    H    LYS  46           HN       LYS  46   3.021   7.451   3.807
  306    HA   LYS  46           HA       LYS  46   5.205   9.352   3.864
  307    HB2  LYS  46           HB2      LYS  46   5.060   6.367   3.931
  308    HB3  LYS  46           HB1      LYS  46   6.557   7.254   3.987
  309    HG2  LYS  46           HG2      LYS  46   5.940   8.251   6.083
  310    HG3  LYS  46           HG1      LYS  46   4.348   7.488   5.999
  311    HD2  LYS  46           HD2      LYS  46   5.574   5.275   5.880
  312    HD3  LYS  46           HD1      LYS  46   7.028   6.171   6.335
  313    HE2  LYS  46           HE2      LYS  46   4.459   6.119   7.895
  314    HE3  LYS  46           HE1      LYS  46   5.878   5.115   8.239
  315    HZ1  LYS  46           HZ1      LYS  46   5.839   8.083   8.272
  316    HZ2  LYS  46           HZ2      LYS  46   7.154   7.100   8.665
  317    HZ3  LYS  46           HZ3      LYS  46   5.777   7.097   9.643
  318    H    LEU  47           HN       LEU  47   3.723   7.046   1.706
  319    HA   LEU  47           HA       LEU  47   5.838   6.994  -0.179
  320    HB2  LEU  47           HB2      LEU  47   3.008   6.016  -0.150
  321    HB3  LEU  47           HB1      LEU  47   3.994   5.896  -1.598
  322    HG   LEU  47           HG       LEU  47   4.656   4.671   1.078
  323   HD11  LEU  47          HD11      LEU  47   4.199   2.539  -0.041
  324   HD12  LEU  47          HD12      LEU  47   3.651   3.418  -1.469
  325   HD13  LEU  47          HD13      LEU  47   2.768   3.566   0.052
  326   HD21  LEU  47          HD21      LEU  47   6.019   4.422  -1.598
  327   HD22  LEU  47          HD22      LEU  47   6.440   3.529  -0.138
  328   HD23  LEU  47          HD23      LEU  47   6.643   5.279  -0.192
  329    H    ALA  48           HN       ALA  48   3.567   9.307   0.504
  330    HA   ALA  48           HA       ALA  48   2.500  10.259  -1.795
  331    HB1  ALA  48           HB1      ALA  48   2.243  12.334  -0.759
  332    HB2  ALA  48           HB2      ALA  48   3.708  12.143   0.195
  333    HB3  ALA  48           HB3      ALA  48   2.284  11.170   0.566
  334    HA   PRO  49           HA       PRO  49   6.361  12.964  -2.872
  335    HB2  PRO  49           HB2      PRO  49   8.550  11.654  -1.389
  336    HB3  PRO  49           HB1      PRO  49   8.162  13.361  -1.537
  337    HG2  PRO  49           HG2      PRO  49   7.734  12.123   0.754
  338    HG3  PRO  49           HG1      PRO  49   6.521  13.262   0.126
  339    HD2  PRO  49           HD2      PRO  49   6.588  10.275  -0.125
  340    HD3  PRO  49           HD1      PRO  49   5.269  11.299   0.470
  341    H    TYR  50           HN       TYR  50   6.388   9.578  -2.563
  342    HA   TYR  50           HA       TYR  50   8.433   9.221  -4.627
  343    HB2  TYR  50           HB2      TYR  50   7.129   7.149  -2.863
  344    HB3  TYR  50           HB1      TYR  50   8.540   6.924  -3.892
  345    HD1  TYR  50           HD1      TYR  50  10.594   8.354  -3.383
  346    HD2  TYR  50           HD2      TYR  50   7.407   7.806  -0.635
  347    HE1  TYR  50           HE1      TYR  50  12.096   8.985  -1.535
  348    HE2  TYR  50           HE2      TYR  50   8.887   8.442   1.223
  349    HH   TYR  50           HH       TYR  50  11.909   9.899   0.760
  350    H    MET  51           HN       MET  51   5.098   9.402  -4.330
  351    HA   MET  51           HA       MET  51   4.477   7.483  -6.383
  352    HB2  MET  51           HB2      MET  51   2.681   9.727  -5.498
  353    HB3  MET  51           HB1      MET  51   2.233   8.226  -6.273
  354    HG2  MET  51           HG2      MET  51   3.396   8.449  -3.527
  355    HG3  MET  51           HG1      MET  51   1.679   8.303  -3.898
  356    HE1  MET  51           HE1      MET  51   1.661   4.711  -5.535
  357    HE2  MET  51           HE2      MET  51   1.805   6.275  -6.333
  358    HE3  MET  51           HE3      MET  51   0.634   6.052  -5.034
  359    H    SER  52           HN       SER  52   3.498   8.127  -8.403
  360    HA   SER  52           HA       SER  52   4.797  10.524  -9.488
  361    HB2  SER  52           HB2      SER  52   4.608   7.849 -10.883
  362    HB3  SER  52           HB1      SER  52   5.448   9.286 -11.465
  363    HG   SER  52           HG       SER  52   6.876   9.100  -9.713
  364    H    LYS  53           HN       LYS  53   2.052   8.398  -9.504
  365    HA   LYS  53           HA       LYS  53   0.770   9.624 -11.733
  366    HB2  LYS  53           HB2      LYS  53  -0.835   8.008 -11.465
  367    HB3  LYS  53           HB1      LYS  53   0.500   7.236 -10.658
  368    HG2  LYS  53           HG2      LYS  53  -1.923   8.502  -9.412
  369    HG3  LYS  53           HG1      LYS  53  -1.442   6.812  -9.387
  370    HD2  LYS  53           HD2      LYS  53   0.629   7.619  -8.117
  371    HD3  LYS  53           HD1      LYS  53  -0.265   9.129  -7.902
  372    HE2  LYS  53           HE2      LYS  53  -0.524   7.644  -5.982
  373    HE3  LYS  53           HE1      LYS  53  -2.063   7.930  -6.794
  374    HZ1  LYS  53           HZ1      LYS  53  -1.739   5.627  -6.158
  375    HZ2  LYS  53           HZ2      LYS  53  -0.405   5.526  -7.197
  376    HZ3  LYS  53           HZ3      LYS  53  -1.955   5.819  -7.822
  377    H    ASN  54           HN       ASN  54  -1.837   9.956 -10.642
  378    HA   ASN  54           HA       ASN  54  -2.624  12.259  -9.996
  379    HB2  ASN  54           HB2      ASN  54  -3.031   9.749  -8.427
  380    HB3  ASN  54           HB1      ASN  54  -3.826  11.223  -7.946
  381   HD21  ASN  54          HD21      ASN  54  -5.880  10.495  -8.392
  382   HD22  ASN  54          HD22      ASN  54  -6.449  10.220 -10.006
  383    H    ALA  55           HN       ALA  55  -0.891  10.489  -7.496
  384    HA   ALA  55           HA       ALA  55  -1.147  12.230  -5.382
  385    HB1  ALA  55           HB1      ALA  55  -0.453  10.005  -5.045
  386    HB2  ALA  55           HB2      ALA  55   0.862  11.045  -4.494
  387    HB3  ALA  55           HB3      ALA  55   0.975  10.224  -6.052
  388    H    LYS  56           HN       LYS  56   0.580  13.305  -4.223
  389    HA   LYS  56           HA       LYS  56   2.865  14.336  -5.546
  390    HB2  LYS  56           HB2      LYS  56   1.095  15.803  -6.510
  391    HB3  LYS  56           HB1      LYS  56   0.671  16.304  -4.882
  392    HG2  LYS  56           HG2      LYS  56   2.036  18.001  -5.828
  393    HG3  LYS  56           HG1      LYS  56   2.999  17.155  -4.616
  394    HD2  LYS  56           HD2      LYS  56   4.378  17.494  -6.538
  395    HD3  LYS  56           HD1      LYS  56   3.971  15.781  -6.462
  396    HE2  LYS  56           HE2      LYS  56   3.797  16.601  -8.743
  397    HE3  LYS  56           HE1      LYS  56   2.212  16.133  -8.132
  398    HZ1  LYS  56           HZ1      LYS  56   2.126  18.231  -9.325
  399    HZ2  LYS  56           HZ2      LYS  56   3.253  18.910  -8.262
  400    HZ3  LYS  56           HZ3      LYS  56   1.727  18.452  -7.700
  401    H    ASN  57           HN       ASN  57   0.655  15.590  -3.055
  402    HA   ASN  57           HA       ASN  57   2.710  15.037  -1.031
  403    HB2  ASN  57           HB2      ASN  57   0.331  16.917  -0.911
  404    HB3  ASN  57           HB1      ASN  57   1.434  16.605   0.421
  405   HD21  ASN  57          HD21      ASN  57   0.997  18.187  -2.631
  406   HD22  ASN  57          HD22      ASN  57   2.433  19.152  -2.570
  407    H    GLU  58           HN       GLU  58   1.371  14.755   1.195
  408    HA   GLU  58           HA       GLU  58   0.157  12.249   1.047
  409    HB2  GLU  58           HB2      GLU  58   0.543  12.402   3.241
  410    HB3  GLU  58           HB1      GLU  58   0.813  14.128   3.085
  411    HG2  GLU  58           HG2      GLU  58  -1.522  14.566   3.346
  412    HG3  GLU  58           HG1      GLU  58  -1.865  12.839   3.422
  413    H    ASP  59           HN       ASP  59  -1.108  15.473   0.993
  414    HA   ASP  59           HA       ASP  59  -3.849  14.947   1.194
  415    HB2  ASP  59           HB2      ASP  59  -2.614  17.167   1.342
  416    HB3  ASP  59           HB1      ASP  59  -2.621  17.154  -0.412
  417    H    GLY  60           HN       GLY  60  -1.626  14.680  -1.462
  418    HA2  GLY  60           HA2      GLY  60  -3.825  14.502  -3.382
  419    HA3  GLY  60           HA1      GLY  60  -2.133  14.730  -3.781
  420    H    ILE  61           HN       ILE  61  -1.826  12.391  -1.624
  421    HA   ILE  61           HA       ILE  61  -1.981  10.350  -3.697
  422    HB   ILE  61           HB       ILE  61   0.193  10.490  -2.800
  423   HG12  ILE  61          HG12      ILE  61   0.602   8.331  -1.942
  424   HG13  ILE  61          HG11      ILE  61  -1.025   8.193  -1.284
  425   HG21  ILE  61          HG21      ILE  61  -0.954  10.274  -0.038
  426   HG22  ILE  61          HG22      ILE  61  -0.299  11.732  -0.775
  427   HG23  ILE  61          HG23      ILE  61   0.754  10.356  -0.451
  428   HD11  ILE  61          HD11      ILE  61  -0.331   8.335  -4.214
  429   HD12  ILE  61          HD12      ILE  61  -1.945   8.101  -3.524
  430   HD13  ILE  61          HD13      ILE  61  -0.701   6.859  -3.324
  431    H    VAL  62           HN       VAL  62  -2.505  10.538  -0.246
  432    HA   VAL  62           HA       VAL  62  -3.730   8.016  -0.036
  433    HB   VAL  62           HB       VAL  62  -3.658  10.416   1.796
  434   HG11  VAL  62          HG11      VAL  62  -5.603   8.908   2.234
  435   HG12  VAL  62          HG12      VAL  62  -4.441   9.062   3.566
  436   HG13  VAL  62          HG13      VAL  62  -4.423   7.611   2.552
  437   HG21  VAL  62          HG21      VAL  62  -2.287   7.866   2.314
  438   HG22  VAL  62          HG22      VAL  62  -1.800   9.516   2.717
  439   HG23  VAL  62          HG23      VAL  62  -1.628   8.919   1.061
  440    H    ASN  63           HN       ASN  63  -4.898  11.256  -0.408
  441    HA   ASN  63           HA       ASN  63  -7.654  10.568  -0.085
  442    HB2  ASN  63           HB2      ASN  63  -6.694  12.801   0.420
  443    HB3  ASN  63           HB1      ASN  63  -6.453  13.060  -1.305
  444   HD21  ASN  63          HD21      ASN  63  -8.763  12.840   1.262
  445   HD22  ASN  63          HD22      ASN  63 -10.110  13.481   0.387
  446    H    SER  64           HN       SER  64  -5.397  10.446  -2.665
  447    HA   SER  64           HA       SER  64  -7.459  10.400  -4.742
  448    HB2  SER  64           HB2      SER  64  -5.241  11.477  -5.191
  449    HB3  SER  64           HB1      SER  64  -4.474   9.895  -4.991
  450    HG   SER  64           HG       SER  64  -6.049   9.223  -6.693
  451    H    LEU  65           HN       LEU  65  -5.898   8.420  -2.596
  452    HA   LEU  65           HA       LEU  65  -5.918   5.984  -4.104
  453    HB2  LEU  65           HB2      LEU  65  -4.892   7.020  -1.605
  454    HB3  LEU  65           HB1      LEU  65  -5.567   5.409  -1.424
  455    HG   LEU  65           HG       LEU  65  -3.697   5.930  -3.665
  456   HD11  LEU  65          HD11      LEU  65  -2.989   5.755  -0.765
  457   HD12  LEU  65          HD12      LEU  65  -2.430   6.905  -1.977
  458   HD13  LEU  65          HD13      LEU  65  -1.874   5.234  -2.024
  459   HD21  LEU  65          HD21      LEU  65  -4.845   3.788  -3.473
  460   HD22  LEU  65          HD22      LEU  65  -4.236   3.595  -1.829
  461   HD23  LEU  65          HD23      LEU  65  -3.120   3.588  -3.190
  462    H    ALA  66           HN       ALA  66  -7.033   4.094  -3.455
  463    HA   ALA  66           HA       ALA  66  -9.717   4.248  -2.818
  464    HB1  ALA  66           HB1      ALA  66  -8.628   2.209  -3.712
  465    HB2  ALA  66           HB2      ALA  66  -9.621   1.891  -2.274
  466    HB3  ALA  66           HB3      ALA  66  -7.860   1.976  -2.133
  467    H    LYS  67           HN       LYS  67 -10.861   4.247  -0.987
  468    HA   LYS  67           HA       LYS  67  -9.329   4.555   1.491
  469    HB2  LYS  67           HB2      LYS  67 -12.010   5.791   0.905
  470    HB3  LYS  67           HB1      LYS  67 -10.963   6.112   2.271
  471    HG2  LYS  67           HG2      LYS  67 -10.505   6.888  -0.592
  472    HG3  LYS  67           HG1      LYS  67 -10.833   7.954   0.767
  473    HD2  LYS  67           HD2      LYS  67  -8.411   6.188   0.682
  474    HD3  LYS  67           HD1      LYS  67  -8.420   7.784  -0.060
  475    HE2  LYS  67           HE2      LYS  67  -8.847   7.118   2.846
  476    HE3  LYS  67           HE1      LYS  67  -7.462   7.954   2.135
  477    HZ1  LYS  67           HZ1      LYS  67  -8.945   9.519   3.171
  478    HZ2  LYS  67           HZ2      LYS  67 -10.258   8.965   2.260
  479    HZ3  LYS  67           HZ3      LYS  67  -8.972   9.755   1.499
  480    H    ASP  68           HN       ASP  68  -9.822   3.275   3.121
  481    HA   ASP  68           HA       ASP  68 -11.853   1.248   2.679
  482    HB2  ASP  68           HB2      ASP  68  -9.656   0.518   3.500
  483    HB3  ASP  68           HB1      ASP  68  -9.835   1.543   4.923
  484    H    LYS  69           HN       LYS  69 -13.499   0.801   4.240
  485    HA   LYS  69           HA       LYS  69 -14.666   3.301   5.077
  486    HB2  LYS  69           HB2      LYS  69 -16.645   1.788   5.664
  487    HB3  LYS  69           HB1      LYS  69 -16.210   2.001   3.980
  488    HG2  LYS  69           HG2      LYS  69 -14.918  -0.274   5.278
  489    HG3  LYS  69           HG1      LYS  69 -16.677  -0.384   5.167
  490    HD2  LYS  69           HD2      LYS  69 -14.843   0.235   2.857
  491    HD3  LYS  69           HD1      LYS  69 -15.504  -1.365   3.210
  492    HE2  LYS  69           HE2      LYS  69 -17.772  -0.465   2.975
  493    HE3  LYS  69           HE1      LYS  69 -17.104   1.121   2.607
  494    HZ1  LYS  69           HZ1      LYS  69 -16.741  -1.339   0.987
  495    HZ2  LYS  69           HZ2      LYS  69 -16.050   0.164   0.646
  496    HZ3  LYS  69           HZ3      LYS  69 -17.728  -0.023   0.595
  497    H    SER  70           HN       SER  70 -13.614   0.310   6.671
  498    HA   SER  70           HA       SER  70 -14.522   1.485   9.202
  499    HB2  SER  70           HB2      SER  70 -14.383  -0.812  10.102
  500    HB3  SER  70           HB1      SER  70 -15.445  -0.722   8.696
  501    HG   SER  70           HG       SER  70 -14.090  -1.918   7.573
  502    H    GLY  71           HN       GLY  71 -11.713   0.163   7.557
  503    HA2  GLY  71           HA2      GLY  71  -9.485   0.125   8.142
  504    HA3  GLY  71           HA1      GLY  71  -9.851   1.419   9.277
  505    H    ASN  72           HN       ASN  72 -11.604  -1.535   9.514
  506    HA   ASN  72           HA       ASN  72 -11.051  -1.746  12.266
  507    HB2  ASN  72           HB2      ASN  72 -13.159  -2.508  11.560
  508    HB3  ASN  72           HB1      ASN  72 -12.471  -3.521  10.298
  509   HD21  ASN  72          HD21      ASN  72 -13.042  -3.205  13.731
  510   HD22  ASN  72          HD22      ASN  72 -12.796  -4.877  14.115
  511    H    SER  73           HN       SER  73  -9.569  -3.269   9.498
  512    HA   SER  73           HA       SER  73  -8.144  -5.154  11.202
  513    HB2  SER  73           HB2      SER  73  -9.040  -5.834   8.952
  514    HB3  SER  73           HB1      SER  73  -7.872  -4.740   8.214
  515    HG   SER  73           HG       SER  73  -6.206  -5.985   9.068
  516    H    SER  74           HN       SER  74  -7.852  -2.060  10.873
  517    HA   SER  74           HA       SER  74  -6.239  -0.483  11.017
  518    HB2  SER  74           HB2      SER  74  -5.087  -2.021  12.584
  519    HB3  SER  74           HB1      SER  74  -4.285  -2.796  11.221
  520    HG   SER  74           HG       SER  74  -2.920  -1.194  11.116
  521    H    THR  75           HN       THR  75  -4.917   0.670   9.590
  522    HA   THR  75           HA       THR  75  -4.027  -0.709   7.191
  523    HB   THR  75           HB       THR  75  -6.395   0.170   6.840
  524    HG1  THR  75           HG1      THR  75  -5.794   1.041   4.737
  525   HG21  THR  75          HG21      THR  75  -5.963   2.339   8.014
  526   HG22  THR  75          HG22      THR  75  -6.699   2.500   6.419
  527   HG23  THR  75          HG23      THR  75  -4.974   2.819   6.629
  528    H    SER  76           HN       SER  76  -3.726   1.813   9.475
  529    HA   SER  76           HA       SER  76  -2.029   3.210   9.995
  530    HB2  SER  76           HB2      SER  76  -0.563   1.887   7.702
  531    HB3  SER  76           HB1      SER  76   0.164   2.959   8.898
  532    HG   SER  76           HG       SER  76  -0.138   1.452  10.458
  533    H    ALA  77           HN       ALA  77  -2.661   3.003   6.511
  534    HA   ALA  77           HA       ALA  77  -2.005   5.725   5.938
  535    HB1  ALA  77           HB1      ALA  77  -2.114   3.979   4.202
  536    HB2  ALA  77           HB2      ALA  77  -3.164   5.358   3.826
  537    HB3  ALA  77           HB3      ALA  77  -3.858   3.854   4.463
  538    HA   PRO  78           HA       PRO  78  -5.542   7.714   7.740
  539    HB2  PRO  78           HB2      PRO  78  -5.114   9.611   5.501
  540    HB3  PRO  78           HB1      PRO  78  -5.261   9.945   7.223
  541    HG2  PRO  78           HG2      PRO  78  -2.901  10.067   6.053
  542    HG3  PRO  78           HG1      PRO  78  -3.064   9.283   7.631
  543    HD2  PRO  78           HD2      PRO  78  -2.825   8.036   4.934
  544    HD3  PRO  78           HD1      PRO  78  -2.044   7.575   6.461
  545    H    GLY  79           HN       GLY  79  -7.304   6.510   7.330
  546    HA2  GLY  79           HA2      GLY  79  -9.274   5.852   6.388
  547    HA3  GLY  79           HA1      GLY  79  -9.169   7.290   5.396
  548    H    SER  80           HN       SER  80  -6.451   5.451   4.727
  549    HA   SER  80           HA       SER  80  -7.624   4.814   2.135
  550    HB2  SER  80           HB2      SER  80  -5.009   5.546   3.168
  551    HB3  SER  80           HB1      SER  80  -4.951   4.245   1.984
  552    HG   SER  80           HG       SER  80  -6.406   5.720   0.721
  553    H    ALA  81           HN       ALA  81  -6.842   2.959   0.966
  554    HA   ALA  81           HA       ALA  81  -7.204   0.569   2.614
  555    HB1  ALA  81           HB1      ALA  81  -7.589   0.992  -0.342
  556    HB2  ALA  81           HB2      ALA  81  -8.863   1.002   0.876
  557    HB3  ALA  81           HB3      ALA  81  -7.967  -0.488   0.542
  558    H    HIS  82           HN       HIS  82  -4.580   1.639   2.573
  559    HA   HIS  82           HA       HIS  82  -3.310  -0.737   1.522
  560    HB2  HIS  82           HB2      HIS  82  -2.770   1.952   0.488
  561    HB3  HIS  82           HB1      HIS  82  -1.341   1.038   0.936
  562    HD1  HIS  82           HD1      HIS  82  -1.023  -1.273  -0.369
  563    HD2  HIS  82           HD2      HIS  82  -3.935   1.286  -1.870
  564    HE1  HIS  82           HE1      HIS  82  -1.465  -2.056  -2.718
  565    HE2  HIS  82           HE2      HIS  82  -3.375  -0.621  -3.522
  566    H    GLN  83           HN       GLN  83  -2.027  -1.630   2.871
  567    HA   GLN  83           HA       GLN  83  -0.622  -0.094   4.917
  568    HB2  GLN  83           HB2      GLN  83  -2.653  -0.758   6.038
  569    HB3  GLN  83           HB1      GLN  83  -2.517  -2.394   5.414
  570    HG2  GLN  83           HG2      GLN  83  -0.391  -2.610   6.740
  571    HG3  GLN  83           HG1      GLN  83  -0.806  -1.074   7.500
  572   HE21  GLN  83          HE21      GLN  83  -3.192  -3.446   6.557
  573   HE22  GLN  83          HE22      GLN  83  -3.661  -3.885   8.162
  574    H    ILE  84           HN       ILE  84   1.425  -0.740   4.846
  575    HA   ILE  84           HA       ILE  84   2.047  -3.172   3.441
  576    HB   ILE  84           HB       ILE  84   3.518  -0.726   4.256
  577   HG12  ILE  84          HG12      ILE  84   3.945  -1.760   1.620
  578   HG13  ILE  84          HG11      ILE  84   2.225  -1.762   1.987
  579   HG21  ILE  84          HG21      ILE  84   4.848  -3.256   3.284
  580   HG22  ILE  84          HG22      ILE  84   5.032  -2.540   4.885
  581   HG23  ILE  84          HG23      ILE  84   5.625  -1.683   3.462
  582   HD11  ILE  84          HD11      ILE  84   2.481   0.643   2.650
  583   HD12  ILE  84          HD12      ILE  84   2.747   0.303   0.942
  584   HD13  ILE  84          HD13      ILE  84   4.124   0.570   2.010
  585    H    ASP  85           HN       ASP  85   2.925  -4.924   4.246
  586    HA   ASP  85           HA       ASP  85   3.070  -5.240   7.138
  587    HB2  ASP  85           HB2      ASP  85   1.962  -6.931   5.540
  588    HB3  ASP  85           HB1      ASP  85   3.588  -7.327   5.012
  589    H    THR  86           HN       THR  86   4.986  -4.692   8.049
  590    HA   THR  86           HA       THR  86   7.377  -4.774   6.430
  591    HB   THR  86           HB       THR  86   8.457  -3.727   8.378
  592    HG1  THR  86           HG1      THR  86   7.513  -4.059  10.242
  593   HG21  THR  86          HG21      THR  86   7.400  -2.354   6.681
  594   HG22  THR  86          HG22      THR  86   7.173  -1.626   8.274
  595   HG23  THR  86          HG23      THR  86   5.846  -2.503   7.506
  596    H    THR  87           HN       THR  87   5.811  -6.665   8.810
  597    HA   THR  87           HA       THR  87   7.878  -8.192   9.856
  598    HB   THR  87           HB       THR  87   5.077  -9.065   9.112
  599    HG1  THR  87           HG1      THR  87   4.504  -8.361  11.104
  600   HG21  THR  87          HG21      THR  87   5.394 -10.826  10.788
  601   HG22  THR  87          HG22      THR  87   7.067 -10.314  11.003
  602   HG23  THR  87          HG23      THR  87   6.541 -10.976   9.456
  603    H    ASN  88           HN       ASN  88   5.825  -8.938   7.038
  604    HA   ASN  88           HA       ASN  88   7.789 -10.900   6.120
  605    HB2  ASN  88           HB2      ASN  88   5.052 -10.166   5.058
  606    HB3  ASN  88           HB1      ASN  88   6.072 -11.446   4.410
  607   HD21  ASN  88          HD21      ASN  88   4.133 -10.412   7.121
  608   HD22  ASN  88          HD22      ASN  88   3.966 -11.981   7.843
  609    H    HIS  89           HN       HIS  89   6.839  -7.696   5.592
  610    HA   HIS  89           HA       HIS  89   7.762  -6.013   4.402
  611    HB2  HIS  89           HB2      HIS  89   9.671  -8.193   3.737
  612    HB3  HIS  89           HB1      HIS  89   9.657  -6.777   2.695
  613    HD1  HIS  89           HD1      HIS  89  11.832  -7.796   4.964
  614    HD2  HIS  89           HD2      HIS  89   9.314  -4.491   5.041
  615    HE1  HIS  89           HE1      HIS  89  12.895  -6.174   6.565
  616    HE2  HIS  89           HE2      HIS  89  11.407  -4.138   6.513
  617    H    LYS  90           HN       LYS  90   5.455  -7.044   3.679
  618    HA   LYS  90           HA       LYS  90   5.477  -7.148   0.742
  619    HB2  LYS  90           HB2      LYS  90   3.848  -8.375   2.872
  620    HB3  LYS  90           HB1      LYS  90   3.000  -7.950   1.406
  621    HG2  LYS  90           HG2      LYS  90   4.548  -9.342   0.117
  622    HG3  LYS  90           HG1      LYS  90   5.434  -9.725   1.594
  623    HD2  LYS  90           HD2      LYS  90   2.567 -10.432   0.980
  624    HD3  LYS  90           HD1      LYS  90   3.935 -11.543   1.038
  625    HE2  LYS  90           HE2      LYS  90   4.246 -10.993   3.416
  626    HE3  LYS  90           HE1      LYS  90   2.834  -9.942   3.344
  627    HZ1  LYS  90           HZ1      LYS  90   2.177 -12.044   4.231
  628    HZ2  LYS  90           HZ2      LYS  90   2.892 -12.884   2.950
  629    HZ3  LYS  90           HZ3      LYS  90   1.529 -11.924   2.673
  630    H    LEU  91           HN       LEU  91   4.154  -5.822  -0.404
  631    HA   LEU  91           HA       LEU  91   2.986  -3.529   0.980
  632    HB2  LEU  91           HB2      LEU  91   4.420  -3.080  -0.931
  633    HB3  LEU  91           HB1      LEU  91   3.451  -4.089  -1.952
  634    HG   LEU  91           HG       LEU  91   2.343  -2.296  -2.618
  635   HD11  LEU  91          HD11      LEU  91   0.650  -2.713  -0.965
  636   HD12  LEU  91          HD12      LEU  91   0.893  -0.973  -1.130
  637   HD13  LEU  91          HD13      LEU  91   1.576  -1.833   0.250
  638   HD21  LEU  91          HD21      LEU  91   4.389  -1.099  -2.081
  639   HD22  LEU  91          HD22      LEU  91   3.726  -0.704  -0.499
  640   HD23  LEU  91          HD23      LEU  91   2.954  -0.088  -1.959
  641    H    ILE  92           HN       ILE  92   1.147  -4.038   1.814
  642    HA   ILE  92           HA       ILE  92  -0.796  -5.718   0.435
  643    HB   ILE  92           HB       ILE  92  -0.254  -4.878   3.245
  644   HG12  ILE  92          HG12      ILE  92  -0.836  -7.426   3.509
  645   HG13  ILE  92          HG11      ILE  92  -0.585  -7.458   1.767
  646   HG21  ILE  92          HG21      ILE  92  -2.617  -4.378   3.031
  647   HG22  ILE  92          HG22      ILE  92  -2.399  -5.825   4.016
  648   HG23  ILE  92          HG23      ILE  92  -2.922  -5.972   2.340
  649   HD11  ILE  92          HD11      ILE  92   1.405  -6.494   3.782
  650   HD12  ILE  92          HD12      ILE  92   1.650  -6.629   2.044
  651   HD13  ILE  92          HD13      ILE  92   1.405  -8.081   3.017
  652    H    SER  93           HN       SER  93  -2.816  -4.939  -0.138
  653    HA   SER  93           HA       SER  93  -3.468  -2.223   0.716
  654    HB2  SER  93           HB2      SER  93  -5.139  -2.144  -0.969
  655    HB3  SER  93           HB1      SER  93  -3.719  -2.856  -1.735
  656    HG   SER  93           HG       SER  93  -5.856  -4.360  -0.628
  657    H    THR  94           HN       THR  94  -4.786  -2.038   2.478
  658    HA   THR  94           HA       THR  94  -6.238  -4.468   3.211
  659    HB   THR  94           HB       THR  94  -5.525  -2.119   4.968
  660    HG1  THR  94           HG1      THR  94  -4.370  -4.683   4.576
  661   HG21  THR  94          HG21      THR  94  -6.696  -4.818   5.662
  662   HG22  THR  94          HG22      THR  94  -7.616  -3.318   5.578
  663   HG23  THR  94          HG23      THR  94  -6.344  -3.507   6.790
  664    H    PHE  95           HN       PHE  95  -8.170  -4.464   2.517
  665    HA   PHE  95           HA       PHE  95  -9.783  -2.022   2.751
  666    HB2  PHE  95           HB2      PHE  95  -9.407  -3.188   0.476
  667    HB3  PHE  95           HB1      PHE  95 -10.448  -4.445   1.131
  668    HD1  PHE  95           HD1      PHE  95 -12.797  -3.903   1.762
  669    HD2  PHE  95           HD2      PHE  95 -10.297  -1.150  -0.319
  670    HE1  PHE  95           HE1      PHE  95 -14.773  -2.593   1.115
  671    HE2  PHE  95           HE2      PHE  95 -12.274   0.159  -0.970
  672    HZ   PHE  95           HZ       PHE  95 -14.511  -0.565  -0.250
  673    H    THR  96           HN       THR  96 -10.752  -2.255   4.773
  674    HA   THR  96           HA       THR  96 -11.522  -4.939   5.586
  675    HB   THR  96           HB       THR  96 -12.071  -2.634   7.369
  676    HG1  THR  96           HG1      THR  96 -10.021  -2.051   6.653
  677   HG21  THR  96          HG21      THR  96 -11.145  -4.269   9.012
  678   HG22  THR  96          HG22      THR  96 -10.939  -5.408   7.680
  679   HG23  THR  96          HG23      THR  96 -12.553  -4.855   8.128
  680    HA   PRO  97           HA       PRO  97 -15.486  -3.864   3.721
  681    HB2  PRO  97           HB2      PRO  97 -16.563  -6.344   4.422
  682    HB3  PRO  97           HB1      PRO  97 -15.821  -5.929   2.879
  683    HG2  PRO  97           HG2      PRO  97 -14.745  -7.470   5.143
  684    HG3  PRO  97           HG1      PRO  97 -14.312  -7.526   3.426
  685    HD2  PRO  97           HD2      PRO  97 -12.781  -6.383   5.373
  686    HD3  PRO  97           HD1      PRO  97 -12.698  -5.942   3.665
  687    H    SER  98           HN       SER  98 -17.589  -3.510   4.473
  688    HA   SER  98           HA       SER  98 -17.684  -2.658   7.164
  689    HB2  SER  98           HB2      SER  98 -18.846  -1.505   5.316
  690    HB3  SER  98           HB1      SER  98 -19.950  -2.872   5.178
  691    HG   SER  98           HG       SER  98 -19.640  -1.655   7.680
  692    H    ASN  99           HN       ASN  99 -18.425  -5.629   5.658
  693    HA   ASN  99           HA       ASN  99 -20.225  -6.587   7.671
  694    HB2  ASN  99           HB2      ASN  99 -18.668  -7.958   5.504
  695    HB3  ASN  99           HB1      ASN  99 -19.596  -8.868   6.685
  696   HD21  ASN  99          HD21      ASN  99 -19.697  -6.919   3.867
  697   HD22  ASN  99          HD22      ASN  99 -21.400  -7.025   3.590
  698    H    GLY 100           HN       GLY 100 -16.904  -6.043   7.531
  699    HA2  GLY 100           HA2      GLY 100 -15.388  -6.237   9.270
  700    HA3  GLY 100           HA1      GLY 100 -16.561  -7.198  10.153
  701    H    GLY 101           HN       GLY 101 -16.179  -8.338   7.038
  702    HA2  GLY 101           HA2      GLY 101 -14.880 -10.728   7.945
  703    HA3  GLY 101           HA1      GLY 101 -15.371 -10.369   6.296
  704    H    GLN 102           HN       GLN 102 -13.287 -11.479   5.876
  705    HA   GLN 102           HA       GLN 102 -10.812 -10.342   6.546
  706    HB2  GLN 102           HB2      GLN 102  -9.888 -11.721   4.772
  707    HB3  GLN 102           HB1      GLN 102 -11.073 -12.634   5.696
  708    HG2  GLN 102           HG2      GLN 102 -12.730 -12.266   3.967
  709    HG3  GLN 102           HG1      GLN 102 -11.571 -11.310   3.049
  710   HE21  GLN 102          HE21      GLN 102  -9.346 -13.068   3.716
  711   HE22  GLN 102          HE22      GLN 102  -9.556 -14.490   2.758
  712    H    ALA 103           HN       ALA 103  -9.482  -8.936   5.505
  713    HA   ALA 103           HA       ALA 103 -10.782  -6.927   3.883
  714    HB1  ALA 103           HB1      ALA 103  -9.238  -6.285   5.662
  715    HB2  ALA 103           HB2      ALA 103  -8.703  -5.702   4.081
  716    HB3  ALA 103           HB3      ALA 103  -7.920  -7.107   4.818
  717    H    THR 104           HN       THR 104 -10.113  -6.180   1.993
  718    HA   THR 104           HA       THR 104  -9.376  -8.268   0.125
  719    HB   THR 104           HB       THR 104 -10.870  -5.740   0.087
  720    HG1  THR 104           HG1      THR 104 -11.251  -8.369  -0.505
  721   HG21  THR 104          HG21      THR 104  -9.335  -5.132  -1.613
  722   HG22  THR 104          HG22      THR 104 -10.823  -5.670  -2.403
  723   HG23  THR 104          HG23      THR 104  -9.417  -6.739  -2.346
  724    H    VAL 105           HN       VAL 105  -7.405  -8.369  -0.854
  725    HA   VAL 105           HA       VAL 105  -5.587  -6.116  -0.300
  726    HB   VAL 105           HB       VAL 105  -4.876  -9.029  -0.086
  727   HG11  VAL 105          HG11      VAL 105  -3.336  -6.538   0.585
  728   HG12  VAL 105          HG12      VAL 105  -2.973  -7.704  -0.686
  729   HG13  VAL 105          HG13      VAL 105  -2.827  -8.170   1.010
  730   HG21  VAL 105          HG21      VAL 105  -6.345  -8.514   1.745
  731   HG22  VAL 105          HG22      VAL 105  -5.461  -7.027   2.089
  732   HG23  VAL 105          HG23      VAL 105  -4.689  -8.590   2.361
  733    H    LEU 106           HN       LEU 106  -4.344  -5.466  -1.857
  734    HA   LEU 106           HA       LEU 106  -3.605  -7.267  -4.058
  735    HB2  LEU 106           HB2      LEU 106  -3.867  -4.279  -3.860
  736    HB3  LEU 106           HB1      LEU 106  -2.832  -4.996  -5.076
  737    HG   LEU 106           HG       LEU 106  -4.923  -4.473  -6.087
  738   HD11  LEU 106          HD11      LEU 106  -4.818  -7.437  -5.541
  739   HD12  LEU 106          HD12      LEU 106  -3.884  -6.580  -6.768
  740   HD13  LEU 106          HD13      LEU 106  -5.642  -6.653  -6.890
  741   HD21  LEU 106          HD21      LEU 106  -7.059  -5.316  -5.276
  742   HD22  LEU 106          HD22      LEU 106  -6.268  -4.385  -4.008
  743   HD23  LEU 106          HD23      LEU 106  -6.252  -6.148  -3.943
  744    H    THR 107           HN       THR 107  -1.637  -8.132  -3.737
  745    HA   THR 107           HA       THR 107   0.084  -6.808  -1.751
  746    HB   THR 107           HB       THR 107   0.113  -9.737  -2.444
  747    HG1  THR 107           HG1      THR 107  -1.457 -10.052  -1.014
  748   HG21  THR 107          HG21      THR 107   2.108  -8.884  -1.285
  749   HG22  THR 107          HG22      THR 107   1.174  -9.963  -0.249
  750   HG23  THR 107          HG23      THR 107   1.085  -8.218  -0.010
  751    H    TYR 108           HN       TYR 108   2.264  -6.758  -1.970
  752    HA   TYR 108           HA       TYR 108   3.569  -7.894  -4.319
  753    HB2  TYR 108           HB2      TYR 108   3.390  -5.755  -5.194
  754    HB3  TYR 108           HB1      TYR 108   3.380  -4.996  -3.613
  755    HD1  TYR 108           HD1      TYR 108   5.306  -4.037  -2.747
  756    HD2  TYR 108           HD2      TYR 108   5.628  -6.687  -6.052
  757    HE1  TYR 108           HE1      TYR 108   7.652  -3.390  -3.016
  758    HE2  TYR 108           HE2      TYR 108   7.991  -6.066  -6.328
  759    HH   TYR 108           HH       TYR 108   9.501  -4.300  -5.787
  760    H    ASP 109           HN       ASP 109   5.786  -8.414  -3.890
  761    HA   ASP 109           HA       ASP 109   6.481  -8.225  -1.027
  762    HB2  ASP 109           HB2      ASP 109   6.104 -10.523  -2.294
  763    HB3  ASP 109           HB1      ASP 109   7.752 -10.240  -2.835
  764    H    TRP 110           HN       TRP 110   8.104  -6.853  -0.595
  765    HA   TRP 110           HA       TRP 110   9.847  -5.967  -2.734
  766    HB2  TRP 110           HB2      TRP 110   9.281  -4.148  -1.407
  767    HB3  TRP 110           HB1      TRP 110   9.382  -5.061   0.088
  768    HD1  TRP 110           HD1      TRP 110  11.774  -3.588  -2.594
  769    HE1  TRP 110           HE1      TRP 110  13.993  -2.975  -1.426
  770    HE3  TRP 110           HE3      TRP 110  10.746  -5.309   2.107
  771    HZ2  TRP 110           HZ2      TRP 110  15.142  -3.194   1.128
  772    HZ3  TRP 110           HZ3      TRP 110  12.460  -5.067   3.854
  773    HH2  TRP 110           HH2      TRP 110  14.618  -4.030   3.380
  774    H    SER 111           HN       SER 111  10.149  -7.767   0.302
  775    HA   SER 111           HA       SER 111  12.951  -8.196  -0.028
  776    HB2  SER 111           HB2      SER 111  10.888  -9.402   1.780
  777    HB3  SER 111           HB1      SER 111  12.585  -9.818   1.851
  778    HG   SER 111           HG       SER 111  13.034  -7.928   2.719
  779    H    ALA 112           HN       ALA 112  10.004  -9.894  -0.792
  780    HA   ALA 112           HA       ALA 112   9.562 -11.737  -2.034
  781    HB1  ALA 112           HB1      ALA 112  10.245 -10.218  -3.718
  782    HB2  ALA 112           HB2      ALA 112  10.863 -11.823  -4.125
  783    HB3  ALA 112           HB3      ALA 112  11.942 -10.603  -3.446
  784    H    ASN 113           HN       ASN 113  10.732 -12.544   0.169
  785    HA   ASN 113           HA       ASN 113  12.948 -14.311  -0.408
  786    HB2  ASN 113           HB2      ASN 113  12.658 -13.148   1.810
  787    HB3  ASN 113           HB1      ASN 113  11.258 -14.173   2.102
  788   HD21  ASN 113          HD21      ASN 113  11.563 -16.339   2.583
  789   HD22  ASN 113          HD22      ASN 113  13.111 -16.989   2.993
  790    H    GLY 114           HN       GLY 114  11.641 -15.266  -2.175
  791    HA2  GLY 114           HA2      GLY 114  10.869 -17.391  -2.813
  792    HA3  GLY 114           HA1      GLY 114  10.322 -17.665  -1.167
  793    H    VAL 115           HN       VAL 115   9.671 -15.526  -3.933
  794    HA   VAL 115           HA       VAL 115   6.801 -15.871  -3.396
  795    HB   VAL 115           HB       VAL 115   7.692 -13.609  -2.694
  796   HG11  VAL 115          HG11      VAL 115   9.297 -13.252  -4.456
  797   HG12  VAL 115          HG12      VAL 115   8.093 -11.963  -4.484
  798   HG13  VAL 115          HG13      VAL 115   8.017 -13.270  -5.668
  799   HG21  VAL 115          HG21      VAL 115   5.328 -13.940  -3.101
  800   HG22  VAL 115          HG22      VAL 115   5.563 -13.676  -4.828
  801   HG23  VAL 115          HG23      VAL 115   5.823 -12.354  -3.689
  802    H    ASN 116           HN       ASN 116   9.049 -16.775  -5.282
  803    HA   ASN 116           HA       ASN 116   9.219 -17.585  -7.395
  804    HB2  ASN 116           HB2      ASN 116   6.283 -16.905  -7.425
  805    HB3  ASN 116           HB1      ASN 116   7.098 -17.597  -8.821
  806   HD21  ASN 116          HD21      ASN 116   7.799 -19.722  -8.748
  807   HD22  ASN 116          HD22      ASN 116   7.277 -20.826  -7.523
  808    H    SER 117           HN       SER 117   8.715 -16.873  -9.807
  809    HA   SER 117           HA       SER 117   9.447 -15.486 -11.433
  810    HB2  SER 117           HB2      SER 117   8.368 -13.214 -11.471
  811    HB3  SER 117           HB1      SER 117   7.247 -14.559 -11.286
  812    HG   SER 117           HG       SER 117   8.141 -13.594  -8.892
  813    H    ASN 118           HN       ASN 118  11.178 -15.746  -9.145
  814    HA   ASN 118           HA       ASN 118  13.070 -13.722  -9.747
  815    HB2  ASN 118           HB2      ASN 118  11.586 -12.395  -8.273
  816    HB3  ASN 118           HB1      ASN 118  11.803 -13.589  -6.997
  817   HD21  ASN 118          HD21      ASN 118  13.359 -11.117  -8.897
  818   HD22  ASN 118          HD22      ASN 118  14.686 -10.848  -7.823