*HEADER    CELL CYCLE                              09-MAY-03   1P94              
*TITLE     NMR STRUCTURE OF PARG SYMMETRIC DIMER                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PLASMID PARTITION PROTEIN PARG;                            
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA;                            
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: PARG;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET-22-B(+)                               
*KEYWDS    RIBBON-HELIX-HELIX, DIMER, DNA BINDING                                
*EXPDTA    NMR, 11 STRUCTURES                                                    
*AUTHOR    A.P.GOLOVANOV, D.BARILLA, M.GOLOVANOVA, F.HAYES, L.Y.LIAN             
*REVDAT   1   13-JAN-04 1P94    0                                                
! Experimental NMR distance and angle constraints  for the
! structure calculation of symmetric dimer of ParG using ARIA protocol 
! (Nilges et al., 1997, J. Mol. Biol. 269, 408-422). 
! 
!
! NOTE - Numbering of residues in in this file is different from PDB entry 
! chain A correspond to residues 1-76 in this file
! chain B correspond to residues 101-176 in this file
!
! Ambiguous distance restraints for the final run of ARIA calculations
!
 ASSI {    1}
   (( segid "    " and resid 164  and name HN  ))
   (( segid "    " and resid 149  and name HZ  ))
      3.200     1.300     1.300 peak     1 spectrum    1 weight  0.11000E+01 volume  0.16395E-02 ppm1      8.940 ppm2      6.612 CV     1
 OR {    1}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {    4}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 164  and name HG2%)
      2.500     2.500     3.500 peak     4 spectrum    1 weight  0.11000E+01 volume  0.22766E-02 ppm1      8.938 ppm2      0.956 CV     1
 OR {    4}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI {    5}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 139  and name HG1%)
      6.000     4.600     0.000 peak     5 spectrum    1 weight  0.11000E+01 volume  0.19383E-03 ppm1      8.940 ppm2      0.773 CV     1
 OR {    5}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI {    8}
   (( segid "    " and resid 164  and name HN  ))
   (( segid "    " and resid 141  and name HZ  ))
      6.000     6.000     0.000 peak     8 spectrum    1 weight  0.11000E+01 volume  0.52303E-04 ppm1      8.934 ppm2      6.887 CV     1
 OR {    8}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 41   and name HZ  ))
 ASSI {   13}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      3.200     1.300     1.300 peak    13 spectrum    1 weight  0.11000E+01 volume  0.16859E-02 ppm1      8.935 ppm2      0.838 CV     1
 OR {   13}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {   15}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
      5.000     3.100     1.000 peak    15 spectrum    1 weight  0.11000E+01 volume  0.30595E-03 ppm1      8.937 ppm2      0.568 CV     1
 OR {   15}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI {   18}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      3.300     1.300     1.300 peak    18 spectrum    1 weight  0.11000E+01 volume  0.15341E-02 ppm1      8.682 ppm2      4.169 CV     1
 OR {   18}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 OR {   18}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {   30}
   (( segid "    " and resid 168  and name HN  ))
   (  segid "    " and resid 164  and name HG1%)
      4.600     2.700     1.400 peak    30 spectrum    1 weight  0.11000E+01 volume  0.24564E-03 ppm1      8.676 ppm2      1.132 CV     1
 OR {   30}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 164  and name HG1%)
 ASSI {   36}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
      3.000     1.200     1.200 peak    36 spectrum    1 weight  0.11000E+01 volume  0.23737E-02 ppm1      8.587 ppm2      1.923 CV     1
 OR {   36}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {   36}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {   36}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {   36}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 ASSI {   37}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 63   and name HB  ))
      4.000     2.000     2.000 peak    37 spectrum    1 weight  0.11000E+01 volume  0.97053E-03 ppm1      8.587 ppm2      1.616 CV     1
 OR {   37}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 163  and name HB  ))
 ASSI {   41}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 71   and name HE3 ))
      6.000     6.000     0.000 peak    41 spectrum    1 weight  0.11000E+01 volume  0.67398E-04 ppm1      8.571 ppm2      7.274 CV     1
 OR {   41}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 171  and name HE3 ))
 ASSI {   54}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.400     1.400     1.400 peak    54 spectrum    1 weight  0.11000E+01 volume  0.11231E-02 ppm1      8.243 ppm2      4.429 CV     1
 OR {   54}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
 ASSI {   56}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      2.300     2.300     3.700 peak    56 spectrum    1 weight  0.11000E+01 volume  0.48823E-02 ppm1      8.243 ppm2      0.837 CV     1
 OR {   56}
   (( segid "    " and resid 163  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {   62}
   (( segid "    " and resid 163  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
      3.900     1.900     1.900 peak    62 spectrum    1 weight  0.11000E+01 volume  0.61745E-03 ppm1      8.241 ppm2      1.172 CV     1
 OR {   62}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI {   63}
   (( segid "    " and resid 163  and name HN  ))
   (  segid "    " and resid 163  and name HG2%)
      2.800     1.000     1.000 peak    63 spectrum    1 weight  0.11000E+01 volume  0.15642E-02 ppm1      8.242 ppm2     -0.194 CV     1
 OR {   63}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI {   65}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 146  and name HD2 ))
      3.800     1.800     1.800 peak    65 spectrum    1 weight  0.11000E+01 volume  0.15761E-02 ppm1      7.701 ppm2      6.322 CV     1
 OR {   65}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 46   and name HD2 ))
 ASSI {   67}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 46   and name HA  ))
      5.000     3.100     1.000 peak    67 spectrum    1 weight  0.11000E+01 volume  0.33992E-03 ppm1      7.700 ppm2      3.871 CV     1
 OR {   67}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 146  and name HA  ))
 ASSI {   68}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 47   and name HA  ))
      4.300     2.300     1.700 peak    68 spectrum    1 weight  0.11000E+01 volume  0.82463E-03 ppm1      7.699 ppm2      3.649 CV     1
 OR {   68}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI {   69}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HA  ))
      6.000     4.600     0.000 peak    69 spectrum    1 weight  0.11000E+01 volume  0.12955E-03 ppm1      7.701 ppm2      3.431 CV     1
 OR {   69}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HA  ))
 ASSI {   70}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HE1 ))
      4.000     2.000     2.000 peak    70 spectrum    1 weight  0.11000E+01 volume  0.17587E-02 ppm1      7.699 ppm2      2.934 CV     1
 OR {   70}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 146  and name HB2 ))
 OR {   70}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {   72}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HB2 ))
      4.600     2.600     1.400 peak    72 spectrum    1 weight  0.11000E+01 volume  0.90106E-03 ppm1      7.701 ppm2      1.659 CV     1
 OR {   72}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HB2 ))
 OR {   72}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 160  and name HB  ))
 ASSI {   73}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HD1 ))
      2.300     0.700     0.700 peak    73 spectrum    1 weight  0.11000E+01 volume  0.15212E-01 ppm1      7.700 ppm2      1.546 CV     1
 OR {   73}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR {   73}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 35   and name HD1 ))
 ASSI {   74}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 135  and name HD1 ))
      3.200     1.300     1.300 peak    74 spectrum    1 weight  0.11000E+01 volume  0.37971E-02 ppm1      7.700 ppm2      1.418 CV     1
 OR {   74}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR {   74}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {   75}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HG1 ))
      3.100     1.200     1.200 peak    75 spectrum    1 weight  0.11000E+01 volume  0.36371E-02 ppm1      7.700 ppm2      1.268 CV     1
 OR {   75}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HG1 ))
 OR {   75}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {   75}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HG2 ))
 ASSI {   77}
   (( segid "    " and resid 46   and name HE1 ))
   (  segid "    " and resid 137  and name HG1%)
      4.600     2.600     1.400 peak    77 spectrum    1 weight  0.11000E+01 volume  0.10636E-02 ppm1      7.699 ppm2      0.829 CV     1
 OR {   77}
   (( segid "    " and resid 146  and name HE1 ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI {   78}
   (( segid "    " and resid 146  and name HE1 ))
   (  segid "    " and resid 37   and name HG2%)
      3.900     1.900     1.900 peak    78 spectrum    1 weight  0.11000E+01 volume  0.19148E-02 ppm1      7.700 ppm2      0.657 CV     1
 OR {   78}
   (( segid "    " and resid 46   and name HE1 ))
   (  segid "    " and resid 137  and name HG2%)
 OR {   78}
   (( segid "    " and resid 146  and name HE1 ))
   (  segid "    " and resid 160  and name HG2%)
 ASSI {   79}
   (( segid "    " and resid 46   and name HE1 ))
   (  segid "    " and resid 60   and name HD1%)
      3.900     1.900     1.900 peak    79 spectrum    1 weight  0.11000E+01 volume  0.14169E-02 ppm1      7.700 ppm2      0.514 CV     1
 OR {   79}
   (( segid "    " and resid 146  and name HE1 ))
   (  segid "    " and resid 160  and name HD1%)
 ASSI {   83}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 166  and name HG2 ))
      6.000     5.100     0.000 peak    83 spectrum    1 weight  0.11000E+01 volume  0.57118E-04 ppm1      7.403 ppm2      2.572 CV     1
 OR {   83}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI {   85}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HZ3 ))
      6.000     5.700     0.000 peak    85 spectrum    1 weight  0.11000E+01 volume  0.56346E-04 ppm1      7.397 ppm2      7.131 CV     1
 OR {   85}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HZ3 ))
 ASSI {   86}
   (( segid "    " and resid 171  and name HD1 ))
   (  segid "    " and resid 49   and name HE% )
      5.600     5.600     0.400 peak    86 spectrum    1 weight  0.11000E+01 volume  0.24863E-03 ppm1      7.397 ppm2      6.505 CV     1
 OR {   86}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 149  and name HE% )
 ASSI {   87}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HA  ))
      2.200     0.600     0.600 peak    87 spectrum    1 weight  0.11000E+01 volume  0.16498E-01 ppm1      7.397 ppm2      4.190 CV     1
 OR {   87}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {   88}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 163  and name HA  ))
      4.100     2.200     1.900 peak    88 spectrum    1 weight  0.11000E+01 volume  0.97928E-03 ppm1      7.397 ppm2      3.512 CV     1
 OR {   88}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {   90}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 170  and name HB2 ))
      4.600     2.600     1.400 peak    90 spectrum    1 weight  0.11000E+01 volume  0.26712E-03 ppm1      7.398 ppm2      3.086 CV     1
 OR {   90}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {   90}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 170  and name HB1 ))
 OR {   90}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {   90}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {   92}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 166  and name HB1 ))
      4.000     2.000     2.000 peak    92 spectrum    1 weight  0.11000E+01 volume  0.42531E-03 ppm1      7.396 ppm2      2.290 CV     1
 OR {   92}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 66   and name HB1 ))
 OR {   92}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 166  and name HB2 ))
 OR {   92}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {   93}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 167  and name HG  ))
      3.100     3.100     2.900 peak    93 spectrum    1 weight  0.11000E+01 volume  0.45846E-02 ppm1      7.397 ppm2      2.022 CV     1
 OR {   93}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 172  and name HG  ))
 ASSI {   94}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 167  and name HB1 ))
      3.400     1.400     1.400 peak    94 spectrum    1 weight  0.11000E+01 volume  0.29249E-02 ppm1      7.397 ppm2      1.929 CV     1
 OR {   94}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {   94}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 167  and name HB2 ))
 ASSI {   95}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 174  and name HB2 ))
      4.100     2.200     1.900 peak    95 spectrum    1 weight  0.11000E+01 volume  0.10334E-02 ppm1      7.398 ppm2      1.787 CV     1
 OR {   95}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 74   and name HB2 ))
 OR {   95}
   (( segid "    " and resid 171  and name HD1 ))
   (  segid "    " and resid 52   and name HB% )
 OR {   95}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {   97}
   (( segid "    " and resid 171  and name HD1 ))
   (  segid "    " and resid 67   and name HD2%)
      2.400     2.400     3.600 peak    97 spectrum    1 weight  0.11000E+01 volume  0.24907E-01 ppm1      7.397 ppm2      1.078 CV     1
 OR {   97}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {   99}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 175  and name HB1 ))
      3.400     1.500     1.500 peak    99 spectrum    1 weight  0.11000E+01 volume  0.11450E-02 ppm1      7.397 ppm2      0.839 CV     1
 OR {   99}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 75   and name HB1 ))
 OR {   99}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {  101}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 68   and name HG1%)
      5.300     5.300     0.700 peak   101 spectrum    1 weight  0.11000E+01 volume  0.37310E-03 ppm1      7.398 ppm2      0.055 CV     1
 OR {  101}
   (( segid "    " and resid 171  and name HD1 ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  105}
   (  segid "    " and resid 115  and name HD% )
   (  segid "    " and resid 115  and name HE% )
      2.400     0.700     0.700 peak   105 spectrum    1 weight  0.11000E+01 volume  0.74993E-02 ppm1      7.352 ppm2      7.276 CV     1
 OR {  105}
   (  segid "    " and resid 15   and name HD% )
   (  segid "    " and resid 15   and name HE% )
 ASSI {  106}
   (( segid "    " and resid 15   and name HZ  ))
   (  segid "    " and resid 15   and name HE% )
      4.400     2.400     1.600 peak   106 spectrum    1 weight  0.11000E+01 volume  0.23095E-03 ppm1      7.335 ppm2      7.238 CV     1
 OR {  106}
   (( segid "    " and resid 115  and name HZ  ))
   (  segid "    " and resid 115  and name HE% )
 ASSI {  107}
   (( segid "    " and resid 115  and name HZ  ))
   (  segid "    " and resid 115  and name HD% )
      6.000     5.700     0.000 peak   107 spectrum    1 weight  0.11000E+01 volume  0.78485E-04 ppm1      7.329 ppm2      7.407 CV     1
 OR {  107}
   (( segid "    " and resid 15   and name HZ  ))
   (  segid "    " and resid 15   and name HD% )
 ASSI {  109}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 35   and name HB2 ))
      3.200     3.200     2.800 peak   109 spectrum    1 weight  0.11000E+01 volume  0.30117E-02 ppm1      7.326 ppm2      1.498 CV     1
 OR {  109}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 135  and name HB2 ))
 OR {  109}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 135  and name HB1 ))
 ASSI {  110}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 35   and name HG2 ))
      4.000     4.000     2.000 peak   110 spectrum    1 weight  0.11000E+01 volume  0.23733E-02 ppm1      7.326 ppm2      0.957 CV     1
 OR {  110}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 135  and name HG2 ))
 ASSI {  112}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 46   and name HD2 ))
      2.500     2.500     3.500 peak   112 spectrum    1 weight  0.11000E+01 volume  0.41315E-02 ppm1      7.324 ppm2      6.322 CV     1
 OR {  112}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 146  and name HD2 ))
 ASSI {  114}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 41   and name HA  ))
      2.100     0.500     0.500 peak   114 spectrum    1 weight  0.11000E+01 volume  0.96081E-02 ppm1      7.323 ppm2      5.123 CV     1
 OR {  114}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 141  and name HA  ))
 ASSI {  115}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 137  and name HA  ))
      4.500     2.500     1.500 peak   115 spectrum    1 weight  0.11000E+01 volume  0.17544E-02 ppm1      7.323 ppm2      4.141 CV     1
 OR {  115}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  116}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 41   and name HB2 ))
      2.100     0.600     0.600 peak   116 spectrum    1 weight  0.11000E+01 volume  0.90426E-02 ppm1      7.323 ppm2      3.243 CV     1
 OR {  116}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 141  and name HB1 ))
 ASSI {  117}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 146  and name HB2 ))
      3.400     3.400     2.600 peak   117 spectrum    1 weight  0.11000E+01 volume  0.19110E-02 ppm1      7.324 ppm2      2.962 CV     1
 OR {  117}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  120}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HB1 ))
      3.400     1.400     1.400 peak   120 spectrum    1 weight  0.11000E+01 volume  0.30992E-02 ppm1      7.321 ppm2      2.011 CV     1
 OR {  120}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HB1 ))
 OR {  120}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HB2 ))
 OR {  120}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HB2 ))
 ASSI {  121}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HG1 ))
      3.500     1.500     1.500 peak   121 spectrum    1 weight  0.11000E+01 volume  0.35387E-02 ppm1      7.322 ppm2      1.431 CV     1
 OR {  121}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HG1 ))
 OR {  121}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HG2 ))
 OR {  121}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HG2 ))
 ASSI {  122}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 161  and name HG2%)
      6.000     6.000     0.000 peak   122 spectrum    1 weight  0.11000E+01 volume  0.64218E-04 ppm1      7.321 ppm2      1.268 CV     1
 OR {  122}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 61   and name HG2%)
 OR {  122}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 161  and name HG2%)
 ASSI {  123}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 137  and name HG2%)
      1.900     1.900     4.100 peak   123 spectrum    1 weight  0.11000E+01 volume  0.17891E-01 ppm1      7.324 ppm2      0.658 CV     1
 OR {  123}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 37   and name HG2%)
 ASSI {  124}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 139  and name HG2%)
      3.300     3.300     2.700 peak   124 spectrum    1 weight  0.11000E+01 volume  0.59068E-02 ppm1      7.325 ppm2      0.475 CV     1
 OR {  124}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 139  and name HG2%)
 OR {  124}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 39   and name HG2%)
 OR {  124}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  125}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 68   and name HG1%)
      2.900     2.900     3.100 peak   125 spectrum    1 weight  0.11000E+01 volume  0.26890E-02 ppm1      7.323 ppm2      0.056 CV     1
 OR {  125}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  126}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 149  and name HE% )
      3.200     3.200     2.800 peak   126 spectrum    1 weight  0.11000E+01 volume  0.23370E-02 ppm1      7.318 ppm2      6.510 CV     1
 OR {  126}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 49   and name HE% )
 ASSI {  129}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 153  and name HA  ))
      3.100     1.200     1.200 peak   129 spectrum    1 weight  0.11000E+01 volume  0.44454E-02 ppm1      7.314 ppm2      3.975 CV     1
 OR {  129}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 53   and name HA  ))
 OR {  129}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HA  ))
 OR {  129}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HA  ))
 ASSI {  130}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 146  and name HA  ))
      3.000     3.000     3.000 peak   130 spectrum    1 weight  0.11000E+01 volume  0.33247E-02 ppm1      7.319 ppm2      3.873 CV     1
 OR {  130}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  131}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 64   and name HA  ))
      4.000     2.000     2.000 peak   131 spectrum    1 weight  0.11000E+01 volume  0.14827E-02 ppm1      7.319 ppm2      3.375 CV     1
 OR {  131}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 164  and name HA  ))
 OR {  131}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 64   and name HA  ))
 OR {  131}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 164  and name HA  ))
 ASSI {  132}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HE2 ))
      3.000     1.100     1.100 peak   132 spectrum    1 weight  0.11000E+01 volume  0.35745E-02 ppm1      7.315 ppm2      3.152 CV     1
 OR {  132}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HE1 ))
 ASSI {  133}
   (( segid "    " and resid 115  and name HZ  ))
   (( segid "    " and resid 117  and name HB2 ))
      2.200     2.200     3.800 peak   133 spectrum    1 weight  0.11000E+01 volume  0.25526E-02 ppm1      7.315 ppm2      1.934 CV     1
 OR {  133}
   (( segid "    " and resid 15   and name HZ  ))
   (( segid "    " and resid 17   and name HB2 ))
 OR {  133}
   (( segid "    " and resid 115  and name HZ  ))
   (( segid "    " and resid 117  and name HB1 ))
 OR {  133}
   (( segid "    " and resid 15   and name HZ  ))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI {  134}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HD1 ))
      2.200     0.600     0.600 peak   134 spectrum    1 weight  0.11000E+01 volume  0.15647E-01 ppm1      7.318 ppm2      1.815 CV     1
 OR {  134}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HD1 ))
 OR {  134}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 45   and name HD2 ))
 OR {  134}
   (  segid "    " and resid 141  and name HD% )
   (( segid "    " and resid 145  and name HD2 ))
 OR {  134}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 39   and name HB  ))
 ASSI {  136}
   (  segid "    " and resid 141  and name HD% )
   (  segid "    " and resid 139  and name HG1%)
      2.600     2.600     3.400 peak   136 spectrum    1 weight  0.11000E+01 volume  0.46994E-02 ppm1      7.319 ppm2      0.774 CV     1
 OR {  136}
   (  segid "    " and resid 41   and name HD% )
   (  segid "    " and resid 39   and name HG1%)
 ASSI {  137}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 71   and name HZ3 ))
      3.400     1.500     1.500 peak   137 spectrum    1 weight  0.11000E+01 volume  0.35452E-02 ppm1      7.309 ppm2      7.129 CV     1
 OR {  137}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 171  and name HZ3 ))
 ASSI {  138}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 171  and name HH2 ))
      1.800     0.400     0.400 peak   138 spectrum    1 weight  0.11000E+01 volume  0.27261E-01 ppm1      7.308 ppm2      6.800 CV     1
 OR {  138}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 71   and name HH2 ))
 ASSI {  139}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 75   and name HA  ))
      5.400     3.600     0.600 peak   139 spectrum    1 weight  0.11000E+01 volume  0.28900E-03 ppm1      7.306 ppm2      4.555 CV     1
 OR {  139}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI {  142}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 156  and name HB2 ))
      3.100     1.200     1.200 peak   142 spectrum    1 weight  0.11000E+01 volume  0.28259E-02 ppm1      7.306 ppm2      1.934 CV     1
 OR {  142}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI {  143}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 75   and name HB2 ))
      2.400     2.400     3.600 peak   143 spectrum    1 weight  0.11000E+01 volume  0.94619E-02 ppm1      7.305 ppm2      1.689 CV     1
 OR {  143}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI {  145}
   (( segid "    " and resid 171  and name HZ2 ))
   (  segid "    " and resid 67   and name HD2%)
      3.500     3.500     2.500 peak   145 spectrum    1 weight  0.11000E+01 volume  0.13747E-02 ppm1      7.306 ppm2      1.066 CV     1
 OR {  145}
   (( segid "    " and resid 71   and name HZ2 ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  147}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 171  and name HD1 ))
      4.200     2.200     1.800 peak   147 spectrum    1 weight  0.11000E+01 volume  0.13370E-02 ppm1      7.298 ppm2      7.394 CV     1
 OR {  147}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {  149}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 163  and name HA  ))
      4.700     2.800     1.300 peak   149 spectrum    1 weight  0.11000E+01 volume  0.24885E-03 ppm1      7.301 ppm2      3.521 CV     1
 OR {  149}
   (( segid "    " and resid 171  and name HZ2 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  154}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 169  and name HA  ))
      6.000     6.000     0.000 peak   154 spectrum    1 weight  0.11000E+01 volume  0.52044E-04 ppm1      7.271 ppm2      4.386 CV     1
 OR {  154}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  159}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 149  and name HZ  ))
      5.000     3.100     1.000 peak   159 spectrum    1 weight  0.11000E+01 volume  0.34735E-03 ppm1      7.264 ppm2      6.615 CV     1
 OR {  159}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {  161}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 163  and name HA  ))
      5.200     3.400     0.800 peak   161 spectrum    1 weight  0.11000E+01 volume  0.21299E-03 ppm1      7.265 ppm2      3.518 CV     1
 OR {  161}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  162}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 172  and name HD1%)
      2.900     2.900     3.100 peak   162 spectrum    1 weight  0.11000E+01 volume  0.42355E-02 ppm1      7.263 ppm2      0.877 CV     1
 OR {  162}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI {  163}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 68   and name HG1%)
      3.300     3.300     2.700 peak   163 spectrum    1 weight  0.11000E+01 volume  0.26406E-02 ppm1      7.264 ppm2      0.052 CV     1
 OR {  163}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  164}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 63   and name HG1%)
      3.300     1.400     1.400 peak   164 spectrum    1 weight  0.11000E+01 volume  0.16072E-02 ppm1      7.264 ppm2     -0.192 CV     1
 OR {  164}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 163  and name HG2%)
 ASSI {  165}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HD1 ))
      4.300     2.400     1.700 peak   165 spectrum    1 weight  0.11000E+01 volume  0.63266E-03 ppm1      7.260 ppm2      7.405 CV     1
 OR {  165}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HD1 ))
 ASSI {  166}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HZ3 ))
      2.100     0.500     0.500 peak   166 spectrum    1 weight  0.11000E+01 volume  0.85405E-02 ppm1      7.261 ppm2      7.134 CV     1
 OR {  166}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HZ3 ))
 ASSI {  167}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 149  and name HD% )
      2.800     2.800     3.200 peak   167 spectrum    1 weight  0.11000E+01 volume  0.41315E-02 ppm1      7.260 ppm2      6.963 CV     1
 OR {  167}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  168}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HH2 ))
      3.500     1.500     1.500 peak   168 spectrum    1 weight  0.11000E+01 volume  0.25260E-02 ppm1      7.262 ppm2      6.801 CV     1
 OR {  168}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HH2 ))
 ASSI {  170}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 149  and name HA  ))
      3.900     1.900     1.900 peak   170 spectrum    1 weight  0.11000E+01 volume  0.14520E-02 ppm1      7.262 ppm2      4.884 CV     1
 OR {  170}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  171}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HA  ))
      3.400     1.400     1.400 peak   171 spectrum    1 weight  0.11000E+01 volume  0.25292E-02 ppm1      7.261 ppm2      4.192 CV     1
 OR {  171}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  172}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 172  and name HA  ))
      2.100     0.500     0.500 peak   172 spectrum    1 weight  0.11000E+01 volume  0.75067E-02 ppm1      7.262 ppm2      3.873 CV     1
 OR {  172}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI {  173}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HB1 ))
      2.100     0.500     0.500 peak   173 spectrum    1 weight  0.11000E+01 volume  0.93386E-02 ppm1      7.261 ppm2      3.350 CV     1
 OR {  173}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  173}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HB2 ))
 OR {  173}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI {  175}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 45   and name HE2 ))
      6.000     4.500     0.000 peak   175 spectrum    1 weight  0.11000E+01 volume  0.00000E+00 ppm1      7.262 ppm2      3.172 CV     1
 OR {  175}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 145  and name HE1 ))
 ASSI {  176}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 172  and name HB1 ))
      3.800     1.800     1.800 peak   176 spectrum    1 weight  0.11000E+01 volume  0.23497E-02 ppm1      7.261 ppm2      2.091 CV     1
 OR {  176}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 72   and name HB1 ))
 ASSI {  177}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 172  and name HG  ))
      2.600     0.800     0.800 peak   177 spectrum    1 weight  0.11000E+01 volume  0.89211E-02 ppm1      7.262 ppm2      2.007 CV     1
 OR {  177}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 72   and name HG  ))
 ASSI {  178}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 152  and name HB% )
      3.400     1.400     1.400 peak   178 spectrum    1 weight  0.11000E+01 volume  0.50150E-02 ppm1      7.261 ppm2      1.822 CV     1
 OR {  178}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 52   and name HB% )
 ASSI {  179}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 173  and name HG1 ))
      4.600     2.600     1.400 peak   179 spectrum    1 weight  0.11000E+01 volume  0.91275E-03 ppm1      7.261 ppm2      1.682 CV     1
 OR {  179}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 73   and name HG1 ))
 ASSI {  180}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 172  and name HB2 ))
      2.800     1.000     1.000 peak   180 spectrum    1 weight  0.11000E+01 volume  0.16975E-02 ppm1      7.261 ppm2      1.574 CV     1
 OR {  180}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  181}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 67   and name HD2%)
      2.400     2.400     3.600 peak   181 spectrum    1 weight  0.11000E+01 volume  0.10724E-01 ppm1      7.263 ppm2      1.061 CV     1
 OR {  181}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 172  and name HD2%)
 OR {  181}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  182}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 175  and name HB1 ))
      3.900     1.900     1.900 peak   182 spectrum    1 weight  0.11000E+01 volume  0.71479E-03 ppm1      7.261 ppm2      0.769 CV     1
 OR {  182}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI {  183}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 68   and name HG2%)
      3.600     1.600     1.600 peak   183 spectrum    1 weight  0.11000E+01 volume  0.15540E-02 ppm1      7.262 ppm2      0.616 CV     1
 OR {  183}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 168  and name HG2%)
 ASSI {  185}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HZ2 ))
      3.700     1.700     1.700 peak   185 spectrum    1 weight  0.11000E+01 volume  0.12725E-02 ppm1      7.246 ppm2      7.334 CV     1
 OR {  185}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HZ2 ))
 ASSI {  188}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 49   and name HD% )
      2.200     2.200     3.800 peak   188 spectrum    1 weight  0.11000E+01 volume  0.73793E-02 ppm1      7.132 ppm2      6.961 CV     1
 OR {  188}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  189}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 71   and name HH2 ))
      2.000     0.500     0.500 peak   189 spectrum    1 weight  0.11000E+01 volume  0.12398E-01 ppm1      7.132 ppm2      6.800 CV     1
 OR {  189}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 171  and name HH2 ))
 ASSI {  190}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 49   and name HE% )
      2.600     2.600     3.400 peak   190 spectrum    1 weight  0.11000E+01 volume  0.43509E-02 ppm1      7.132 ppm2      6.506 CV     1
 OR {  190}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 149  and name HE% )
 ASSI {  191}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 49   and name HA  ))
      2.700     0.900     0.900 peak   191 spectrum    1 weight  0.11000E+01 volume  0.30824E-02 ppm1      7.133 ppm2      4.889 CV     1
 OR {  191}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  192}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 172  and name HA  ))
      2.800     0.900     0.900 peak   192 spectrum    1 weight  0.11000E+01 volume  0.36109E-02 ppm1      7.132 ppm2      3.877 CV     1
 OR {  192}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI {  193}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 148  and name HD2 ))
      4.400     2.400     1.600 peak   193 spectrum    1 weight  0.11000E+01 volume  0.59402E-03 ppm1      7.133 ppm2      3.369 CV     1
 OR {  193}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI {  194}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 48   and name HD2 ))
      4.400     2.500     1.600 peak   194 spectrum    1 weight  0.11000E+01 volume  0.53307E-03 ppm1      7.133 ppm2      3.250 CV     1
 OR {  194}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 148  and name HD1 ))
 ASSI {  198}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 172  and name HB2 ))
      6.000     4.800     0.000 peak   198 spectrum    1 weight  0.11000E+01 volume  0.53081E-04 ppm1      7.136 ppm2      1.560 CV     1
 OR {  198}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  199}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 63   and name HG1%)
      4.100     2.100     1.900 peak   199 spectrum    1 weight  0.11000E+01 volume  0.33708E-03 ppm1      7.133 ppm2     -0.195 CV     1
 OR {  199}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 163  and name HG2%)
 ASSI {  201}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 152  and name HA  ))
      4.400     2.400     1.600 peak   201 spectrum    1 weight  0.11000E+01 volume  0.16637E-02 ppm1      7.130 ppm2      4.308 CV     1
 OR {  201}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  202}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 153  and name HA  ))
      4.300     2.300     1.700 peak   202 spectrum    1 weight  0.11000E+01 volume  0.74503E-03 ppm1      7.129 ppm2      3.978 CV     1
 OR {  202}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  203}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 71   and name HB1 ))
      5.000     3.100     1.000 peak   203 spectrum    1 weight  0.11000E+01 volume  0.45949E-03 ppm1      7.130 ppm2      3.324 CV     1
 OR {  203}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  203}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  204}
   (( segid "    " and resid 171  and name HZ3 ))
   (( segid "    " and resid 172  and name HG  ))
      2.700     0.900     0.900 peak   204 spectrum    1 weight  0.11000E+01 volume  0.35963E-02 ppm1      7.130 ppm2      2.008 CV     1
 OR {  204}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 72   and name HG  ))
 ASSI {  207}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 172  and name HD2%)
      2.800     2.800     3.200 peak   207 spectrum    1 weight  0.11000E+01 volume  0.91025E-02 ppm1      7.131 ppm2      1.060 CV     1
 OR {  207}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  208}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 172  and name HD1%)
      3.100     1.200     1.200 peak   208 spectrum    1 weight  0.11000E+01 volume  0.23516E-02 ppm1      7.130 ppm2      0.871 CV     1
 OR {  208}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI {  209}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 68   and name HG1%)
      5.500     3.800     0.500 peak   209 spectrum    1 weight  0.11000E+01 volume  0.17958E-03 ppm1      7.129 ppm2      0.057 CV     1
 OR {  209}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  213}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 171  and name HH2 ))
      3.600     3.600     2.400 peak   213 spectrum    1 weight  0.11000E+01 volume  0.22944E-02 ppm1      6.961 ppm2      6.798 CV     1
 OR {  213}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 71   and name HH2 ))
 ASSI {  214}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 149  and name HZ  ))
      2.800     1.000     1.000 peak   214 spectrum    1 weight  0.11000E+01 volume  0.66810E-02 ppm1      6.963 ppm2      6.613 CV     1
 OR {  214}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {  215}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 149  and name HE% )
      1.600     0.300     0.600 peak   215 spectrum    1 weight  0.11000E+01 volume  0.30422E-01 ppm1      6.961 ppm2      6.507 CV     1
 OR {  215}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 49   and name HE% )
 ASSI {  216}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HA  ))
      1.700     1.700     4.300 peak   216 spectrum    1 weight  0.11000E+01 volume  0.19624E-01 ppm1      6.961 ppm2      4.888 CV     1
 OR {  216}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  217}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 48   and name HA  ))
      4.400     4.400     1.600 peak   217 spectrum    1 weight  0.11000E+01 volume  0.76514E-03 ppm1      6.962 ppm2      4.155 CV     1
 OR {  217}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  218}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 67   and name HD2%)
      2.700     2.700     3.300 peak   218 spectrum    1 weight  0.11000E+01 volume  0.12337E-01 ppm1      6.961 ppm2      1.060 CV     1
 OR {  218}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  219}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 163  and name HG2%)
      2.700     2.700     3.300 peak   219 spectrum    1 weight  0.11000E+01 volume  0.66417E-02 ppm1      6.963 ppm2     -0.197 CV     1
 OR {  219}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 63   and name HG1%)
 ASSI {  220}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 146  and name HD2 ))
      2.700     2.700     3.300 peak   220 spectrum    1 weight  0.11000E+01 volume  0.41107E-02 ppm1      6.956 ppm2      6.324 CV     1
 OR {  220}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 46   and name HD2 ))
 ASSI {  221}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 52   and name HA  ))
      6.000     6.000     0.000 peak   221 spectrum    1 weight  0.11000E+01 volume  0.57135E-04 ppm1      6.960 ppm2      4.312 CV     1
 OR {  221}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 152  and name HA  ))
 ASSI {  223}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 164  and name HA  ))
      3.100     3.100     2.900 peak   223 spectrum    1 weight  0.11000E+01 volume  0.58648E-02 ppm1      6.957 ppm2      3.383 CV     1
 OR {  223}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 64   and name HA  ))
 OR {  223}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 48   and name HD1 ))
 ASSI {  227}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 141  and name HB2 ))
      3.600     1.600     1.600 peak   227 spectrum    1 weight  0.11000E+01 volume  0.21507E-02 ppm1      6.957 ppm2      2.814 CV     1
 OR {  227}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 41   and name HB1 ))
 ASSI {  228}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 48   and name HB1 ))
      3.000     3.000     3.000 peak   228 spectrum    1 weight  0.11000E+01 volume  0.31576E-02 ppm1      6.958 ppm2      2.105 CV     1
 OR {  228}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 164  and name HB  ))
 OR {  228}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 64   and name HB  ))
 ASSI {  229}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HB1 ))
      2.600     2.600     3.400 peak   229 spectrum    1 weight  0.11000E+01 volume  0.62893E-02 ppm1      6.959 ppm2      2.009 CV     1
 OR {  229}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HB2 ))
 OR {  229}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 167  and name HG  ))
 OR {  229}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 67   and name HG  ))
 ASSI {  230}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 148  and name HB1 ))
      2.800     2.800     3.200 peak   230 spectrum    1 weight  0.11000E+01 volume  0.57397E-02 ppm1      6.958 ppm2      1.928 CV     1
 OR {  230}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 48   and name HB2 ))
 ASSI {  231}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 52   and name HB% )
      2.400     2.400     3.600 peak   231 spectrum    1 weight  0.11000E+01 volume  0.20040E-01 ppm1      6.958 ppm2      1.816 CV     1
 OR {  231}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 152  and name HB% )
 ASSI {  232}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 63   and name HB  ))
      3.300     1.300     1.300 peak   232 spectrum    1 weight  0.11000E+01 volume  0.42014E-02 ppm1      6.959 ppm2      1.647 CV     1
 OR {  232}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 60   and name HB  ))
 OR {  232}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 160  and name HB  ))
 ASSI {  233}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 50   and name HD2 ))
      3.400     3.400     2.600 peak   233 spectrum    1 weight  0.11000E+01 volume  0.23040E-02 ppm1      6.959 ppm2      1.552 CV     1
 OR {  233}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 150  and name HD2 ))
 OR {  233}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 50   and name HD1 ))
 OR {  233}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 150  and name HD1 ))
 ASSI {  235}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 160  and name HG12))
      3.300     1.400     1.400 peak   235 spectrum    1 weight  0.11000E+01 volume  0.27857E-02 ppm1      6.960 ppm2      1.268 CV     1
 OR {  235}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 60   and name HG12))
 ASSI {  236}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 64   and name HG2%)
      3.000     3.000     3.000 peak   236 spectrum    1 weight  0.11000E+01 volume  0.77507E-02 ppm1      6.957 ppm2      1.145 CV     1
 OR {  236}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 164  and name HG1%)
 ASSI {  239}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 139  and name HG2%)
      2.600     2.600     3.400 peak   239 spectrum    1 weight  0.11000E+01 volume  0.14939E-01 ppm1      6.956 ppm2      0.486 CV     1
 OR {  239}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 39   and name HG2%)
 OR {  239}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 39   and name HG2%)
 OR {  239}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 139  and name HG2%)
 ASSI {  240}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 68   and name HG1%)
      2.400     2.400     3.600 peak   240 spectrum    1 weight  0.11000E+01 volume  0.13721E-01 ppm1      6.957 ppm2      0.055 CV     1
 OR {  240}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  243}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 137  and name HA  ))
      5.000     5.000     1.000 peak   243 spectrum    1 weight  0.11000E+01 volume  0.82748E-03 ppm1      6.954 ppm2      4.140 CV     1
 OR {  243}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  244}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 39   and name HA  ))
      3.600     3.600     2.400 peak   244 spectrum    1 weight  0.11000E+01 volume  0.25089E-02 ppm1      6.954 ppm2      3.970 CV     1
 OR {  244}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 139  and name HA  ))
 ASSI {  245}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 137  and name HB  ))
      2.200     2.200     3.800 peak   245 spectrum    1 weight  0.11000E+01 volume  0.85740E-02 ppm1      6.952 ppm2      2.210 CV     1
 OR {  245}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 37   and name HB  ))
 ASSI {  246}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 64   and name HG1%)
      2.200     2.200     3.800 peak   246 spectrum    1 weight  0.11000E+01 volume  0.10323E-01 ppm1      6.952 ppm2      0.956 CV     1
 OR {  246}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 164  and name HG2%)
 OR {  246}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 64   and name HG1%)
 ASSI {  247}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 39   and name HG1%)
      2.200     2.200     3.800 peak   247 spectrum    1 weight  0.11000E+01 volume  0.96651E-02 ppm1      6.952 ppm2      0.774 CV     1
 OR {  247}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 139  and name HG1%)
 ASSI {  250}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 39   and name HA  ))
      6.000     6.000     0.000 peak   250 spectrum    1 weight  0.11000E+01 volume  0.55186E-04 ppm1      6.888 ppm2      3.978 CV     1
 OR {  250}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 139  and name HA  ))
 OR {  250}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI {  251}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 141  and name HD% )
      2.900     1.100     1.100 peak   251 spectrum    1 weight  0.11000E+01 volume  0.68531E-02 ppm1      6.886 ppm2      7.323 CV     1
 OR {  251}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 41   and name HD% )
 ASSI {  252}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 41   and name HE% )
      1.900     0.400     0.400 peak   252 spectrum    1 weight  0.11000E+01 volume  0.20298E-01 ppm1      6.886 ppm2      6.952 CV     1
 OR {  252}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {  253}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 149  and name HZ  ))
      3.100     1.200     1.200 peak   253 spectrum    1 weight  0.11000E+01 volume  0.20024E-02 ppm1      6.881 ppm2      6.614 CV     1
 OR {  253}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {  255}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 165  and name HA  ))
      3.700     1.700     1.700 peak   255 spectrum    1 weight  0.11000E+01 volume  0.14931E-02 ppm1      6.883 ppm2      3.905 CV     1
 OR {  255}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 165  and name HA  ))
 ASSI {  256}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 64   and name HA  ))
      3.900     1.900     1.900 peak   256 spectrum    1 weight  0.11000E+01 volume  0.78526E-03 ppm1      6.886 ppm2      3.397 CV     1
 OR {  256}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 164  and name HA  ))
 OR {  256}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 164  and name HA  ))
 ASSI {  257}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 41   and name HB2 ))
      4.300     2.300     1.700 peak   257 spectrum    1 weight  0.11000E+01 volume  0.93888E-03 ppm1      6.885 ppm2      3.286 CV     1
 OR {  257}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 141  and name HB1 ))
 OR {  257}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 68   and name HA  ))
 OR {  257}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 168  and name HA  ))
 ASSI {  258}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 64   and name HB  ))
      4.200     2.200     1.800 peak   258 spectrum    1 weight  0.11000E+01 volume  0.97546E-03 ppm1      6.882 ppm2      2.110 CV     1
 OR {  258}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 164  and name HB  ))
 OR {  258}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 164  and name HB  ))
 ASSI {  259}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 68   and name HB  ))
      3.400     1.400     1.400 peak   259 spectrum    1 weight  0.11000E+01 volume  0.23346E-02 ppm1      6.884 ppm2      1.934 CV     1
 OR {  259}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 168  and name HB  ))
 ASSI {  260}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 39   and name HB  ))
      3.000     1.100     1.100 peak   260 spectrum    1 weight  0.11000E+01 volume  0.21273E-02 ppm1      6.884 ppm2      1.807 CV     1
 OR {  260}
   (( segid "    " and resid 141  and name HZ  ))
   (( segid "    " and resid 139  and name HB  ))
 OR {  260}
   (( segid "    " and resid 41   and name HZ  ))
   (( segid "    " and resid 139  and name HB  ))
 ASSI {  263}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 137  and name HG1%)
      3.300     1.300     1.300 peak   263 spectrum    1 weight  0.11000E+01 volume  0.34541E-02 ppm1      6.884 ppm2      0.831 CV     1
 OR {  263}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI {  264}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 39   and name HG1%)
      3.200     1.300     1.300 peak   264 spectrum    1 weight  0.11000E+01 volume  0.39172E-02 ppm1      6.883 ppm2      0.773 CV     1
 OR {  264}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 139  and name HG1%)
 OR {  264}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 139  and name HG1%)
 OR {  264}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI {  265}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 68   and name HG2%)
      2.200     2.200     3.800 peak   265 spectrum    1 weight  0.11000E+01 volume  0.14520E-01 ppm1      6.883 ppm2      0.620 CV     1
 OR {  265}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 168  and name HG2%)
 ASSI {  266}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 139  and name HG2%)
      2.700     2.700     3.300 peak   266 spectrum    1 weight  0.11000E+01 volume  0.65609E-02 ppm1      6.883 ppm2      0.474 CV     1
 OR {  266}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 39   and name HG2%)
 OR {  266}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  267}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 68   and name HG1%)
      3.200     1.300     1.300 peak   267 spectrum    1 weight  0.11000E+01 volume  0.37616E-02 ppm1      6.883 ppm2      0.055 CV     1
 OR {  267}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  269}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 167  and name HD1%)
      4.900     3.000     1.100 peak   269 spectrum    1 weight  0.11000E+01 volume  0.17598E-03 ppm1      6.879 ppm2      1.060 CV     1
 OR {  269}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 67   and name HD2%)
 OR {  269}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  270}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 52   and name HA  ))
      4.000     2.000     2.000 peak   270 spectrum    1 weight  0.11000E+01 volume  0.15652E-02 ppm1      6.802 ppm2      4.311 CV     1
 OR {  270}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 152  and name HA  ))
 ASSI {  276}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 49   and name HA  ))
      5.100     3.300     0.900 peak   276 spectrum    1 weight  0.11000E+01 volume  0.15937E-03 ppm1      6.796 ppm2      4.882 CV     1
 OR {  276}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  278}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 172  and name HA  ))
      4.200     2.200     1.800 peak   278 spectrum    1 weight  0.11000E+01 volume  0.12610E-02 ppm1      6.800 ppm2      3.881 CV     1
 OR {  278}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI {  279}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 56   and name HB2 ))
      3.000     1.200     1.200 peak   279 spectrum    1 weight  0.11000E+01 volume  0.33684E-02 ppm1      6.798 ppm2      2.260 CV     1
 OR {  279}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 156  and name HB1 ))
 ASSI {  280}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 52   and name HB% )
      2.000     0.500     0.500 peak   280 spectrum    1 weight  0.11000E+01 volume  0.15815E-01 ppm1      6.798 ppm2      1.821 CV     1
 OR {  280}
   (( segid "    " and resid 71   and name HH2 ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {  281}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 75   and name HB2 ))
      3.100     3.100     2.900 peak   281 spectrum    1 weight  0.11000E+01 volume  0.65968E-02 ppm1      6.798 ppm2      1.692 CV     1
 OR {  281}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI {  283}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 67   and name HD2%)
      3.400     3.400     2.600 peak   283 spectrum    1 weight  0.11000E+01 volume  0.33364E-02 ppm1      6.799 ppm2      1.060 CV     1
 OR {  283}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 172  and name HD2%)
 OR {  283}
   (( segid "    " and resid 71   and name HH2 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  284}
   (( segid "    " and resid 71   and name HH2 ))
   (  segid "    " and resid 163  and name HG1%)
      2.500     2.500     3.500 peak   284 spectrum    1 weight  0.11000E+01 volume  0.55993E-02 ppm1      6.798 ppm2      0.840 CV     1
 OR {  284}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  286}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 49   and name HE% )
      4.000     4.000     2.000 peak   286 spectrum    1 weight  0.11000E+01 volume  0.11058E-02 ppm1      6.793 ppm2      6.509 CV     1
 OR {  286}
   (( segid "    " and resid 71   and name HH2 ))
   (  segid "    " and resid 149  and name HE% )
 ASSI {  288}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 172  and name HG  ))
      5.200     3.400     0.800 peak   288 spectrum    1 weight  0.11000E+01 volume  0.29383E-03 ppm1      6.795 ppm2      1.998 CV     1
 OR {  288}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 72   and name HG  ))
 OR {  288}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 176  and name HB2 ))
 OR {  288}
   (( segid "    " and resid 171  and name HH2 ))
   (( segid "    " and resid 176  and name HB1 ))
 ASSI {  289}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 49   and name HA  ))
      5.400     3.700     0.600 peak   289 spectrum    1 weight  0.11000E+01 volume  0.28465E-03 ppm1      6.622 ppm2      4.875 CV     1
 OR {  289}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  290}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 164  and name HA  ))
      2.900     1.000     1.000 peak   290 spectrum    1 weight  0.11000E+01 volume  0.13719E-02 ppm1      6.620 ppm2      3.394 CV     1
 OR {  290}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  292}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 68   and name HA  ))
      5.400     3.600     0.600 peak   292 spectrum    1 weight  0.11000E+01 volume  0.27857E-03 ppm1      6.616 ppm2      3.292 CV     1
 OR {  292}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 168  and name HA  ))
 ASSI {  293}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 164  and name HB  ))
      4.600     2.600     1.400 peak   293 spectrum    1 weight  0.11000E+01 volume  0.61513E-03 ppm1      6.617 ppm2      2.106 CV     1
 OR {  293}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 64   and name HB  ))
 ASSI {  294}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 160  and name HG12))
      5.600     3.900     0.400 peak   294 spectrum    1 weight  0.11000E+01 volume  0.30930E-03 ppm1      6.619 ppm2      1.269 CV     1
 OR {  294}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI {  295}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 67   and name HD2%)
      3.000     1.100     1.100 peak   295 spectrum    1 weight  0.11000E+01 volume  0.10536E-02 ppm1      6.615 ppm2      1.072 CV     1
 OR {  295}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  296}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 160  and name HD1%)
      4.600     2.600     1.400 peak   296 spectrum    1 weight  0.11000E+01 volume  0.13411E-02 ppm1      6.616 ppm2      0.522 CV     1
 OR {  296}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI {  297}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 68   and name HG1%)
      3.500     1.500     1.500 peak   297 spectrum    1 weight  0.11000E+01 volume  0.20188E-02 ppm1      6.613 ppm2      0.054 CV     1
 OR {  297}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  299}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 41   and name HD% )
      4.000     2.000     2.000 peak   299 spectrum    1 weight  0.11000E+01 volume  0.66296E-03 ppm1      6.610 ppm2      7.311 CV     1
 OR {  299}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 171  and name HZ2 ))
 OR {  299}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 71   and name HZ2 ))
 ASSI {  300}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 71   and name HZ3 ))
      6.000     5.600     0.000 peak   300 spectrum    1 weight  0.11000E+01 volume  0.55524E-04 ppm1      6.610 ppm2      7.131 CV     1
 OR {  300}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 171  and name HZ3 ))
 ASSI {  302}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 149  and name HE% )
      1.800     0.400     0.400 peak   302 spectrum    1 weight  0.11000E+01 volume  0.17320E-01 ppm1      6.612 ppm2      6.507 CV     1
 OR {  302}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 49   and name HE% )
 ASSI {  303}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 163  and name HA  ))
      4.100     2.100     1.900 peak   303 spectrum    1 weight  0.11000E+01 volume  0.12542E-02 ppm1      6.613 ppm2      3.519 CV     1
 OR {  303}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  304}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 160  and name HA  ))
      3.600     1.700     1.700 peak   304 spectrum    1 weight  0.11000E+01 volume  0.29568E-02 ppm1      6.612 ppm2      3.144 CV     1
 OR {  304}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  306}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 167  and name HB1 ))
      6.000     4.500     0.000 peak   306 spectrum    1 weight  0.11000E+01 volume  0.00000E+00 ppm1      6.611 ppm2      1.914 CV     1
 OR {  306}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  306}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  306}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  306}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 167  and name HB2 ))
 ASSI {  307}
   (( segid "    " and resid 149  and name HZ  ))
   (( segid "    " and resid 163  and name HB  ))
      2.100     0.600     0.600 peak   307 spectrum    1 weight  0.11000E+01 volume  0.71203E-02 ppm1      6.613 ppm2      1.652 CV     1
 OR {  307}
   (( segid "    " and resid 49   and name HZ  ))
   (( segid "    " and resid 63   and name HB  ))
 ASSI {  308}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 64   and name HG2%)
      2.200     2.200     3.800 peak   308 spectrum    1 weight  0.11000E+01 volume  0.97050E-02 ppm1      6.613 ppm2      1.144 CV     1
 OR {  308}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 164  and name HG1%)
 ASSI {  309}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 164  and name HG2%)
      2.800     2.800     3.200 peak   309 spectrum    1 weight  0.11000E+01 volume  0.22627E-02 ppm1      6.613 ppm2      0.957 CV     1
 OR {  309}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI {  310}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 163  and name HG1%)
      2.900     1.000     1.000 peak   310 spectrum    1 weight  0.11000E+01 volume  0.48380E-02 ppm1      6.613 ppm2      0.838 CV     1
 OR {  310}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  311}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 160  and name HG2%)
      3.200     3.200     2.800 peak   311 spectrum    1 weight  0.11000E+01 volume  0.10933E-01 ppm1      6.613 ppm2      0.622 CV     1
 OR {  311}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 60   and name HG2%)
 ASSI {  315}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 163  and name HA  ))
      4.700     2.700     1.300 peak   315 spectrum    1 weight  0.11000E+01 volume  0.73561E-03 ppm1      6.513 ppm2      3.519 CV     1
 OR {  315}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  321}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 146  and name HD2 ))
      5.300     5.300     0.700 peak   321 spectrum    1 weight  0.11000E+01 volume  0.17103E-03 ppm1      6.507 ppm2      6.320 CV     1
 OR {  321}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 46   and name HD2 ))
 ASSI {  322}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 153  and name HA  ))
      5.600     5.600     0.400 peak   322 spectrum    1 weight  0.11000E+01 volume  0.16472E-03 ppm1      6.507 ppm2      3.973 CV     1
 OR {  322}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  323}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 164  and name HA  ))
      3.200     1.300     1.300 peak   323 spectrum    1 weight  0.11000E+01 volume  0.33558E-02 ppm1      6.509 ppm2      3.391 CV     1
 OR {  323}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  325}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 164  and name HB  ))
      4.100     2.100     1.900 peak   325 spectrum    1 weight  0.11000E+01 volume  0.17709E-02 ppm1      6.508 ppm2      2.105 CV     1
 OR {  325}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 64   and name HB  ))
 ASSI {  326}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 167  and name HG  ))
      3.600     1.600     1.600 peak   326 spectrum    1 weight  0.11000E+01 volume  0.18571E-02 ppm1      6.508 ppm2      2.016 CV     1
 OR {  326}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 67   and name HG  ))
 OR {  326}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  327}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 163  and name HB  ))
      2.300     2.300     3.700 peak   327 spectrum    1 weight  0.11000E+01 volume  0.86674E-02 ppm1      6.507 ppm2      1.649 CV     1
 OR {  327}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 63   and name HB  ))
 OR {  327}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 160  and name HB  ))
 ASSI {  328}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 64   and name HG2%)
      2.000     2.000     4.000 peak   328 spectrum    1 weight  0.11000E+01 volume  0.14759E-01 ppm1      6.506 ppm2      1.146 CV     1
 OR {  328}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 164  and name HG1%)
 ASSI {  329}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 67   and name HD2%)
      2.400     2.400     3.600 peak   329 spectrum    1 weight  0.11000E+01 volume  0.64141E-02 ppm1      6.506 ppm2      1.063 CV     1
 OR {  329}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  330}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 163  and name HG1%)
      2.500     2.500     3.500 peak   330 spectrum    1 weight  0.11000E+01 volume  0.76004E-02 ppm1      6.506 ppm2      0.839 CV     1
 OR {  330}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  331}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 68   and name HG2%)
      2.100     2.100     3.900 peak   331 spectrum    1 weight  0.11000E+01 volume  0.23601E-01 ppm1      6.506 ppm2      0.625 CV     1
 OR {  331}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 168  and name HG2%)
 OR {  331}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 60   and name HG2%)
 ASSI {  333}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 63   and name HG1%)
      2.200     2.200     3.800 peak   333 spectrum    1 weight  0.11000E+01 volume  0.16761E-01 ppm1      6.506 ppm2     -0.195 CV     1
 OR {  333}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 163  and name HG2%)
 ASSI {  338}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 146  and name HA  ))
      3.900     1.900     1.900 peak   338 spectrum    1 weight  0.11000E+01 volume  0.22746E-02 ppm1      6.503 ppm2      3.864 CV     1
 OR {  338}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  340}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 41   and name HB2 ))
      2.900     2.900     3.100 peak   340 spectrum    1 weight  0.11000E+01 volume  0.41306E-02 ppm1      6.503 ppm2      3.267 CV     1
 OR {  340}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 48   and name HD2 ))
 ASSI {  343}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 160  and name HG12))
      3.400     3.400     2.600 peak   343 spectrum    1 weight  0.11000E+01 volume  0.15278E-02 ppm1      6.504 ppm2      1.272 CV     1
 OR {  343}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 60   and name HG12))
 ASSI {  344}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 164  and name HG2%)
      2.500     2.500     3.500 peak   344 spectrum    1 weight  0.11000E+01 volume  0.31320E-02 ppm1      6.503 ppm2      0.955 CV     1
 OR {  344}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 64   and name HG1%)
 ASSI {  345}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 160  and name HD1%)
      3.200     3.200     2.800 peak   345 spectrum    1 weight  0.11000E+01 volume  0.63334E-02 ppm1      6.504 ppm2      0.514 CV     1
 OR {  345}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 60   and name HD1%)
 ASSI {  348}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 41   and name HZ  ))
      5.900     4.300     0.100 peak   348 spectrum    1 weight  0.11000E+01 volume  0.23534E-03 ppm1      6.323 ppm2      6.886 CV     1
 OR {  348}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 141  and name HZ  ))
 ASSI {  349}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 146  and name HA  ))
      2.100     0.600     0.600 peak   349 spectrum    1 weight  0.11000E+01 volume  0.88259E-02 ppm1      6.323 ppm2      3.862 CV     1
 OR {  349}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  350}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HB1 ))
      3.000     1.100     1.100 peak   350 spectrum    1 weight  0.11000E+01 volume  0.46363E-02 ppm1      6.323 ppm2      3.373 CV     1
 OR {  350}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 146  and name HB1 ))
 ASSI {  351}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 41   and name HB2 ))
      3.000     1.100     1.100 peak   351 spectrum    1 weight  0.11000E+01 volume  0.24680E-02 ppm1      6.323 ppm2      3.246 CV     1
 OR {  351}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 149  and name HB1 ))
 OR {  351}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 49   and name HB1 ))
 OR {  351}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 141  and name HB1 ))
 ASSI {  352}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 141  and name HB2 ))
      2.800     1.000     1.000 peak   352 spectrum    1 weight  0.11000E+01 volume  0.25886E-02 ppm1      6.323 ppm2      2.812 CV     1
 OR {  352}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 41   and name HB1 ))
 ASSI {  353}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 150  and name HB2 ))
      4.100     4.100     1.900 peak   353 spectrum    1 weight  0.11000E+01 volume  0.11557E-02 ppm1      6.323 ppm2      1.644 CV     1
 OR {  353}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 50   and name HB2 ))
 OR {  353}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 63   and name HB  ))
 ASSI {  354}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 35   and name HB2 ))
      2.700     0.900     0.900 peak   354 spectrum    1 weight  0.11000E+01 volume  0.31115E-02 ppm1      6.323 ppm2      1.488 CV     1
 OR {  354}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR {  354}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 35   and name HB1 ))
 OR {  354}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI {  355}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 135  and name HD1 ))
      4.200     2.200     1.800 peak   355 spectrum    1 weight  0.11000E+01 volume  0.10164E-02 ppm1      6.323 ppm2      1.416 CV     1
 OR {  355}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR {  355}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 45   and name HG1 ))
 OR {  355}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI {  356}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 150  and name HG1 ))
      3.300     1.400     1.400 peak   356 spectrum    1 weight  0.11000E+01 volume  0.20229E-02 ppm1      6.323 ppm2      1.266 CV     1
 OR {  356}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 50   and name HG1 ))
 OR {  356}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 150  and name HG2 ))
 OR {  356}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI {  357}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 160  and name HD1%)
      2.500     0.800     0.800 peak   357 spectrum    1 weight  0.11000E+01 volume  0.63304E-02 ppm1      6.323 ppm2      0.514 CV     1
 OR {  357}
   (( segid "    " and resid 46   and name HD2 ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI {  358}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 160  and name HG11))
      5.000     3.200     1.000 peak   358 spectrum    1 weight  0.11000E+01 volume  0.28177E-03 ppm1      6.324 ppm2     -0.250 CV     1
 OR {  358}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 60   and name HG11))
 ASSI {  362}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 149  and name HA  ))
      6.000     5.800     0.000 peak   362 spectrum    1 weight  0.11000E+01 volume  0.15999E-03 ppm1      6.321 ppm2      4.882 CV     1
 OR {  362}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  363}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 137  and name HA  ))
      5.100     3.200     0.900 peak   363 spectrum    1 weight  0.11000E+01 volume  0.47699E-03 ppm1      6.323 ppm2      4.137 CV     1
 OR {  363}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  364}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 149  and name HB2 ))
      3.600     1.600     1.600 peak   364 spectrum    1 weight  0.11000E+01 volume  0.15912E-02 ppm1      6.323 ppm2      3.112 CV     1
 OR {  364}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI {  365}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 46   and name HB2 ))
      2.400     0.700     0.700 peak   365 spectrum    1 weight  0.11000E+01 volume  0.43112E-02 ppm1      6.323 ppm2      2.962 CV     1
 OR {  365}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 146  and name HB2 ))
 ASSI {  366}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 137  and name HB  ))
      4.200     2.200     1.800 peak   366 spectrum    1 weight  0.11000E+01 volume  0.12316E-02 ppm1      6.322 ppm2      2.212 CV     1
 OR {  366}
   (( segid "    " and resid 146  and name HD2 ))
   (( segid "    " and resid 37   and name HB  ))
 ASSI {  367}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 135  and name HG2 ))
      5.100     3.300     0.900 peak   367 spectrum    1 weight  0.11000E+01 volume  0.26521E-03 ppm1      6.322 ppm2      0.952 CV     1
 OR {  367}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 164  and name HG2%)
 ASSI {  369}
   (( segid "    " and resid 46   and name HD2 ))
   (  segid "    " and resid 137  and name HG2%)
      2.200     2.200     3.800 peak   369 spectrum    1 weight  0.11000E+01 volume  0.12074E-01 ppm1      6.323 ppm2      0.657 CV     1
 OR {  369}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI {  372}
   (( segid "    " and resid 140  and name HA  ))
   (  segid "    " and resid 34   and name HG2%)
      4.300     2.300     1.700 peak   372 spectrum    1 weight  0.11000E+01 volume  0.66296E-03 ppm1      5.196 ppm2      0.721 CV     1
 OR {  372}
   (( segid "    " and resid 40   and name HA  ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI {  382}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
      3.200     1.300     1.300 peak   382 spectrum    1 weight  0.11000E+01 volume  0.11825E-02 ppm1      5.098 ppm2      2.490 CV     1
 OR {  382}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  383}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
      3.400     1.400     1.400 peak   383 spectrum    1 weight  0.11000E+01 volume  0.15530E-02 ppm1      5.095 ppm2      2.433 CV     1
 OR {  383}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB1 ))
 ASSI {  388}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 127  and name HB% )
      5.300     3.500     0.700 peak   388 spectrum    1 weight  0.11000E+01 volume  0.61443E-04 ppm1      4.593 ppm2      1.370 CV     1
 OR {  388}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 27   and name HB% )
 ASSI {  393}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB1 ))
      4.500     2.600     1.500 peak   393 spectrum    1 weight  0.11000E+01 volume  0.21959E-03 ppm1      4.565 ppm2      3.917 CV     1
 OR {  393}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
 OR {  393}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR {  393}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
 OR {  393}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
 ASSI {  399}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      4.500     2.500     1.500 peak   399 spectrum    1 weight  0.11000E+01 volume  0.23473E-03 ppm1      4.531 ppm2      3.920 CV     1
 OR {  399}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR {  399}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
 OR {  399}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
 ASSI {  405}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 42   and name HA  ))
      3.100     1.200     1.200 peak   405 spectrum    1 weight  0.11000E+01 volume  0.10206E-02 ppm1      4.503 ppm2      4.818 CV     1
 OR {  405}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  406}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 134  and name HG2%)
      3.100     1.200     1.200 peak   406 spectrum    1 weight  0.11000E+01 volume  0.16807E-02 ppm1      4.504 ppm2      0.725 CV     1
 OR {  406}
   (( segid "    " and resid 34   and name HA  ))
   (  segid "    " and resid 34   and name HG2%)
 OR {  406}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 134  and name HD1%)
 ASSI {  407}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
      4.100     2.100     1.900 peak   407 spectrum    1 weight  0.11000E+01 volume  0.39433E-03 ppm1      4.498 ppm2      3.920 CV     1
 OR {  407}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
 ASSI {  408}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 170  and name HB1 ))
      3.100     1.200     1.200 peak   408 spectrum    1 weight  0.11000E+01 volume  0.20631E-02 ppm1      4.495 ppm2      3.084 CV     1
 OR {  408}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
 OR {  408}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {  408}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 170  and name HB2 ))
 ASSI {  409}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 169  and name HB2 ))
      3.700     1.700     1.700 peak   409 spectrum    1 weight  0.11000E+01 volume  0.26749E-02 ppm1      4.496 ppm2      2.975 CV     1
 OR {  409}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  418}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 148  and name HD1 ))
      4.800     2.900     1.200 peak   418 spectrum    1 weight  0.11000E+01 volume  0.84081E-03 ppm1      4.443 ppm2      3.240 CV     1
 OR {  418}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HD2 ))
 OR {  418}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 149  and name HB1 ))
 OR {  418}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI {  419}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 162  and name HB2 ))
      3.200     1.300     1.300 peak   419 spectrum    1 weight  0.11000E+01 volume  0.13849E-02 ppm1      4.437 ppm2      2.707 CV     1
 OR {  419}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  428}
   (( segid "    " and resid 47   and name HB  ))
   (  segid "    " and resid 47   and name HG2%)
      2.800     0.900     0.900 peak   428 spectrum    1 weight  0.11000E+01 volume  0.31729E-02 ppm1      4.417 ppm2      1.283 CV     1
 OR {  428}
   (( segid "    " and resid 147  and name HB  ))
   (  segid "    " and resid 147  and name HG2%)
 ASSI {  430}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
      5.500     3.700     0.500 peak   430 spectrum    1 weight  0.11000E+01 volume  0.25892E-03 ppm1      4.407 ppm2      1.649 CV     1
 OR {  430}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 163  and name HB  ))
 ASSI {  434}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 72   and name HD1%)
      4.700     2.800     1.300 peak   434 spectrum    1 weight  0.11000E+01 volume  0.36033E-03 ppm1      4.375 ppm2      0.877 CV     1
 OR {  434}
   (( segid "    " and resid 169  and name HA  ))
   (  segid "    " and resid 172  and name HD1%)
 ASSI {  435}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      4.200     2.200     1.800 peak   435 spectrum    1 weight  0.11000E+01 volume  0.25709E-03 ppm1      4.347 ppm2      1.767 CV     1
 OR {  435}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HB1 ))
 ASSI {  441}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB  ))
      3.100     1.200     1.200 peak   441 spectrum    1 weight  0.11000E+01 volume  0.15353E-02 ppm1      4.315 ppm2      4.143 CV     1
 OR {  441}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
 OR {  441}
   (( segid "    " and resid 108  and name HA  ))
   (( segid "    " and resid 108  and name HB  ))
 OR {  441}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {  443}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HG1 ))
      5.000     3.200     1.000 peak   443 spectrum    1 weight  0.11000E+01 volume  0.23439E-03 ppm1      4.315 ppm2      1.915 CV     1
 OR {  443}
   (( segid "    " and resid 152  and name HA  ))
   (( segid "    " and resid 155  and name HG1 ))
 OR {  443}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HG2 ))
 OR {  443}
   (( segid "    " and resid 152  and name HA  ))
   (( segid "    " and resid 155  and name HG2 ))
 ASSI {  444}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG2 ))
      5.700     4.000     0.300 peak   444 spectrum    1 weight  0.11000E+01 volume  0.64138E-04 ppm1      4.315 ppm2      1.372 CV     1
 OR {  444}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI {  445}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 126  and name HG2%)
      3.400     1.400     1.400 peak   445 spectrum    1 weight  0.11000E+01 volume  0.19710E-02 ppm1      4.315 ppm2      1.199 CV     1
 OR {  445}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 26   and name HG2%)
 ASSI {  446}
   (( segid "    " and resid 152  and name HA  ))
   (  segid "    " and resid 152  and name HB% )
      2.400     0.700     0.700 peak   446 spectrum    1 weight  0.11000E+01 volume  0.63622E-02 ppm1      4.307 ppm2      1.819 CV     1
 OR {  446}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 52   and name HB% )
 OR {  446}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB2 ))
 OR {  446}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB1 ))
 OR {  446}
   (( segid "    " and resid 133  and name HA  ))
   (( segid "    " and resid 133  and name HB2 ))
 ASSI {  447}
   (( segid "    " and resid 152  and name HA  ))
   (( segid "    " and resid 155  and name HB2 ))
      6.000     4.500     0.000 peak   447 spectrum    1 weight  0.11000E+01 volume  0.00000E+00 ppm1      4.299 ppm2      1.942 CV     1
 OR {  447}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  448}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      3.100     1.200     1.200 peak   448 spectrum    1 weight  0.11000E+01 volume  0.16014E-02 ppm1      4.298 ppm2      1.750 CV     1
 OR {  448}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 OR {  448}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
 OR {  448}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI {  450}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 111  and name HG2 ))
      3.000     3.000     3.000 peak   450 spectrum    1 weight  0.11000E+01 volume  0.37434E-03 ppm1      4.285 ppm2      1.376 CV     1
 OR {  450}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI {  451}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HD1 ))
      5.100     3.300     0.900 peak   451 spectrum    1 weight  0.11000E+01 volume  0.30651E-03 ppm1      4.282 ppm2      1.673 CV     1
 OR {  451}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HD1 ))
 OR {  451}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HD2 ))
 OR {  451}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HD2 ))
 ASSI {  454}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG2 ))
      4.500     2.500     1.500 peak   454 spectrum    1 weight  0.11000E+01 volume  0.23080E-03 ppm1      4.263 ppm2      1.414 CV     1
 OR {  454}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HG2 ))
 ASSI {  456}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HG1 ))
      3.400     1.500     1.500 peak   456 spectrum    1 weight  0.11000E+01 volume  0.10364E-02 ppm1      4.255 ppm2      2.301 CV     1
 OR {  456}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HG1 ))
 OR {  456}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
 OR {  456}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HG2 ))
 OR {  456}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG1 ))
 ASSI {  459}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.600     0.800     0.800 peak   459 spectrum    1 weight  0.11000E+01 volume  0.57711E-02 ppm1      4.258 ppm2      1.942 CV     1
 OR {  459}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI {  460}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.800     1.000     1.000 peak   460 spectrum    1 weight  0.11000E+01 volume  0.40282E-02 ppm1      4.255 ppm2      1.791 CV     1
 OR {  460}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
 ASSI {  464}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HG2 ))
      5.700     4.000     0.300 peak   464 spectrum    1 weight  0.11000E+01 volume  0.67991E-04 ppm1      4.230 ppm2      2.247 CV     1
 OR {  464}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {  464}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HG1 ))
 OR {  464}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI {  466}
   (( segid "    " and resid 154  and name HA  ))
   (  segid "    " and resid 154  and name HB% )
      1.900     1.900     4.100 peak   466 spectrum    1 weight  0.11000E+01 volume  0.33305E-01 ppm1      4.228 ppm2      1.544 CV     1
 OR {  466}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HB% )
 ASSI {    2}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      1.800     0.400     0.400 peak     2 spectrum    1 weight  0.10000E+01 volume  0.14309E-01 ppm1      5.123 ppm2      9.231 CV     1
 OR {    2}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {    3}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      1.800     0.400     0.400 peak     3 spectrum    1 weight  0.10000E+01 volume  0.17852E-01 ppm1      5.085 ppm2      9.213 CV     1
 OR {    3}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 139  and name HN  ))
 ASSI {    5}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 49   and name HN  ))
      3.000     1.100     1.100 peak     5 spectrum    1 weight  0.10000E+01 volume  0.28825E-02 ppm1      6.958 ppm2      9.082 CV     1
 OR {    5}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 149  and name HN  ))
 OR {    5}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 50   and name HN  ))
 OR {    5}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 150  and name HN  ))
 ASSI {   10}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 167  and name HN  ))
      6.000     4.600     0.000 peak    10 spectrum    1 weight  0.10000E+01 volume  0.40126E-04 ppm1      7.399 ppm2      8.540 CV     1
 OR {   10}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HN  ))
 OR {   10}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HN  ))
 ASSI {   12}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
      2.500     0.800     0.800 peak    12 spectrum    1 weight  0.10000E+01 volume  0.35140E-02 ppm1      5.086 ppm2      8.488 CV     1
 OR {   12}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI {   14}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      2.600     0.800     0.800 peak    14 spectrum    1 weight  0.10000E+01 volume  0.20140E-02 ppm1      5.180 ppm2      7.731 CV     1
 OR {   14}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI {   17}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 141  and name HD% )
      1.600     0.300     0.600 peak    17 spectrum    1 weight  0.10000E+01 volume  0.34879E-01 ppm1      6.951 ppm2      7.321 CV     1
 OR {   17}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 41   and name HD% )
 ASSI {   26}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 149  and name HD% )
      1.800     0.400     0.400 peak    26 spectrum    1 weight  0.10000E+01 volume  0.15243E-01 ppm1      6.507 ppm2      6.953 CV     1
 OR {   26}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 49   and name HD% )
 OR {   26}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 41   and name HE% )
 ASSI {   27}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 149  and name HD% )
      3.800     1.800     1.800 peak    27 spectrum    1 weight  0.10000E+01 volume  0.45855E-03 ppm1      6.318 ppm2      6.951 CV     1
 OR {   27}
   (( segid "    " and resid 46   and name HD2 ))
   (  segid "    " and resid 49   and name HD% )
 OR {   27}
   (( segid "    " and resid 46   and name HD2 ))
   (  segid "    " and resid 41   and name HE% )
 OR {   27}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {   28}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 41   and name HE% )
      3.600     1.600     1.600 peak    28 spectrum    1 weight  0.10000E+01 volume  0.20847E-02 ppm1      5.120 ppm2      6.960 CV     1
 OR {   28}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {   31}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 149  and name HE% )
      4.200     2.200     1.800 peak    31 spectrum    1 weight  0.10000E+01 volume  0.10897E-03 ppm1      7.253 ppm2      6.514 CV     1
 OR {   31}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 49   and name HE% )
 ASSI {   32}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 149  and name HE% )
      1.800     0.400     0.400 peak    32 spectrum    1 weight  0.10000E+01 volume  0.16071E-01 ppm1      6.960 ppm2      6.512 CV     1
 OR {   32}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 49   and name HE% )
 OR {   32}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 149  and name HE% )
 ASSI {   33}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 149  and name HE% )
      3.700     1.700     1.700 peak    33 spectrum    1 weight  0.10000E+01 volume  0.67491E-03 ppm1      6.877 ppm2      6.517 CV     1
 OR {   33}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 49   and name HE% )
 ASSI {   38}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 49   and name HA  ))
      4.600     2.700     1.400 peak    38 spectrum    1 weight  0.10000E+01 volume  0.41659E-03 ppm1      6.504 ppm2      4.874 CV     1
 OR {   38}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 149  and name HA  ))
 ASSI {   39}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 136  and name HA  ))
      2.200     0.600     0.600 peak    39 spectrum    1 weight  0.10000E+01 volume  0.41738E-02 ppm1      5.183 ppm2      4.591 CV     1
 OR {   39}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {   40}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HA  ))
      2.800     0.900     0.900 peak    40 spectrum    1 weight  0.10000E+01 volume  0.25137E-02 ppm1      7.400 ppm2      4.191 CV     1
 OR {   40}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HA  ))
 OR {   40}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 167  and name HA  ))
 OR {   40}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI {   42}
   (( segid "    " and resid 115  and name HZ  ))
   (( segid "    " and resid 116  and name HA2 ))
      2.300     2.300     3.700 peak    42 spectrum    1 weight  0.10000E+01 volume  0.13898E-02 ppm1      7.321 ppm2      3.895 CV     1
 OR {   42}
   (( segid "    " and resid 15   and name HZ  ))
   (( segid "    " and resid 16   and name HA1 ))
 ASSI {   44}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 65   and name HA  ))
      2.700     0.900     0.900 peak    44 spectrum    1 weight  0.10000E+01 volume  0.37116E-02 ppm1      6.952 ppm2      3.893 CV     1
 OR {   44}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 165  and name HA  ))
 OR {   44}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 46   and name HA  ))
 OR {   44}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 146  and name HA  ))
 ASSI {   46}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 71   and name HB2 ))
      2.400     0.700     0.700 peak    46 spectrum    1 weight  0.10000E+01 volume  0.39357E-02 ppm1      7.400 ppm2      3.339 CV     1
 OR {   46}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HB2 ))
 OR {   46}
   (( segid "    " and resid 171  and name HD1 ))
   (( segid "    " and resid 171  and name HB1 ))
 ASSI {   48}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 71   and name HB1 ))
      2.700     0.900     0.900 peak    48 spectrum    1 weight  0.10000E+01 volume  0.15303E-02 ppm1      7.255 ppm2      3.338 CV     1
 OR {   48}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {   48}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI {   51}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB1 ))
      2.300     0.700     0.700 peak    51 spectrum    1 weight  0.10000E+01 volume  0.40746E-02 ppm1      5.120 ppm2      3.240 CV     1
 OR {   51}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {   52}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 60   and name HA  ))
      3.500     1.500     1.500 peak    52 spectrum    1 weight  0.10000E+01 volume  0.10366E-02 ppm1      6.507 ppm2      3.148 CV     1
 OR {   52}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 160  and name HA  ))
 ASSI {   53}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 160  and name HA  ))
      2.600     2.600     3.400 peak    53 spectrum    1 weight  0.10000E+01 volume  0.68449E-02 ppm1      6.959 ppm2      3.137 CV     1
 OR {   53}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 60   and name HA  ))
 ASSI {   58}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HB1 ))
      2.200     0.600     0.600 peak    58 spectrum    1 weight  0.10000E+01 volume  0.64171E-02 ppm1      5.124 ppm2      2.820 CV     1
 OR {   58}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {   62}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.900     1.000     1.000 peak    62 spectrum    1 weight  0.10000E+01 volume  0.23296E-02 ppm1      5.184 ppm2      2.587 CV     1
 OR {   62}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI {   63}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
      2.100     0.600     0.600 peak    63 spectrum    1 weight  0.10000E+01 volume  0.10087E-01 ppm1      5.088 ppm2      2.474 CV     1
 OR {   63}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {   63}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {   63}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HB1 ))
 ASSI {   64}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB1 ))
      2.200     0.600     0.600 peak    64 spectrum    1 weight  0.10000E+01 volume  0.46506E-02 ppm1      5.181 ppm2      2.323 CV     1
 OR {   64}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI {   65}
   (( segid "    " and resid 115  and name HZ  ))
   (( segid "    " and resid 117  and name HG1 ))
      1.800     1.800     4.200 peak    65 spectrum    1 weight  0.10000E+01 volume  0.58422E-02 ppm1      7.321 ppm2      2.212 CV     1
 OR {   65}
   (( segid "    " and resid 15   and name HZ  ))
   (( segid "    " and resid 17   and name HG1 ))
 OR {   65}
   (( segid "    " and resid 115  and name HZ  ))
   (( segid "    " and resid 117  and name HG2 ))
 OR {   65}
   (( segid "    " and resid 15   and name HZ  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {   68}
   (( segid "    " and resid 171  and name HE3 ))
   (( segid "    " and resid 172  and name HG  ))
      2.800     1.000     1.000 peak    68 spectrum    1 weight  0.10000E+01 volume  0.34958E-02 ppm1      7.262 ppm2      2.000 CV     1
 OR {   68}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 72   and name HG  ))
 OR {   68}
   (( segid "    " and resid 71   and name HE3 ))
   (( segid "    " and resid 167  and name HG  ))
 ASSI {   69}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 167  and name HB1 ))
      3.900     1.900     1.900 peak    69 spectrum    1 weight  0.10000E+01 volume  0.12702E-02 ppm1      6.507 ppm2      1.879 CV     1
 OR {   69}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 67   and name HB1 ))
 OR {   69}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 167  and name HB2 ))
 OR {   69}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 67   and name HB2 ))
 ASSI {   72}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 152  and name HB% )
      2.300     0.700     0.700 peak    72 spectrum    1 weight  0.10000E+01 volume  0.58422E-02 ppm1      7.127 ppm2      1.823 CV     1
 OR {   72}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 52   and name HB% )
 ASSI {   73}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 39   and name HB  ))
      2.300     2.300     3.700 peak    73 spectrum    1 weight  0.10000E+01 volume  0.11181E-01 ppm1      6.954 ppm2      1.838 CV     1
 OR {   73}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 139  and name HB  ))
 OR {   73}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 52   and name HB% )
 OR {   73}
   (  segid "    " and resid 149  and name HD% )
   (  segid "    " and resid 152  and name HB% )
 ASSI {   75}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 136  and name HB1 ))
      4.300     2.300     1.700 peak    75 spectrum    1 weight  0.10000E+01 volume  0.40100E-03 ppm1      5.190 ppm2      1.816 CV     1
 OR {   75}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR {   75}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 136  and name HB2 ))
 OR {   75}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI {   76}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 139  and name HB  ))
      4.400     2.400     1.600 peak    76 spectrum    1 weight  0.10000E+01 volume  0.48218E-03 ppm1      5.098 ppm2      1.816 CV     1
 OR {   76}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 39   and name HB  ))
 OR {   76}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 39   and name HB  ))
 ASSI {   81}
   (  segid "    " and resid 149  and name HE% )
   (( segid "    " and resid 163  and name HB  ))
      2.900     1.000     1.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.15840E-02 ppm1      6.513 ppm2      1.637 CV     1
 OR {   81}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 63   and name HB  ))
 ASSI {   82}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 136  and name HG2 ))
      3.700     1.700     1.700 peak    82 spectrum    1 weight  0.10000E+01 volume  0.12774E-02 ppm1      5.181 ppm2      1.636 CV     1
 OR {   82}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 36   and name HG2 ))
 OR {   82}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 136  and name HG1 ))
 OR {   82}
   (( segid "    " and resid 140  and name HA  ))
   (( segid "    " and resid 36   and name HG1 ))
 ASSI {   83}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HD1 ))
      2.900     1.100     1.100 peak    83 spectrum    1 weight  0.10000E+01 volume  0.19271E-02 ppm1      7.717 ppm2      1.542 CV     1
 OR {   83}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HD1 ))
 OR {   83}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR {   83}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 150  and name HD2 ))
 OR {   83}
   (( segid "    " and resid 146  and name HE1 ))
   (( segid "    " and resid 35   and name HD1 ))
 ASSI {   85}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 35   and name HB2 ))
      3.300     1.400     1.400 peak    85 spectrum    1 weight  0.10000E+01 volume  0.16057E-02 ppm1      6.953 ppm2      1.471 CV     1
 OR {   85}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 135  and name HB2 ))
 OR {   85}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 45   and name HG1 ))
 OR {   85}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HG2 ))
 OR {   85}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 135  and name HB2 ))
 OR {   85}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HG1 ))
 OR {   85}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 45   and name HG2 ))
 OR {   85}
   (  segid "    " and resid 141  and name HE% )
   (( segid "    " and resid 35   and name HB1 ))
 OR {   85}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 135  and name HB1 ))
 ASSI {   86}
   (( segid "    " and resid 71   and name HZ2 ))
   (  segid "    " and resid 158  and name HG2%)
      4.000     2.000     2.000 peak    86 spectrum    1 weight  0.10000E+01 volume  0.30058E-03 ppm1      7.312 ppm2      1.186 CV     1
 OR {   86}
   (( segid "    " and resid 171  and name HZ2 ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI {   87}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 164  and name HG1%)
      3.200     1.300     1.300 peak    87 spectrum    1 weight  0.10000E+01 volume  0.65941E-03 ppm1      6.880 ppm2      1.147 CV     1
 OR {   87}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 64   and name HG2%)
 OR {   87}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 164  and name HG1%)
 ASSI {   93}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 67   and name HD2%)
      3.000     1.100     1.100 peak    93 spectrum    1 weight  0.10000E+01 volume  0.26411E-02 ppm1      7.136 ppm2      1.064 CV     1
 OR {   93}
   (( segid "    " and resid 171  and name HZ3 ))
   (  segid "    " and resid 172  and name HD2%)
 OR {   93}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {   94}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 167  and name HD1%)
      2.400     2.400     3.600 peak    94 spectrum    1 weight  0.10000E+01 volume  0.95250E-02 ppm1      6.958 ppm2      1.046 CV     1
 OR {   94}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 172  and name HD2%)
 OR {   94}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 67   and name HD2%)
 OR {   94}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 167  and name HD1%)
 OR {   94}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 67   and name HD2%)
 ASSI {   95}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 64   and name HG1%)
      2.400     0.700     0.700 peak    95 spectrum    1 weight  0.10000E+01 volume  0.38837E-02 ppm1      6.877 ppm2      0.957 CV     1
 OR {   95}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 164  and name HG2%)
 OR {   95}
   (( segid "    " and resid 141  and name HZ  ))
   (  segid "    " and resid 64   and name HG1%)
 ASSI {   96}
   (( segid "    " and resid 171  and name HE3 ))
   (  segid "    " and resid 172  and name HD1%)
      4.200     2.200     1.800 peak    96 spectrum    1 weight  0.10000E+01 volume  0.26548E-03 ppm1      7.269 ppm2      0.866 CV     1
 OR {   96}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 72   and name HD1%)
 OR {   96}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {   98}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 163  and name HG1%)
      2.600     0.800     0.800 peak    98 spectrum    1 weight  0.10000E+01 volume  0.39606E-02 ppm1      6.507 ppm2      0.847 CV     1
 OR {   98}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 72   and name HD1%)
 OR {   98}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 172  and name HD1%)
 OR {   98}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 63   and name HG2%)
 OR {   98}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 137  and name HG1%)
 ASSI {   99}
   (( segid "    " and resid 71   and name HZ2 ))
   (  segid "    " and resid 163  and name HG1%)
      3.000     1.100     1.100 peak    99 spectrum    1 weight  0.10000E+01 volume  0.15396E-02 ppm1      7.309 ppm2      0.827 CV     1
 OR {   99}
   (( segid "    " and resid 171  and name HZ2 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  100}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 137  and name HG1%)
      2.200     2.200     3.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.10985E-01 ppm1      6.951 ppm2      0.813 CV     1
 OR {  100}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 37   and name HG1%)
 OR {  100}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 63   and name HG2%)
 OR {  100}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 137  and name HG1%)
 ASSI {  102}
   (( segid "    " and resid 46   and name HD2 ))
   (  segid "    " and resid 137  and name HG1%)
      3.200     1.300     1.300 peak   102 spectrum    1 weight  0.10000E+01 volume  0.31758E-02 ppm1      6.321 ppm2      0.820 CV     1
 OR {  102}
   (( segid "    " and resid 146  and name HD2 ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI {  103}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 137  and name HG1%)
      3.200     1.300     1.300 peak   103 spectrum    1 weight  0.10000E+01 volume  0.19579E-02 ppm1      5.093 ppm2      0.786 CV     1
 OR {  103}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 37   and name HG1%)
 OR {  103}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 139  and name HG1%)
 OR {  103}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI {  105}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 134  and name HG2%)
      4.200     2.200     1.800 peak   105 spectrum    1 weight  0.10000E+01 volume  0.24072E-03 ppm1      5.119 ppm2      0.712 CV     1
 OR {  105}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 34   and name HG2%)
 ASSI {  107}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 137  and name HG2%)
      2.000     2.000     4.000 peak   107 spectrum    1 weight  0.10000E+01 volume  0.14512E-01 ppm1      6.952 ppm2      0.630 CV     1
 OR {  107}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 37   and name HG2%)
 OR {  107}
   (  segid "    " and resid 141  and name HE% )
   (  segid "    " and resid 68   and name HG2%)
 OR {  107}
   (  segid "    " and resid 41   and name HE% )
   (  segid "    " and resid 168  and name HG2%)
 OR {  107}
   (  segid "    " and resid 49   and name HD% )
   (  segid "    " and resid 60   and name HG2%)
 ASSI {  111}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 68   and name HG2%)
      2.600     2.600     3.400 peak   111 spectrum    1 weight  0.10000E+01 volume  0.34315E-02 ppm1      6.608 ppm2      0.611 CV     1
 OR {  111}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 168  and name HG2%)
 ASSI {  117}
   (  segid "    " and resid 149  and name HE% )
   (  segid "    " and resid 68   and name HG1%)
      3.600     1.600     1.600 peak   117 spectrum    1 weight  0.10000E+01 volume  0.55474E-03 ppm1      6.508 ppm2      0.039 CV     1
 OR {  117}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  118}
   (  segid "    " and resid 149  and name HD% )
   (( segid "    " and resid 160  and name HG11))
      2.600     0.800     0.800 peak   118 spectrum    1 weight  0.10000E+01 volume  0.12580E-02 ppm1      6.956 ppm2     -0.205 CV     1
 OR {  118}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 60   and name HG11))
 ASSI {  119}
   (( segid "    " and resid 49   and name HZ  ))
   (  segid "    " and resid 63   and name HG1%)
      2.800     1.000     1.000 peak   119 spectrum    1 weight  0.10000E+01 volume  0.35281E-02 ppm1      6.609 ppm2     -0.204 CV     1
 OR {  119}
   (( segid "    " and resid 149  and name HZ  ))
   (  segid "    " and resid 163  and name HG2%)
 ASSI {  123}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.700     0.900     0.900 peak   123 spectrum    1 weight  0.10000E+01 volume  0.21281E-02 ppm1      4.525 ppm2      9.444 CV     1
 OR {  123}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  124}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      2.600     0.800     0.800 peak   124 spectrum    1 weight  0.10000E+01 volume  0.23190E-02 ppm1      3.877 ppm2      9.458 CV     1
 OR {  124}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  128}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 135  and name HN  ))
      6.000     6.000     0.000 peak   128 spectrum    1 weight  0.10000E+01 volume  0.19734E-04 ppm1      2.006 ppm2      9.452 CV     1
 OR {  128}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
 OR {  128}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 172  and name HN  ))
 OR {  128}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
 OR {  128}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 135  and name HN  ))
 OR {  128}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {  129}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 72   and name HN  ))
      3.200     1.200     1.200 peak   129 spectrum    1 weight  0.10000E+01 volume  0.28352E-02 ppm1      2.006 ppm2      9.456 CV     1
 OR {  129}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  132}
   (( segid "    " and resid 34   and name HB  ))
   (( segid "    " and resid 35   and name HN  ))
      3.200     1.300     1.300 peak   132 spectrum    1 weight  0.10000E+01 volume  0.21096E-02 ppm1      1.751 ppm2      9.445 CV     1
 OR {  132}
   (( segid "    " and resid 134  and name HB  ))
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  134}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HN  ))
      2.300     0.600     0.600 peak   134 spectrum    1 weight  0.10000E+01 volume  0.59578E-02 ppm1      1.483 ppm2      9.444 CV     1
 OR {  134}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
 OR {  134}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HN  ))
 OR {  134}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {  136}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 172  and name HN  ))
      3.500     1.500     1.500 peak   136 spectrum    1 weight  0.10000E+01 volume  0.25181E-02 ppm1      1.059 ppm2      9.455 CV     1
 OR {  136}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 72   and name HN  ))
 ASSI {  138}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 72   and name HN  ))
      3.400     1.500     1.500 peak   138 spectrum    1 weight  0.10000E+01 volume  0.23838E-02 ppm1      0.877 ppm2      9.447 CV     1
 OR {  138}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  139}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 35   and name HN  ))
      2.200     2.200     3.800 peak   139 spectrum    1 weight  0.10000E+01 volume  0.18252E-02 ppm1      0.737 ppm2      9.444 CV     1
 OR {  139}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  141}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      1.800     0.400     0.400 peak   141 spectrum    1 weight  0.10000E+01 volume  0.14601E-01 ppm1      4.506 ppm2      9.442 CV     1
 OR {  141}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  143}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 172  and name HN  ))
      3.800     1.800     1.800 peak   143 spectrum    1 weight  0.10000E+01 volume  0.44698E-03 ppm1      4.199 ppm2      9.438 CV     1
 OR {  143}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI {  144}
   (( segid "    " and resid 34   and name HG12))
   (( segid "    " and resid 35   and name HN  ))
      6.000     6.000     0.000 peak   144 spectrum    1 weight  0.10000E+01 volume  0.19256E-04 ppm1      1.207 ppm2      9.441 CV     1
 OR {  144}
   (( segid "    " and resid 134  and name HG11))
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  145}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 35   and name HN  ))
      2.300     2.300     3.700 peak   145 spectrum    1 weight  0.10000E+01 volume  0.50749E-02 ppm1      0.716 ppm2      9.441 CV     1
 OR {  145}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  146}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 142  and name HN  ))
      2.100     0.500     0.500 peak   146 spectrum    1 weight  0.10000E+01 volume  0.57690E-02 ppm1      2.737 ppm2      9.234 CV     1
 OR {  146}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {  147}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      4.700     2.700     1.300 peak   147 spectrum    1 weight  0.10000E+01 volume  0.20165E-03 ppm1      4.597 ppm2      9.218 CV     1
 OR {  147}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 139  and name HN  ))
 OR {  147}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
 ASSI {  148}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HN  ))
      2.600     0.800     0.800 peak   148 spectrum    1 weight  0.10000E+01 volume  0.25505E-02 ppm1      3.975 ppm2      9.208 CV     1
 OR {  148}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  149}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 142  and name HN  ))
      2.900     1.100     1.100 peak   149 spectrum    1 weight  0.10000E+01 volume  0.61610E-02 ppm1      2.843 ppm2      9.231 CV     1
 OR {  149}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {  155}
   (( segid "    " and resid 139  and name HB  ))
   (( segid "    " and resid 139  and name HN  ))
      2.400     0.700     0.700 peak   155 spectrum    1 weight  0.10000E+01 volume  0.49266E-02 ppm1      1.805 ppm2      9.213 CV     1
 OR {  155}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  156}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 39   and name HN  ))
      3.400     3.400     2.600 peak   156 spectrum    1 weight  0.10000E+01 volume  0.12649E-02 ppm1      0.824 ppm2      9.214 CV     1
 OR {  156}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 139  and name HN  ))
 ASSI {  157}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 139  and name HN  ))
      3.000     1.100     1.100 peak   157 spectrum    1 weight  0.10000E+01 volume  0.49930E-02 ppm1      0.774 ppm2      9.212 CV     1
 OR {  157}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  160}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      6.000     6.000     0.000 peak   160 spectrum    1 weight  0.10000E+01 volume  0.19242E-04 ppm1      4.135 ppm2      9.189 CV     1
 OR {  160}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
 OR {  160}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 139  and name HN  ))
 ASSI {  164}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 149  and name HN  ))
      3.700     1.700     1.700 peak   164 spectrum    1 weight  0.10000E+01 volume  0.94090E-03 ppm1      4.177 ppm2      9.088 CV     1
 OR {  164}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
 OR {  164}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  165}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      3.500     1.500     1.500 peak   165 spectrum    1 weight  0.10000E+01 volume  0.59208E-03 ppm1      4.166 ppm2      9.086 CV     1
 OR {  165}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 149  and name HN  ))
 OR {  165}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  166}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 149  and name HN  ))
      5.100     3.200     0.900 peak   166 spectrum    1 weight  0.10000E+01 volume  0.73625E-04 ppm1      3.965 ppm2      9.071 CV     1
 OR {  166}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
 OR {  166}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  167}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 149  and name HN  ))
      3.200     1.300     1.300 peak   167 spectrum    1 weight  0.10000E+01 volume  0.16732E-02 ppm1      3.863 ppm2      9.078 CV     1
 OR {  167}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
 OR {  167}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  168}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 150  and name HN  ))
      3.000     1.200     1.200 peak   168 spectrum    1 weight  0.10000E+01 volume  0.13672E-02 ppm1      3.651 ppm2      9.080 CV     1
 OR {  168}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
 OR {  168}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  169}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      2.500     0.800     0.800 peak   169 spectrum    1 weight  0.10000E+01 volume  0.38632E-02 ppm1      3.442 ppm2      9.086 CV     1
 OR {  169}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  170}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
      2.600     0.900     0.900 peak   170 spectrum    1 weight  0.10000E+01 volume  0.48001E-02 ppm1      3.246 ppm2      9.083 CV     1
 OR {  170}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HN  ))
 OR {  170}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  172}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
      2.100     0.600     0.600 peak   172 spectrum    1 weight  0.10000E+01 volume  0.44387E-02 ppm1      3.108 ppm2      9.079 CV     1
 OR {  172}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 149  and name HN  ))
 OR {  172}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  175}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 141  and name HN  ))
      2.700     0.900     0.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.19088E-02 ppm1      2.816 ppm2      9.105 CV     1
 OR {  175}
   (( segid "    " and resid 41   and name HB1 ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  180}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
      3.200     1.300     1.300 peak   180 spectrum    1 weight  0.10000E+01 volume  0.77965E-03 ppm1      1.924 ppm2      9.090 CV     1
 OR {  180}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 149  and name HN  ))
 ASSI {  181}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 49   and name HN  ))
      6.000     5.000     0.000 peak   181 spectrum    1 weight  0.10000E+01 volume  0.20085E-04 ppm1      1.815 ppm2      9.081 CV     1
 OR {  181}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 150  and name HN  ))
 OR {  181}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  182}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 150  and name HN  ))
      2.200     0.600     0.600 peak   182 spectrum    1 weight  0.10000E+01 volume  0.52165E-02 ppm1      1.659 ppm2      9.086 CV     1
 OR {  182}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  183}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 150  and name HN  ))
      4.000     2.000     2.000 peak   183 spectrum    1 weight  0.10000E+01 volume  0.10787E-02 ppm1      1.559 ppm2      9.088 CV     1
 OR {  183}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  184}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.200     1.200 peak   184 spectrum    1 weight  0.10000E+01 volume  0.47884E-02 ppm1      1.401 ppm2      9.085 CV     1
 OR {  184}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  185}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 150  and name HN  ))
      3.900     1.900     1.900 peak   185 spectrum    1 weight  0.10000E+01 volume  0.70936E-03 ppm1      1.289 ppm2      9.086 CV     1
 OR {  185}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 50   and name HN  ))
 OR {  185}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 49   and name HN  ))
 OR {  185}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 149  and name HN  ))
 ASSI {  187}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HN  ))
      2.700     0.900     0.900 peak   187 spectrum    1 weight  0.10000E+01 volume  0.29418E-02 ppm1      1.261 ppm2      9.083 CV     1
 OR {  187}
   (( segid "    " and resid 150  and name HG1 ))
   (( segid "    " and resid 150  and name HN  ))
 OR {  187}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HN  ))
 OR {  187}
   (( segid "    " and resid 150  and name HG2 ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  188}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 149  and name HN  ))
      3.200     1.300     1.300 peak   188 spectrum    1 weight  0.10000E+01 volume  0.12446E-02 ppm1      1.060 ppm2      9.077 CV     1
 OR {  188}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  189}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 149  and name HN  ))
      3.200     1.300     1.300 peak   189 spectrum    1 weight  0.10000E+01 volume  0.82349E-03 ppm1      0.875 ppm2      9.079 CV     1
 OR {  189}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  191}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 141  and name HN  ))
      2.800     2.800     3.200 peak   191 spectrum    1 weight  0.10000E+01 volume  0.29814E-02 ppm1      0.718 ppm2      9.097 CV     1
 OR {  191}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  192}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 41   and name HN  ))
      3.100     3.100     2.900 peak   192 spectrum    1 weight  0.10000E+01 volume  0.12231E-02 ppm1      0.658 ppm2      9.104 CV     1
 OR {  192}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 141  and name HN  ))
 ASSI {  193}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 150  and name HN  ))
      2.300     2.300     3.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.23169E-02 ppm1      0.512 ppm2      9.085 CV     1
 OR {  193}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 50   and name HN  ))
 OR {  193}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  195}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 164  and name HN  ))
      2.400     0.700     0.700 peak   195 spectrum    1 weight  0.10000E+01 volume  0.25150E-02 ppm1      3.392 ppm2      8.953 CV     1
 OR {  195}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  196}
   (( segid "    " and resid 160  and name HA  ))
   (( segid "    " and resid 164  and name HN  ))
      4.800     2.900     1.200 peak   196 spectrum    1 weight  0.10000E+01 volume  0.20731E-03 ppm1      3.145 ppm2      8.948 CV     1
 OR {  196}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  197}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 64   and name HN  ))
      2.200     0.600     0.600 peak   197 spectrum    1 weight  0.10000E+01 volume  0.56117E-02 ppm1      2.107 ppm2      8.951 CV     1
 OR {  197}
   (( segid "    " and resid 164  and name HB  ))
   (( segid "    " and resid 164  and name HN  ))
 ASSI {  198}
   (( segid "    " and resid 163  and name HB  ))
   (( segid "    " and resid 164  and name HN  ))
      2.400     0.700     0.700 peak   198 spectrum    1 weight  0.10000E+01 volume  0.24707E-02 ppm1      1.647 ppm2      8.946 CV     1
 OR {  198}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI {  204}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
      2.900     1.100     1.100 peak   204 spectrum    1 weight  0.10000E+01 volume  0.20170E-02 ppm1      3.845 ppm2      8.922 CV     1
 OR {  204}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 164  and name HN  ))
 ASSI {  211}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
      2.900     1.000     1.000 peak   211 spectrum    1 weight  0.10000E+01 volume  0.20279E-02 ppm1      4.502 ppm2      8.831 CV     1
 OR {  211}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  213}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
      2.100     0.600     0.600 peak   213 spectrum    1 weight  0.10000E+01 volume  0.91357E-02 ppm1      3.891 ppm2      8.824 CV     1
 OR {  213}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
 OR {  213}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {  214}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
      2.500     0.800     0.800 peak   214 spectrum    1 weight  0.10000E+01 volume  0.33784E-02 ppm1      3.876 ppm2      8.835 CV     1
 OR {  214}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
 OR {  214}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
 OR {  214}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {  215}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 146  and name HN  ))
      2.700     0.900     0.900 peak   215 spectrum    1 weight  0.10000E+01 volume  0.35305E-02 ppm1      3.369 ppm2      8.830 CV     1
 OR {  215}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  218}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      2.200     0.600     0.600 peak   218 spectrum    1 weight  0.10000E+01 volume  0.37630E-02 ppm1      2.962 ppm2      8.842 CV     1
 OR {  218}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {  219}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 143  and name HN  ))
      2.300     0.700     0.700 peak   219 spectrum    1 weight  0.10000E+01 volume  0.30677E-02 ppm1      2.840 ppm2      8.819 CV     1
 OR {  219}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  221}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.400     1.500     1.500 peak   221 spectrum    1 weight  0.10000E+01 volume  0.27535E-02 ppm1      2.739 ppm2      8.819 CV     1
 OR {  221}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 143  and name HN  ))
 ASSI {  222}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      2.100     0.500     0.500 peak   222 spectrum    1 weight  0.10000E+01 volume  0.72944E-02 ppm1      2.103 ppm2      8.819 CV     1
 OR {  222}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 143  and name HN  ))
 OR {  222}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 143  and name HN  ))
 OR {  222}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  225}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      5.100     3.300     0.900 peak   225 spectrum    1 weight  0.10000E+01 volume  0.22003E-03 ppm1      1.485 ppm2      8.829 CV     1
 OR {  225}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 146  and name HN  ))
 OR {  225}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
 OR {  225}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {  227}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 143  and name HN  ))
      5.600     4.000     0.400 peak   227 spectrum    1 weight  0.10000E+01 volume  0.11046E-03 ppm1      0.717 ppm2      8.841 CV     1
 OR {  227}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  229}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HN  ))
      3.100     1.200     1.200 peak   229 spectrum    1 weight  0.10000E+01 volume  0.61367E-02 ppm1      2.284 ppm2      8.793 CV     1
 OR {  229}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 143  and name HN  ))
 OR {  229}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HN  ))
 OR {  229}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 143  and name HN  ))
 ASSI {  232}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 147  and name HN  ))
      2.200     0.600     0.600 peak   232 spectrum    1 weight  0.10000E+01 volume  0.69629E-02 ppm1      4.426 ppm2      8.730 CV     1
 OR {  232}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  233}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      2.900     1.000     1.000 peak   233 spectrum    1 weight  0.10000E+01 volume  0.21518E-02 ppm1      4.112 ppm2      8.760 CV     1
 OR {  233}
   (( segid "    " and resid 159  and name HB1 ))
   (( segid "    " and resid 160  and name HN  ))
 OR {  233}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
 OR {  233}
   (( segid "    " and resid 159  and name HB2 ))
   (( segid "    " and resid 160  and name HN  ))
 ASSI {  235}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 160  and name HN  ))
      3.400     1.400     1.400 peak   235 spectrum    1 weight  0.10000E+01 volume  0.23028E-02 ppm1      3.837 ppm2      8.746 CV     1
 OR {  235}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  239}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 160  and name HN  ))
      2.300     0.700     0.700 peak   239 spectrum    1 weight  0.10000E+01 volume  0.38761E-02 ppm1      1.631 ppm2      8.745 CV     1
 OR {  239}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  246}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.200     0.600     0.600 peak   246 spectrum    1 weight  0.10000E+01 volume  0.76702E-02 ppm1      4.189 ppm2      8.727 CV     1
 OR {  246}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 144  and name HN  ))
 OR {  246}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  247}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 147  and name HN  ))
      2.600     0.800     0.800 peak   247 spectrum    1 weight  0.10000E+01 volume  0.28806E-02 ppm1      3.653 ppm2      8.725 CV     1
 OR {  247}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  250}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 147  and name HN  ))
      3.400     1.400     1.400 peak   250 spectrum    1 weight  0.10000E+01 volume  0.27413E-02 ppm1      1.292 ppm2      8.728 CV     1
 OR {  250}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  251}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 131  and name HN  ))
      2.300     0.700     0.700 peak   251 spectrum    1 weight  0.10000E+01 volume  0.64027E-02 ppm1      4.553 ppm2      8.655 CV     1
 OR {  251}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI {  252}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      3.100     1.200     1.200 peak   252 spectrum    1 weight  0.10000E+01 volume  0.10490E-02 ppm1      3.916 ppm2      8.674 CV     1
 OR {  252}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  253}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HN  ))
      2.400     0.700     0.700 peak   253 spectrum    1 weight  0.10000E+01 volume  0.31006E-02 ppm1      3.285 ppm2      8.678 CV     1
 OR {  253}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  254}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 168  and name HN  ))
      2.100     0.600     0.600 peak   254 spectrum    1 weight  0.10000E+01 volume  0.66349E-02 ppm1      1.922 ppm2      8.685 CV     1
 OR {  254}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 68   and name HN  ))
 ASSI {  255}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 168  and name HN  ))
      4.100     2.100     1.900 peak   255 spectrum    1 weight  0.10000E+01 volume  0.41533E-03 ppm1      1.139 ppm2      8.660 CV     1
 OR {  255}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 68   and name HN  ))
 OR {  255}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 68   and name HN  ))
 ASSI {  256}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 68   and name HN  ))
      3.300     1.400     1.400 peak   256 spectrum    1 weight  0.10000E+01 volume  0.14254E-02 ppm1      0.949 ppm2      8.673 CV     1
 OR {  256}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 168  and name HN  ))
 OR {  256}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  257}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 168  and name HN  ))
      2.300     0.700     0.700 peak   257 spectrum    1 weight  0.10000E+01 volume  0.78332E-02 ppm1      0.614 ppm2      8.680 CV     1
 OR {  257}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 68   and name HN  ))
 ASSI {  258}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 168  and name HN  ))
      2.900     1.100     1.100 peak   258 spectrum    1 weight  0.10000E+01 volume  0.26865E-02 ppm1      0.053 ppm2      8.687 CV     1
 OR {  258}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 68   and name HN  ))
 ASSI {  259}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.300     1.300     1.300 peak   259 spectrum    1 weight  0.10000E+01 volume  0.14315E-02 ppm1      3.972 ppm2      8.623 CV     1
 OR {  259}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HN  ))
 ASSI {  260}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HN  ))
      2.600     0.800     0.800 peak   260 spectrum    1 weight  0.10000E+01 volume  0.42082E-02 ppm1      3.930 ppm2      8.619 CV     1
 OR {  260}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HN  ))
 OR {  260}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
 OR {  260}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 131  and name HN  ))
 OR {  260}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 131  and name HN  ))
 ASSI {  265}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      1.900     0.400     0.400 peak   265 spectrum    1 weight  0.10000E+01 volume  0.15547E-01 ppm1      4.593 ppm2      8.592 CV     1
 OR {  265}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 137  and name HN  ))
 ASSI {  266}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 132  and name HN  ))
      2.300     0.700     0.700 peak   266 spectrum    1 weight  0.10000E+01 volume  0.63205E-02 ppm1      4.506 ppm2      8.593 CV     1
 OR {  266}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
 OR {  266}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI {  268}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name HN  ))
      2.400     0.700     0.700 peak   268 spectrum    1 weight  0.10000E+01 volume  0.53685E-02 ppm1      4.277 ppm2      8.599 CV     1
 OR {  268}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
 ASSI {  269}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      2.200     0.600     0.600 peak   269 spectrum    1 weight  0.10000E+01 volume  0.52420E-02 ppm1      4.171 ppm2      8.583 CV     1
 OR {  269}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  272}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 67   and name HN  ))
      4.400     2.400     1.600 peak   272 spectrum    1 weight  0.10000E+01 volume  0.31235E-03 ppm1      2.569 ppm2      8.587 CV     1
 OR {  272}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  273}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 167  and name HN  ))
      5.100     3.200     0.900 peak   273 spectrum    1 weight  0.10000E+01 volume  0.13931E-03 ppm1      2.436 ppm2      8.596 CV     1
 OR {  273}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI {  277}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 137  and name HN  ))
      2.200     0.600     0.600 peak   277 spectrum    1 weight  0.10000E+01 volume  0.65683E-02 ppm1      2.215 ppm2      8.587 CV     1
 OR {  277}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  278}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 67   and name HN  ))
      1.700     0.300     0.500 peak   278 spectrum    1 weight  0.10000E+01 volume  0.43532E-02 ppm1      2.021 ppm2      8.587 CV     1
 OR {  278}
   (( segid "    " and resid 167  and name HG  ))
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  279}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 137  and name HN  ))
      4.600     2.600     1.400 peak   279 spectrum    1 weight  0.10000E+01 volume  0.11299E-03 ppm1      1.802 ppm2      8.585 CV     1
 OR {  279}
   (( segid "    " and resid 139  and name HB  ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  282}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 67   and name HN  ))
      2.500     0.800     0.800 peak   282 spectrum    1 weight  0.10000E+01 volume  0.79263E-02 ppm1      1.080 ppm2      8.575 CV     1
 OR {  282}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  283}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 137  and name HN  ))
      3.600     1.700     1.700 peak   283 spectrum    1 weight  0.10000E+01 volume  0.13848E-02 ppm1      0.771 ppm2      8.563 CV     1
 OR {  283}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 37   and name HN  ))
 OR {  283}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 67   and name HN  ))
 OR {  283}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  284}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 167  and name HN  ))
      2.600     0.800     0.800 peak   284 spectrum    1 weight  0.10000E+01 volume  0.64673E-02 ppm1      0.567 ppm2      8.584 CV     1
 OR {  284}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 67   and name HN  ))
 ASSI {  285}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 37   and name HN  ))
      6.000     5.900     0.000 peak   285 spectrum    1 weight  0.10000E+01 volume  0.19333E-04 ppm1      0.473 ppm2      8.582 CV     1
 OR {  285}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 137  and name HN  ))
 OR {  285}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 37   and name HN  ))
 OR {  285}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 67   and name HN  ))
 OR {  285}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  286}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 67   and name HN  ))
      3.700     3.700     2.300 peak   286 spectrum    1 weight  0.10000E+01 volume  0.95309E-03 ppm1     -0.195 ppm2      8.594 CV     1
 OR {  286}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  291}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 171  and name HN  ))
      2.700     0.900     0.900 peak   291 spectrum    1 weight  0.10000E+01 volume  0.33073E-02 ppm1      3.282 ppm2      8.542 CV     1
 OR {  291}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
 OR {  291}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 167  and name HN  ))
 OR {  291}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI {  292}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HN  ))
      2.400     0.700     0.700 peak   292 spectrum    1 weight  0.10000E+01 volume  0.28039E-02 ppm1      3.084 ppm2      8.537 CV     1
 OR {  292}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HN  ))
 ASSI {  294}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HN  ))
      2.400     2.400     3.600 peak   294 spectrum    1 weight  0.10000E+01 volume  0.64150E-02 ppm1      0.657 ppm2      8.549 CV     1
 OR {  294}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  295}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
      2.500     0.800     0.800 peak   295 spectrum    1 weight  0.10000E+01 volume  0.37898E-02 ppm1      4.553 ppm2      8.498 CV     1
 OR {  295}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
 OR {  295}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
 OR {  295}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
 ASSI {  296}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HN  ))
      1.900     0.500     0.500 peak   296 spectrum    1 weight  0.10000E+01 volume  0.17603E-01 ppm1      4.530 ppm2      8.481 CV     1
 OR {  296}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  298}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      2.300     0.700     0.700 peak   298 spectrum    1 weight  0.10000E+01 volume  0.55300E-02 ppm1      4.192 ppm2      8.501 CV     1
 OR {  298}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HN  ))
 ASSI {  299}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      1.800     0.400     0.400 peak   299 spectrum    1 weight  0.10000E+01 volume  0.18885E-01 ppm1      4.146 ppm2      8.489 CV     1
 OR {  299}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI {  300}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
      2.500     0.800     0.800 peak   300 spectrum    1 weight  0.10000E+01 volume  0.42067E-02 ppm1      3.927 ppm2      8.501 CV     1
 OR {  300}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HN  ))
 OR {  300}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HN  ))
 OR {  300}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
 OR {  300}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HN  ))
 ASSI {  301}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HN  ))
      2.700     0.900     0.900 peak   301 spectrum    1 weight  0.10000E+01 volume  0.31317E-02 ppm1      3.867 ppm2      8.487 CV     1
 OR {  301}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
 ASSI {  306}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
      2.900     2.900     3.100 peak   306 spectrum    1 weight  0.10000E+01 volume  0.37610E-02 ppm1      1.827 ppm2      8.499 CV     1
 OR {  306}
   (( segid "    " and resid 136  and name HB2 ))
   (( segid "    " and resid 138  and name HN  ))
 OR {  306}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
 OR {  306}
   (( segid "    " and resid 136  and name HB1 ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI {  308}
   (( segid "    " and resid 36   and name HG2 ))
   (( segid "    " and resid 36   and name HN  ))
      2.300     0.600     0.600 peak   308 spectrum    1 weight  0.10000E+01 volume  0.78173E-02 ppm1      1.611 ppm2      8.484 CV     1
 OR {  308}
   (( segid "    " and resid 136  and name HG2 ))
   (( segid "    " and resid 136  and name HN  ))
 OR {  308}
   (( segid "    " and resid 36   and name HG1 ))
   (( segid "    " and resid 36   and name HN  ))
 OR {  308}
   (( segid "    " and resid 136  and name HG1 ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI {  310}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 136  and name HN  ))
      2.600     0.800     0.800 peak   310 spectrum    1 weight  0.10000E+01 volume  0.30862E-02 ppm1      1.479 ppm2      8.485 CV     1
 OR {  310}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 36   and name HN  ))
 OR {  310}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  311}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 36   and name HN  ))
      4.400     2.400     1.600 peak   311 spectrum    1 weight  0.10000E+01 volume  0.48236E-03 ppm1      1.427 ppm2      8.491 CV     1
 OR {  311}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI {  312}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 136  and name HN  ))
      4.200     2.200     1.800 peak   312 spectrum    1 weight  0.10000E+01 volume  0.99825E-03 ppm1      1.211 ppm2      8.490 CV     1
 OR {  312}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  314}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 138  and name HN  ))
      2.200     2.200     3.800 peak   314 spectrum    1 weight  0.10000E+01 volume  0.65433E-02 ppm1      0.827 ppm2      8.498 CV     1
 OR {  314}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HN  ))
 ASSI {  316}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 153  and name HN  ))
      2.600     0.800     0.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.32380E-02 ppm1      3.978 ppm2      8.454 CV     1
 OR {  316}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI {  318}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HN  ))
      3.500     1.500     1.500 peak   318 spectrum    1 weight  0.10000E+01 volume  0.55985E-03 ppm1      3.183 ppm2      8.470 CV     1
 OR {  318}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  320}
   (( segid "    " and resid 115  and name HB2 ))
   (( segid "    " and resid 115  and name HN  ))
      3.500     1.500     1.500 peak   320 spectrum    1 weight  0.10000E+01 volume  0.12441E-02 ppm1      3.036 ppm2      8.441 CV     1
 OR {  320}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
 OR {  320}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  321}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      2.900     1.000     1.000 peak   321 spectrum    1 weight  0.10000E+01 volume  0.25947E-02 ppm1      2.798 ppm2      8.458 CV     1
 OR {  321}
   (( segid "    " and resid 153  and name HB2 ))
   (( segid "    " and resid 153  and name HN  ))
 ASSI {  324}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 153  and name HN  ))
      2.200     2.200     3.800 peak   324 spectrum    1 weight  0.10000E+01 volume  0.73907E-02 ppm1      1.821 ppm2      8.456 CV     1
 OR {  324}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 53   and name HN  ))
 ASSI {  325}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 53   and name HN  ))
      3.700     1.700     1.700 peak   325 spectrum    1 weight  0.10000E+01 volume  0.20464E-02 ppm1      1.542 ppm2      8.453 CV     1
 OR {  325}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 153  and name HN  ))
 ASSI {  326}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 136  and name HN  ))
      4.400     2.400     1.600 peak   326 spectrum    1 weight  0.10000E+01 volume  0.49231E-03 ppm1      1.533 ppm2      8.463 CV     1
 OR {  326}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {  328}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 9    and name HN  ))
      6.000     4.700     0.000 peak   328 spectrum    1 weight  0.10000E+01 volume  0.57670E-04 ppm1      1.133 ppm2      8.456 CV     1
 OR {  328}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 109  and name HN  ))
 ASSI {  329}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 36   and name HN  ))
      4.900     3.000     1.100 peak   329 spectrum    1 weight  0.10000E+01 volume  0.34615E-03 ppm1      0.944 ppm2      8.473 CV     1
 OR {  329}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI {  330}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HN  ))
      2.600     0.900     0.900 peak   330 spectrum    1 weight  0.10000E+01 volume  0.31532E-02 ppm1      4.652 ppm2      8.434 CV     1
 OR {  330}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
 OR {  330}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
 OR {  330}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  331}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
      1.900     0.400     0.400 peak   331 spectrum    1 weight  0.10000E+01 volume  0.22391E-01 ppm1      4.305 ppm2      8.416 CV     1
 OR {  331}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
 OR {  331}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
 OR {  331}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
 ASSI {  332}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name HN  ))
      1.600     0.300     0.600 peak   332 spectrum    1 weight  0.10000E+01 volume  0.40983E-01 ppm1      4.116 ppm2      8.413 CV     1
 OR {  332}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
 OR {  332}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
 OR {  332}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI {  333}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   333 spectrum    1 weight  0.10000E+01 volume  0.50676E-03 ppm1      3.187 ppm2      8.435 CV     1
 OR {  333}
   (( segid "    " and resid 115  and name HB1 ))
   (( segid "    " and resid 115  and name HN  ))
 OR {  333}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  336}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HN  ))
      2.200     0.600     0.600 peak   336 spectrum    1 weight  0.10000E+01 volume  0.85614E-02 ppm1      1.802 ppm2      8.405 CV     1
 OR {  336}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 111  and name HN  ))
 OR {  336}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 112  and name HN  ))
 ASSI {  337}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      2.900     1.000     1.000 peak   337 spectrum    1 weight  0.10000E+01 volume  0.22286E-02 ppm1      1.750 ppm2      8.409 CV     1
 OR {  337}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HN  ))
 OR {  337}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  338}
   (  segid "    " and resid 125  and name HG2%)
   (( segid "    " and resid 125  and name HN  ))
      2.400     0.700     0.700 peak   338 spectrum    1 weight  0.10000E+01 volume  0.82381E-02 ppm1      0.948 ppm2      8.404 CV     1
 OR {  338}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
 OR {  338}
   (  segid "    " and resid 125  and name HG1%)
   (( segid "    " and resid 125  and name HN  ))
 OR {  338}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name HN  ))
 OR {  338}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  341}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HN  ))
      2.700     0.900     0.900 peak   341 spectrum    1 weight  0.10000E+01 volume  0.29061E-02 ppm1      4.573 ppm2      8.389 CV     1
 OR {  341}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  342}
   (( segid "    " and resid 26   and name HA  ))
   (( segid "    " and resid 27   and name HN  ))
      1.900     0.400     0.400 peak   342 spectrum    1 weight  0.10000E+01 volume  0.20732E-01 ppm1      4.322 ppm2      8.368 CV     1
 OR {  342}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  345}
   (( segid "    " and resid 16   and name HA2 ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     1.600     1.600 peak   345 spectrum    1 weight  0.10000E+01 volume  0.31171E-02 ppm1      3.959 ppm2      8.371 CV     1
 OR {  345}
   (( segid "    " and resid 116  and name HA1 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI {  346}
   (( segid "    " and resid 16   and name HA1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.000     3.000     3.000 peak   346 spectrum    1 weight  0.10000E+01 volume  0.29500E-02 ppm1      3.874 ppm2      8.357 CV     1
 OR {  346}
   (( segid "    " and resid 116  and name HA2 ))
   (( segid "    " and resid 119  and name HN  ))
 ASSI {  348}
   (( segid "    " and resid 125  and name HB  ))
   (( segid "    " and resid 125  and name HN  ))
      2.200     0.600     0.600 peak   348 spectrum    1 weight  0.10000E+01 volume  0.13636E-01 ppm1      2.082 ppm2      8.381 CV     1
 OR {  348}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
 OR {  348}
   (( segid "    " and resid 110  and name HB  ))
   (( segid "    " and resid 111  and name HN  ))
 OR {  348}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 11   and name HN  ))
 OR {  348}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI {  350}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HN  ))
      2.700     0.900     0.900 peak   350 spectrum    1 weight  0.10000E+01 volume  0.36468E-02 ppm1      1.757 ppm2      8.388 CV     1
 OR {  350}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HN  ))
 OR {  350}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
 OR {  350}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
 OR {  350}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HN  ))
 OR {  350}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HN  ))
 OR {  350}
   (( segid "    " and resid 133  and name HB1 ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI {  351}
   (( segid "    " and resid 112  and name HG1 ))
   (( segid "    " and resid 112  and name HN  ))
      2.800     1.000     1.000 peak   351 spectrum    1 weight  0.10000E+01 volume  0.35452E-02 ppm1      1.476 ppm2      8.359 CV     1
 OR {  351}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 12   and name HN  ))
 OR {  351}
   (( segid "    " and resid 111  and name HG1 ))
   (( segid "    " and resid 111  and name HN  ))
 OR {  351}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HN  ))
 OR {  351}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI {  352}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 112  and name HN  ))
      2.900     1.100     1.100 peak   352 spectrum    1 weight  0.10000E+01 volume  0.32483E-02 ppm1      1.410 ppm2      8.371 CV     1
 OR {  352}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HN  ))
 OR {  352}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HN  ))
 OR {  352}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HN  ))
 OR {  352}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HN  ))
 OR {  352}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HN  ))
 OR {  352}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HN  ))
 OR {  352}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI {  354}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 11   and name HN  ))
      2.800     1.000     1.000 peak   354 spectrum    1 weight  0.10000E+01 volume  0.58119E-02 ppm1      0.925 ppm2      8.376 CV     1
 OR {  354}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 111  and name HN  ))
 OR {  354}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
 OR {  354}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 111  and name HN  ))
 ASSI {  355}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 129  and name HN  ))
      1.900     0.400     0.400 peak   355 spectrum    1 weight  0.10000E+01 volume  0.19377E-01 ppm1      4.473 ppm2      8.344 CV     1
 OR {  355}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
 ASSI {  356}
   (( segid "    " and resid 114  and name HB  ))
   (( segid "    " and resid 117  and name HN  ))
      2.700     2.700     3.300 peak   356 spectrum    1 weight  0.10000E+01 volume  0.59112E-02 ppm1      4.152 ppm2      8.335 CV     1
 OR {  356}
   (( segid "    " and resid 14   and name HB  ))
   (( segid "    " and resid 17   and name HN  ))
 ASSI {  360}
   (( segid "    " and resid 28   and name HG1 ))
   (( segid "    " and resid 27   and name HN  ))
      4.100     2.100     1.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.27421E-03 ppm1      2.034 ppm2      8.336 CV     1
 OR {  360}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 127  and name HN  ))
 OR {  360}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 27   and name HN  ))
 OR {  360}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  363}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HN  ))
      4.000     2.000     2.000 peak   363 spectrum    1 weight  0.10000E+01 volume  0.98310E-03 ppm1      1.718 ppm2      8.349 CV     1
 OR {  363}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HN  ))
 OR {  363}
   (( segid "    " and resid 33   and name HD1 ))
   (( segid "    " and resid 33   and name HN  ))
 OR {  363}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI {  365}
   (  segid "    " and resid 26   and name HG2%)
   (( segid "    " and resid 27   and name HN  ))
      3.200     1.300     1.300 peak   365 spectrum    1 weight  0.10000E+01 volume  0.24562E-02 ppm1      1.202 ppm2      8.315 CV     1
 OR {  365}
   (  segid "    " and resid 126  and name HG2%)
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  369}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      2.000     0.500     0.500 peak   369 spectrum    1 weight  0.10000E+01 volume  0.12320E-01 ppm1      4.281 ppm2      8.274 CV     1
 OR {  369}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  372}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HN  ))
      2.200     0.600     0.600 peak   372 spectrum    1 weight  0.10000E+01 volume  0.78493E-02 ppm1      4.080 ppm2      8.291 CV     1
 OR {  372}
   (( segid "    " and resid 161  and name HB  ))
   (( segid "    " and resid 161  and name HN  ))
 ASSI {  373}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 161  and name HN  ))
      2.400     0.700     0.700 peak   373 spectrum    1 weight  0.10000E+01 volume  0.37363E-02 ppm1      3.846 ppm2      8.285 CV     1
 OR {  373}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  374}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      2.800     1.000     1.000 peak   374 spectrum    1 weight  0.10000E+01 volume  0.19330E-02 ppm1      3.151 ppm2      8.272 CV     1
 OR {  374}
   (( segid "    " and resid 160  and name HA  ))
   (( segid "    " and resid 161  and name HN  ))
 ASSI {  375}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HN  ))
      3.900     1.900     1.900 peak   375 spectrum    1 weight  0.10000E+01 volume  0.12717E-02 ppm1      2.244 ppm2      8.281 CV     1
 OR {  375}
   (( segid "    " and resid 122  and name HG2 ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  376}
   (( segid "    " and resid 164  and name HB  ))
   (( segid "    " and resid 161  and name HN  ))
      2.900     2.900     3.100 peak   376 spectrum    1 weight  0.10000E+01 volume  0.44618E-03 ppm1      2.098 ppm2      8.282 CV     1
 OR {  376}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  377}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   377 spectrum    1 weight  0.10000E+01 volume  0.51008E-02 ppm1      2.053 ppm2      8.268 CV     1
 OR {  377}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  379}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HN  ))
      2.400     0.700     0.700 peak   379 spectrum    1 weight  0.10000E+01 volume  0.54634E-02 ppm1      1.965 ppm2      8.273 CV     1
 OR {  379}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HN  ))
 OR {  379}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
 OR {  379}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HN  ))
 OR {  379}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
 ASSI {  380}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 52   and name HN  ))
      2.000     0.500     0.500 peak   380 spectrum    1 weight  0.10000E+01 volume  0.11956E-01 ppm1      1.820 ppm2      8.284 CV     1
 OR {  380}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 152  and name HN  ))
 ASSI {  384}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 161  and name HN  ))
      2.900     1.100     1.100 peak   384 spectrum    1 weight  0.10000E+01 volume  0.52220E-02 ppm1      1.268 ppm2      8.290 CV     1
 OR {  384}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  386}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 122  and name HN  ))
      4.700     2.800     1.300 peak   386 spectrum    1 weight  0.10000E+01 volume  0.20218E-04 ppm1      0.864 ppm2      8.289 CV     1
 OR {  386}
   (  segid "    " and resid 21   and name HD1%)
   (( segid "    " and resid 22   and name HN  ))
 ASSI {  393}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HN  ))
      2.600     0.800     0.800 peak   393 spectrum    1 weight  0.10000E+01 volume  0.28363E-02 ppm1      4.511 ppm2      8.251 CV     1
 OR {  393}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
 ASSI {  394}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      3.300     1.400     1.400 peak   394 spectrum    1 weight  0.10000E+01 volume  0.98195E-03 ppm1      4.436 ppm2      8.248 CV     1
 OR {  394}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 163  and name HN  ))
 OR {  394}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  397}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      2.500     0.800     0.800 peak   397 spectrum    1 weight  0.10000E+01 volume  0.29248E-02 ppm1      3.520 ppm2      8.257 CV     1
 OR {  397}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 163  and name HN  ))
 ASSI {  398}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 52   and name HN  ))
      2.500     2.500     3.500 peak   398 spectrum    1 weight  0.10000E+01 volume  0.23906E-02 ppm1      3.392 ppm2      8.260 CV     1
 OR {  398}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 152  and name HN  ))
 ASSI {  400}
   (( segid "    " and resid 162  and name HB1 ))
   (( segid "    " and resid 163  and name HN  ))
      2.900     1.000     1.000 peak   400 spectrum    1 weight  0.10000E+01 volume  0.16083E-02 ppm1      2.587 ppm2      8.247 CV     1
 OR {  400}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 63   and name HN  ))
 OR {  400}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  401}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
      3.300     1.300     1.300 peak   401 spectrum    1 weight  0.10000E+01 volume  0.97420E-03 ppm1      2.118 ppm2      8.253 CV     1
 OR {  401}
   (( segid "    " and resid 148  and name HB2 ))
   (( segid "    " and resid 152  and name HN  ))
 ASSI {  404}
   (( segid "    " and resid 34   and name HB  ))
   (( segid "    " and resid 34   and name HN  ))
      2.100     0.600     0.600 peak   404 spectrum    1 weight  0.10000E+01 volume  0.10368E-01 ppm1      1.752 ppm2      8.255 CV     1
 OR {  404}
   (( segid "    " and resid 134  and name HB  ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI {  405}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 63   and name HN  ))
      2.500     0.800     0.800 peak   405 spectrum    1 weight  0.10000E+01 volume  0.58281E-02 ppm1      1.650 ppm2      8.251 CV     1
 OR {  405}
   (( segid "    " and resid 163  and name HB  ))
   (( segid "    " and resid 163  and name HN  ))
 ASSI {  406}
   (( segid "    " and resid 34   and name HG11))
   (( segid "    " and resid 34   and name HN  ))
      2.600     0.800     0.800 peak   406 spectrum    1 weight  0.10000E+01 volume  0.35331E-02 ppm1      1.424 ppm2      8.255 CV     1
 OR {  406}
   (( segid "    " and resid 134  and name HG12))
   (( segid "    " and resid 134  and name HN  ))
 ASSI {  407}
   (( segid "    " and resid 134  and name HG11))
   (( segid "    " and resid 134  and name HN  ))
      2.500     0.800     0.800 peak   407 spectrum    1 weight  0.10000E+01 volume  0.37856E-02 ppm1      1.212 ppm2      8.257 CV     1
 OR {  407}
   (( segid "    " and resid 34   and name HG12))
   (( segid "    " and resid 34   and name HN  ))
 ASSI {  410}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
      2.500     0.800     0.800 peak   410 spectrum    1 weight  0.10000E+01 volume  0.77845E-02 ppm1      0.953 ppm2      8.230 CV     1
 OR {  410}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HN  ))
 OR {  410}
   (  segid "    " and resid 125  and name HG1%)
   (( segid "    " and resid 126  and name HN  ))
 OR {  410}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 26   and name HN  ))
 OR {  410}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
 ASSI {  411}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 110  and name HN  ))
      2.700     0.900     0.900 peak   411 spectrum    1 weight  0.10000E+01 volume  0.27794E-02 ppm1      0.916 ppm2      8.228 CV     1
 OR {  411}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HN  ))
 OR {  411}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 110  and name HN  ))
 ASSI {  412}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 152  and name HN  ))
      3.300     3.300     2.700 peak   412 spectrum    1 weight  0.10000E+01 volume  0.10132E-02 ppm1      0.873 ppm2      8.249 CV     1
 OR {  412}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 163  and name HN  ))
 ASSI {  414}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 134  and name HN  ))
      3.100     1.200     1.200 peak   414 spectrum    1 weight  0.10000E+01 volume  0.22573E-02 ppm1      0.736 ppm2      8.258 CV     1
 OR {  414}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HN  ))
 ASSI {  417}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 169  and name HN  ))
      2.300     0.700     0.700 peak   417 spectrum    1 weight  0.10000E+01 volume  0.57476E-02 ppm1      4.384 ppm2      8.195 CV     1
 OR {  417}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  420}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 110  and name HN  ))
      2.600     0.800     0.800 peak   420 spectrum    1 weight  0.10000E+01 volume  0.32618E-02 ppm1      4.113 ppm2      8.212 CV     1
 OR {  420}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
 OR {  420}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
 OR {  420}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HN  ))
 ASSI {  422}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      3.600     1.700     1.700 peak   422 spectrum    1 weight  0.10000E+01 volume  0.34597E-03 ppm1      3.286 ppm2      8.196 CV     1
 OR {  422}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 169  and name HN  ))
 ASSI {  425}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HN  ))
      2.600     0.800     0.800 peak   425 spectrum    1 weight  0.10000E+01 volume  0.60873E-02 ppm1      2.667 ppm2      8.197 CV     1
 OR {  425}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 169  and name HN  ))
 OR {  425}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  427}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 69   and name HN  ))
      2.500     0.800     0.800 peak   427 spectrum    1 weight  0.10000E+01 volume  0.39228E-02 ppm1      1.921 ppm2      8.202 CV     1
 OR {  427}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 169  and name HN  ))
 ASSI {  437}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      2.700     0.900     0.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.30372E-02 ppm1      1.763 ppm2      8.178 CV     1
 OR {  437}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HN  ))
 OR {  437}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HN  ))
 OR {  437}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HN  ))
 OR {  437}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 24   and name HN  ))
 OR {  437}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 124  and name HN  ))
 ASSI {  438}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 169  and name HN  ))
      6.000     5.800     0.000 peak   438 spectrum    1 weight  0.10000E+01 volume  0.21384E-04 ppm1      1.077 ppm2      8.169 CV     1
 OR {  438}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 169  and name HN  ))
 OR {  438}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  439}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      2.200     0.600     0.600 peak   439 spectrum    1 weight  0.10000E+01 volume  0.87211E-02 ppm1      4.573 ppm2      8.108 CV     1
 OR {  439}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  441}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 21   and name HN  ))
      2.600     0.800     0.800 peak   441 spectrum    1 weight  0.10000E+01 volume  0.37918E-02 ppm1      1.630 ppm2      8.119 CV     1
 OR {  441}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 121  and name HN  ))
 OR {  441}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 21   and name HN  ))
 OR {  441}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 121  and name HN  ))
 ASSI {  443}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      2.400     0.700     0.700 peak   443 spectrum    1 weight  0.10000E+01 volume  0.45329E-02 ppm1      4.282 ppm2      8.097 CV     1
 OR {  443}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  445}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 158  and name HN  ))
      2.200     0.600     0.600 peak   445 spectrum    1 weight  0.10000E+01 volume  0.77469E-02 ppm1      1.183 ppm2      8.059 CV     1
 OR {  445}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  446}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 148  and name HN  ))
      2.300     0.700     0.700 peak   446 spectrum    1 weight  0.10000E+01 volume  0.41251E-02 ppm1      4.423 ppm2      8.040 CV     1
 OR {  446}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  447}
   (( segid "    " and resid 158  and name HB  ))
   (( segid "    " and resid 158  and name HN  ))
      3.000     1.100     1.100 peak   447 spectrum    1 weight  0.10000E+01 volume  0.22616E-02 ppm1      3.977 ppm2      8.047 CV     1
 OR {  447}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  449}
   (( segid "    " and resid 155  and name HD1 ))
   (( segid "    " and resid 155  and name HN  ))
      4.000     2.000     2.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.82539E-03 ppm1      3.390 ppm2      8.027 CV     1
 OR {  449}
   (( segid "    " and resid 55   and name HD1 ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  449}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 148  and name HN  ))
 OR {  449}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  450}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 148  and name HN  ))
      3.700     1.700     1.700 peak   450 spectrum    1 weight  0.10000E+01 volume  0.17535E-02 ppm1      1.985 ppm2      8.037 CV     1
 OR {  450}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  452}
   (( segid "    " and resid 148  and name HG2 ))
   (( segid "    " and resid 148  and name HN  ))
      2.600     0.900     0.900 peak   452 spectrum    1 weight  0.10000E+01 volume  0.43632E-02 ppm1      1.918 ppm2      8.023 CV     1
 OR {  452}
   (( segid "    " and resid 48   and name HG1 ))
   (( segid "    " and resid 48   and name HN  ))
 OR {  452}
   (( segid "    " and resid 155  and name HG1 ))
   (( segid "    " and resid 155  and name HN  ))
 OR {  452}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  452}
   (( segid "    " and resid 155  and name HG2 ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  456}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 148  and name HN  ))
      3.100     1.200     1.200 peak   456 spectrum    1 weight  0.10000E+01 volume  0.26632E-02 ppm1      1.292 ppm2      8.033 CV     1
 OR {  456}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  457}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HN  ))
      2.000     0.500     0.500 peak   457 spectrum    1 weight  0.10000E+01 volume  0.12582E-01 ppm1      4.147 ppm2      8.012 CV     1
 OR {  457}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
 OR {  457}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 155  and name HN  ))
 OR {  457}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
 ASSI {  461}
   (( segid "    " and resid 155  and name HD2 ))
   (( segid "    " and resid 155  and name HN  ))
      5.300     3.500     0.700 peak   461 spectrum    1 weight  0.10000E+01 volume  0.15907E-03 ppm1      3.272 ppm2      8.006 CV     1
 OR {  461}
   (( segid "    " and resid 55   and name HD2 ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  461}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HN  ))
 OR {  461}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HN  ))
 ASSI {  464}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      2.000     0.500     0.500 peak   464 spectrum    1 weight  0.10000E+01 volume  0.10230E-01 ppm1      2.119 ppm2      7.991 CV     1
 OR {  464}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  467}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HN  ))
      2.900     1.100     1.100 peak   467 spectrum    1 weight  0.10000E+01 volume  0.18569E-02 ppm1      1.664 ppm2      8.011 CV     1
 OR {  467}
   (( segid "    " and resid 148  and name HG1 ))
   (( segid "    " and resid 148  and name HN  ))
 ASSI {  469}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      4.900     3.000     1.100 peak   469 spectrum    1 weight  0.10000E+01 volume  0.19923E-04 ppm1      0.840 ppm2      8.002 CV     1
 OR {  469}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 158  and name HN  ))
 OR {  469}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  470}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 176  and name HN  ))
      3.700     1.700     1.700 peak   470 spectrum    1 weight  0.10000E+01 volume  0.49349E-03 ppm1      3.873 ppm2      7.971 CV     1
 OR {  470}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
 ASSI {  473}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      2.800     1.000     1.000 peak   473 spectrum    1 weight  0.10000E+01 volume  0.22590E-02 ppm1      4.432 ppm2      7.912 CV     1
 OR {  473}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 157  and name HN  ))
 ASSI {  474}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 165  and name HN  ))
      3.000     1.200     1.200 peak   474 spectrum    1 weight  0.10000E+01 volume  0.15944E-02 ppm1      4.425 ppm2      7.914 CV     1
 OR {  474}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  475}
   (( segid "    " and resid 157  and name HA2 ))
   (( segid "    " and resid 157  and name HN  ))
      1.900     0.500     0.500 peak   475 spectrum    1 weight  0.10000E+01 volume  0.12710E-01 ppm1      4.022 ppm2      7.911 CV     1
 OR {  475}
   (( segid "    " and resid 57   and name HA2 ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  477}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      3.000     1.200     1.200 peak   477 spectrum    1 weight  0.10000E+01 volume  0.15493E-02 ppm1      3.979 ppm2      7.919 CV     1
 OR {  477}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 154  and name HN  ))
 OR {  477}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  478}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HN  ))
      2.300     0.700     0.700 peak   478 spectrum    1 weight  0.10000E+01 volume  0.39918E-02 ppm1      3.970 ppm2      7.929 CV     1
 OR {  478}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  479}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 165  and name HN  ))
      2.300     0.700     0.700 peak   479 spectrum    1 weight  0.10000E+01 volume  0.57649E-02 ppm1      3.916 ppm2      7.908 CV     1
 OR {  479}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  483}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 145  and name HN  ))
      3.400     1.400     1.400 peak   483 spectrum    1 weight  0.10000E+01 volume  0.83018E-03 ppm1      2.843 ppm2      7.919 CV     1
 OR {  483}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  485}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      3.000     1.100     1.100 peak   485 spectrum    1 weight  0.10000E+01 volume  0.11006E-02 ppm1      2.737 ppm2      7.911 CV     1
 OR {  485}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 145  and name HN  ))
 ASSI {  495}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 154  and name HN  ))
      1.800     0.400     0.400 peak   495 spectrum    1 weight  0.10000E+01 volume  0.25219E-01 ppm1      1.541 ppm2      7.917 CV     1
 OR {  495}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 54   and name HN  ))
 ASSI {  496}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HN  ))
      3.500     1.500     1.500 peak   496 spectrum    1 weight  0.10000E+01 volume  0.13666E-02 ppm1      1.139 ppm2      7.917 CV     1
 OR {  496}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 165  and name HN  ))
 ASSI {  497}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 165  and name HN  ))
      3.700     1.700     1.700 peak   497 spectrum    1 weight  0.10000E+01 volume  0.10524E-02 ppm1      0.960 ppm2      7.916 CV     1
 OR {  497}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 65   and name HN  ))
 ASSI {  498}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 65   and name HN  ))
      4.600     2.700     1.400 peak   498 spectrum    1 weight  0.10000E+01 volume  0.21740E-03 ppm1      0.839 ppm2      7.907 CV     1
 OR {  498}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 165  and name HN  ))
 ASSI {  501}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 154  and name HN  ))
      2.100     0.500     0.500 peak   501 spectrum    1 weight  0.10000E+01 volume  0.14262E-01 ppm1      4.229 ppm2      7.868 CV     1
 OR {  501}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
 OR {  501}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 157  and name HN  ))
 OR {  501}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  502}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 151  and name HN  ))
      3.200     1.300     1.300 peak   502 spectrum    1 weight  0.10000E+01 volume  0.12517E-02 ppm1      3.437 ppm2      7.808 CV     1
 OR {  502}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  503}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 151  and name HN  ))
      2.300     0.600     0.600 peak   503 spectrum    1 weight  0.10000E+01 volume  0.36711E-02 ppm1      1.662 ppm2      7.811 CV     1
 OR {  503}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  505}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 151  and name HN  ))
      3.200     1.300     1.300 peak   505 spectrum    1 weight  0.10000E+01 volume  0.21911E-02 ppm1      1.399 ppm2      7.810 CV     1
 OR {  505}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  506}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 51   and name HN  ))
      3.900     1.900     1.900 peak   506 spectrum    1 weight  0.10000E+01 volume  0.37331E-03 ppm1      1.298 ppm2      7.811 CV     1
 OR {  506}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 151  and name HN  ))
 ASSI {  510}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 166  and name HN  ))
      2.200     0.600     0.600 peak   510 spectrum    1 weight  0.10000E+01 volume  0.94214E-02 ppm1      4.164 ppm2      7.804 CV     1
 OR {  510}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
 OR {  510}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  513}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 66   and name HN  ))
      3.000     1.100     1.100 peak   513 spectrum    1 weight  0.10000E+01 volume  0.38347E-02 ppm1      2.570 ppm2      7.793 CV     1
 OR {  513}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 166  and name HN  ))
 ASSI {  514}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 166  and name HN  ))
      3.100     1.200     1.200 peak   514 spectrum    1 weight  0.10000E+01 volume  0.31661E-02 ppm1      2.430 ppm2      7.803 CV     1
 OR {  514}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HN  ))
 ASSI {  516}
   (( segid "    " and resid 166  and name HB2 ))
   (( segid "    " and resid 166  and name HN  ))
      1.900     0.500     0.500 peak   516 spectrum    1 weight  0.10000E+01 volume  0.12615E-01 ppm1      2.250 ppm2      7.796 CV     1
 OR {  516}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
 OR {  516}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
 OR {  516}
   (( segid "    " and resid 166  and name HB1 ))
   (( segid "    " and resid 166  and name HN  ))
 ASSI {  517}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 66   and name HN  ))
      2.800     2.800     3.200 peak   517 spectrum    1 weight  0.10000E+01 volume  0.31858E-02 ppm1      1.079 ppm2      7.784 CV     1
 OR {  517}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 166  and name HN  ))
 OR {  517}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 70   and name HD21))
 ASSI {  518}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 166  and name HN  ))
      3.800     1.800     1.800 peak   518 spectrum    1 weight  0.10000E+01 volume  0.52179E-03 ppm1      0.564 ppm2      7.791 CV     1
 OR {  518}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 66   and name HN  ))
 OR {  518}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 166  and name HN  ))
 ASSI {  520}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name HN  ))
      5.500     3.700     0.500 peak   520 spectrum    1 weight  0.10000E+01 volume  0.11151E-03 ppm1     -0.192 ppm2      7.789 CV     1
 OR {  520}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 166  and name HN  ))
 ASSI {  521}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 170  and name HN  ))
      2.300     0.700     0.700 peak   521 spectrum    1 weight  0.10000E+01 volume  0.56909E-02 ppm1      4.495 ppm2      7.726 CV     1
 OR {  521}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  522}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      2.900     1.000     1.000 peak   522 spectrum    1 weight  0.10000E+01 volume  0.17786E-02 ppm1      4.175 ppm2      7.746 CV     1
 OR {  522}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 170  and name HN  ))
 OR {  522}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 166  and name HN  ))
 OR {  522}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
 ASSI {  523}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      1.900     0.500     0.500 peak   523 spectrum    1 weight  0.10000E+01 volume  0.13325E-01 ppm1      3.978 ppm2      7.726 CV     1
 OR {  523}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
 ASSI {  525}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 140  and name HN  ))
      2.900     2.900     3.100 peak   525 spectrum    1 weight  0.10000E+01 volume  0.53198E-02 ppm1      2.981 ppm2      7.731 CV     1
 OR {  525}
   (( segid "    " and resid 165  and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
 OR {  525}
   (( segid "    " and resid 165  and name HB1 ))
   (( segid "    " and resid 170  and name HN  ))
 ASSI {  527}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 170  and name HN  ))
      2.200     0.600     0.600 peak   527 spectrum    1 weight  0.10000E+01 volume  0.76796E-02 ppm1      2.668 ppm2      7.724 CV     1
 OR {  527}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI {  532}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
      5.500     3.800     0.500 peak   532 spectrum    1 weight  0.10000E+01 volume  0.79700E-04 ppm1      0.721 ppm2      7.737 CV     1
 OR {  532}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 140  and name HN  ))
 ASSI {  533}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 140  and name HN  ))
      3.300     1.300     1.300 peak   533 spectrum    1 weight  0.10000E+01 volume  0.47760E-02 ppm1      0.474 ppm2      7.726 CV     1
 OR {  533}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
 ASSI {  534}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      2.800     1.000     1.000 peak   534 spectrum    1 weight  0.10000E+01 volume  0.22947E-02 ppm1      4.386 ppm2      7.716 CV     1
 OR {  534}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 170  and name HN  ))
 ASSI {  535}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      3.100     1.200     1.200 peak   535 spectrum    1 weight  0.10000E+01 volume  0.14136E-02 ppm1      3.845 ppm2      7.688 CV     1
 OR {  535}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 162  and name HN  ))
 OR {  535}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
 ASSI {  536}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 146  and name HE1 ))
      3.500     1.500     1.500 peak   536 spectrum    1 weight  0.10000E+01 volume  0.79004E-03 ppm1      2.787 ppm2      7.705 CV     1
 OR {  536}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 146  and name HE1 ))
 OR {  536}
   (( segid "    " and resid 135  and name HE2 ))
   (( segid "    " and resid 46   and name HE1 ))
 OR {  536}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 46   and name HE1 ))
 ASSI {  538}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 46   and name HE1 ))
      2.800     1.000     1.000 peak   538 spectrum    1 weight  0.10000E+01 volume  0.21580E-02 ppm1      1.535 ppm2      7.715 CV     1
 OR {  538}
   (( segid "    " and resid 150  and name HD1 ))
   (( segid "    " and resid 146  and name HE1 ))
 OR {  538}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 46   and name HE1 ))
 OR {  538}
   (( segid "    " and resid 150  and name HD2 ))
   (( segid "    " and resid 146  and name HE1 ))
 ASSI {  539}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 140  and name HN  ))
      2.700     0.900     0.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.65548E-02 ppm1      1.268 ppm2      7.697 CV     1
 OR {  539}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
 OR {  539}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 162  and name HN  ))
 ASSI {  540}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 140  and name HN  ))
      5.900     4.300     0.100 peak   540 spectrum    1 weight  0.10000E+01 volume  0.90030E-04 ppm1      0.824 ppm2      7.720 CV     1
 OR {  540}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 40   and name HN  ))
 OR {  540}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 146  and name HE1 ))
 ASSI {  545}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HD22))
      3.800     1.800     1.800 peak   545 spectrum    1 weight  0.10000E+01 volume  0.11256E-02 ppm1      2.864 ppm2      7.652 CV     1
 OR {  545}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HD22))
 ASSI {  550}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HN  ))
      2.400     0.700     0.700 peak   550 spectrum    1 weight  0.10000E+01 volume  0.46166E-02 ppm1      4.433 ppm2      7.541 CV     1
 OR {  550}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI {  554}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.500     0.800     0.800 peak   554 spectrum    1 weight  0.10000E+01 volume  0.26959E-02 ppm1      2.264 ppm2      7.543 CV     1
 OR {  554}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 156  and name HN  ))
 ASSI {  555}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.600     0.800     0.800 peak   555 spectrum    1 weight  0.10000E+01 volume  0.35416E-02 ppm1      2.124 ppm2      7.531 CV     1
 OR {  555}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 156  and name HN  ))
 ASSI {  556}
   (( segid "    " and resid 155  and name HB2 ))
   (( segid "    " and resid 156  and name HN  ))
      2.500     0.800     0.800 peak   556 spectrum    1 weight  0.10000E+01 volume  0.37760E-02 ppm1      1.967 ppm2      7.516 CV     1
 OR {  556}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI {  558}
   (( segid "    " and resid 155  and name HG1 ))
   (( segid "    " and resid 156  and name HN  ))
      6.000     5.400     0.000 peak   558 spectrum    1 weight  0.10000E+01 volume  0.19411E-04 ppm1      1.933 ppm2      7.531 CV     1
 OR {  558}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI {  560}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 156  and name HN  ))
      4.600     2.600     1.400 peak   560 spectrum    1 weight  0.10000E+01 volume  0.23067E-03 ppm1      1.821 ppm2      7.518 CV     1
 OR {  560}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 56   and name HN  ))
 OR {  560}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  565}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      3.700     1.700     1.700 peak   565 spectrum    1 weight  0.10000E+01 volume  0.80032E-03 ppm1      4.308 ppm2      7.505 CV     1
 OR {  565}
   (( segid "    " and resid 152  and name HA  ))
   (( segid "    " and resid 156  and name HN  ))
 ASSI {  566}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      2.800     1.000     1.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.28133E-02 ppm1      4.256 ppm2      7.496 CV     1
 OR {  566}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  567}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 173  and name HN  ))
      2.200     0.600     0.600 peak   567 spectrum    1 weight  0.10000E+01 volume  0.78681E-02 ppm1      4.048 ppm2      7.474 CV     1
 OR {  567}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  568}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      4.600     2.700     1.400 peak   568 spectrum    1 weight  0.10000E+01 volume  0.31861E-03 ppm1      3.883 ppm2      7.497 CV     1
 OR {  568}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  569}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 173  and name HN  ))
      2.600     0.900     0.900 peak   569 spectrum    1 weight  0.10000E+01 volume  0.30566E-02 ppm1      3.871 ppm2      7.488 CV     1
 OR {  569}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
 OR {  569}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  575}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
      4.600     2.600     1.400 peak   575 spectrum    1 weight  0.10000E+01 volume  0.25678E-03 ppm1      2.025 ppm2      7.490 CV     1
 OR {  575}
   (( segid "    " and resid 176  and name HB2 ))
   (( segid "    " and resid 175  and name HN  ))
 OR {  575}
   (( segid "    " and resid 176  and name HB2 ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  575}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 OR {  575}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 75   and name HN  ))
 OR {  575}
   (( segid "    " and resid 176  and name HB1 ))
   (( segid "    " and resid 175  and name HN  ))
 OR {  575}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 148  and name HE  ))
 OR {  575}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 148  and name HE  ))
 ASSI {  576}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 48   and name HE  ))
      2.300     2.300     3.700 peak   576 spectrum    1 weight  0.10000E+01 volume  0.16404E-01 ppm1      1.998 ppm2      7.470 CV     1
 OR {  576}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 148  and name HE  ))
 OR {  576}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  576}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 48   and name HE  ))
 OR {  576}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 148  and name HE  ))
 ASSI {  577}
   (( segid "    " and resid 174  and name HB2 ))
   (( segid "    " and resid 175  and name HN  ))
      2.800     1.000     1.000 peak   577 spectrum    1 weight  0.10000E+01 volume  0.24021E-02 ppm1      1.786 ppm2      7.484 CV     1
 OR {  577}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HN  ))
 OR {  577}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  580}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 173  and name HN  ))
      2.100     0.500     0.500 peak   580 spectrum    1 weight  0.10000E+01 volume  0.67582E-02 ppm1      1.663 ppm2      7.491 CV     1
 OR {  580}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  581}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 173  and name HN  ))
      3.500     1.500     1.500 peak   581 spectrum    1 weight  0.10000E+01 volume  0.11698E-02 ppm1      1.573 ppm2      7.472 CV     1
 OR {  581}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  583}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 48   and name HE  ))
      3.200     1.300     1.300 peak   583 spectrum    1 weight  0.10000E+01 volume  0.15698E-02 ppm1      1.055 ppm2      7.491 CV     1
 OR {  583}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 148  and name HE  ))
 OR {  583}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 173  and name HN  ))
 ASSI {  584}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 48   and name HE  ))
      4.000     2.000     2.000 peak   584 spectrum    1 weight  0.10000E+01 volume  0.93785E-03 ppm1      0.877 ppm2      7.472 CV     1
 OR {  584}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 173  and name HN  ))
 OR {  584}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 73   and name HN  ))
 OR {  584}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 148  and name HE  ))
 ASSI {  586}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      3.200     1.200     1.200 peak   586 spectrum    1 weight  0.10000E+01 volume  0.12716E-02 ppm1      4.499 ppm2      7.461 CV     1
 OR {  586}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  586}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  587}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HD21))
      4.000     2.000     2.000 peak   587 spectrum    1 weight  0.10000E+01 volume  0.49851E-03 ppm1      4.435 ppm2      7.439 CV     1
 OR {  587}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 165  and name HD22))
 ASSI {  589}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      4.900     3.000     1.100 peak   589 spectrum    1 weight  0.10000E+01 volume  0.83969E-04 ppm1      4.383 ppm2      7.467 CV     1
 OR {  589}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 173  and name HN  ))
 ASSI {  590}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HD21))
      4.200     2.200     1.800 peak   590 spectrum    1 weight  0.10000E+01 volume  0.34797E-03 ppm1      3.916 ppm2      7.433 CV     1
 OR {  590}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 165  and name HD22))
 ASSI {  591}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 65   and name HD21))
      6.000     6.000     0.000 peak   591 spectrum    1 weight  0.10000E+01 volume  0.19432E-04 ppm1      3.843 ppm2      7.435 CV     1
 OR {  591}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 165  and name HD22))
 OR {  591}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 140  and name HD22))
 OR {  591}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 40   and name HD22))
 ASSI {  594}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HD21))
      2.700     0.900     0.900 peak   594 spectrum    1 weight  0.10000E+01 volume  0.16070E-02 ppm1      2.668 ppm2      7.445 CV     1
 OR {  594}
   (( segid "    " and resid 165  and name HB2 ))
   (( segid "    " and resid 165  and name HD22))
 ASSI {  596}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 166  and name HE21))
      3.100     1.200     1.200 peak   596 spectrum    1 weight  0.10000E+01 volume  0.18146E-02 ppm1      2.433 ppm2      7.448 CV     1
 OR {  596}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HE22))
 ASSI {  597}
   (( segid "    " and resid 172  and name HB1 ))
   (( segid "    " and resid 173  and name HN  ))
      2.700     0.900     0.900 peak   597 spectrum    1 weight  0.10000E+01 volume  0.15958E-02 ppm1      2.092 ppm2      7.460 CV     1
 OR {  597}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  598}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HN  ))
      3.900     1.900     1.900 peak   598 spectrum    1 weight  0.10000E+01 volume  0.12376E-02 ppm1      1.746 ppm2      7.465 CV     1
 OR {  598}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  598}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 73   and name HN  ))
 OR {  598}
   (( segid "    " and resid 173  and name HD2 ))
   (( segid "    " and resid 173  and name HN  ))
 ASSI {  600}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 65   and name HD21))
      2.500     2.500     3.500 peak   600 spectrum    1 weight  0.10000E+01 volume  0.57702E-02 ppm1      1.267 ppm2      7.430 CV     1
 OR {  600}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 140  and name HD22))
 OR {  600}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 40   and name HD22))
 ASSI {  603}
   (( segid "    " and resid 140  and name HB2 ))
   (( segid "    " and resid 140  and name HD22))
      3.200     1.300     1.300 peak   603 spectrum    1 weight  0.10000E+01 volume  0.30495E-02 ppm1      2.590 ppm2      7.408 CV     1
 OR {  603}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HD22))
 ASSI {  611}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 140  and name HD22))
      3.000     3.000     3.000 peak   611 spectrum    1 weight  0.10000E+01 volume  0.40567E-02 ppm1      0.472 ppm2      7.387 CV     1
 OR {  611}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 40   and name HD22))
 ASSI {  616}
   (( segid "    " and resid 141  and name HB2 ))
   (  segid "    " and resid 141  and name HD% )
      2.600     0.800     0.800 peak   616 spectrum    1 weight  0.10000E+01 volume  0.21265E-02 ppm1      2.810 ppm2      7.329 CV     1
 OR {  616}
   (( segid "    " and resid 41   and name HB1 ))
   (  segid "    " and resid 41   and name HD% )
 ASSI {  619}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 41   and name HD% )
      2.800     2.800     3.200 peak   619 spectrum    1 weight  0.10000E+01 volume  0.37827E-02 ppm1      2.214 ppm2      7.323 CV     1
 OR {  619}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  622}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 41   and name HD% )
      2.900     1.000     1.000 peak   622 spectrum    1 weight  0.10000E+01 volume  0.16264E-02 ppm1      1.817 ppm2      7.315 CV     1
 OR {  622}
   (( segid "    " and resid 145  and name HD1 ))
   (  segid "    " and resid 141  and name HD% )
 OR {  622}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 41   and name HD% )
 OR {  622}
   (( segid "    " and resid 145  and name HD2 ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  623}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 41   and name HD% )
      3.600     1.600     1.600 peak   623 spectrum    1 weight  0.10000E+01 volume  0.72530E-03 ppm1      1.806 ppm2      7.327 CV     1
 OR {  623}
   (( segid "    " and resid 139  and name HB  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  626}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 141  and name HD% )
      3.700     1.700     1.700 peak   626 spectrum    1 weight  0.10000E+01 volume  0.76183E-03 ppm1      0.951 ppm2      7.332 CV     1
 OR {  626}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 41   and name HD% )
 ASSI {  628}
   (  segid "    " and resid 137  and name HG1%)
   (  segid "    " and resid 41   and name HD% )
      3.500     3.500     2.500 peak   628 spectrum    1 weight  0.10000E+01 volume  0.26426E-02 ppm1      0.828 ppm2      7.322 CV     1
 OR {  628}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 141  and name HD% )
 ASSI {  631}
   (( segid "    " and resid 115  and name HA  ))
   (  segid "    " and resid 115  and name HE% )
      4.500     2.600     1.500 peak   631 spectrum    1 weight  0.10000E+01 volume  0.68123E-03 ppm1      4.644 ppm2      7.295 CV     1
 OR {  631}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HE% )
 ASSI {  633}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 138  and name HD22))
      3.000     3.000     3.000 peak   633 spectrum    1 weight  0.10000E+01 volume  0.33182E-03 ppm1      3.182 ppm2      7.280 CV     1
 OR {  633}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 38   and name HD21))
 OR {  633}
   (( segid "    " and resid 19   and name HD1 ))
   (  segid "    " and resid 15   and name HE% )
 OR {  633}
   (( segid "    " and resid 119  and name HD1 ))
   (  segid "    " and resid 115  and name HE% )
 ASSI {  634}
   (( segid "    " and resid 15   and name HB1 ))
   (  segid "    " and resid 15   and name HE% )
      3.700     1.700     1.700 peak   634 spectrum    1 weight  0.10000E+01 volume  0.20042E-02 ppm1      3.185 ppm2      7.279 CV     1
 OR {  634}
   (( segid "    " and resid 115  and name HB1 ))
   (  segid "    " and resid 115  and name HE% )
 ASSI {  635}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 15   and name HE% )
      3.600     1.600     1.600 peak   635 spectrum    1 weight  0.10000E+01 volume  0.23018E-02 ppm1      3.035 ppm2      7.279 CV     1
 OR {  635}
   (( segid "    " and resid 115  and name HB2 ))
   (  segid "    " and resid 115  and name HE% )
 ASSI {  639}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 141  and name HD% )
      3.100     1.200     1.200 peak   639 spectrum    1 weight  0.10000E+01 volume  0.12853E-02 ppm1      0.052 ppm2      7.291 CV     1
 OR {  639}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 41   and name HD% )
 OR {  639}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 171  and name HE3 ))
 ASSI {  641}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 171  and name HZ3 ))
      3.600     1.600     1.600 peak   641 spectrum    1 weight  0.10000E+01 volume  0.97018E-03 ppm1      1.082 ppm2      7.133 CV     1
 OR {  641}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 70   and name HD22))
 OR {  641}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 174  and name HN  ))
 ASSI {  644}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HD22))
      5.400     3.600     0.600 peak   644 spectrum    1 weight  0.10000E+01 volume  0.98289E-04 ppm1      4.501 ppm2      7.107 CV     1
 OR {  644}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 170  and name HD22))
 OR {  644}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  645}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      2.300     0.700     0.700 peak   645 spectrum    1 weight  0.10000E+01 volume  0.63710E-02 ppm1      4.258 ppm2      7.099 CV     1
 OR {  645}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HN  ))
 ASSI {  646}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 174  and name HN  ))
      3.000     1.100     1.100 peak   646 spectrum    1 weight  0.10000E+01 volume  0.15962E-02 ppm1      4.191 ppm2      7.102 CV     1
 OR {  646}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  647}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 174  and name HN  ))
      2.800     1.000     1.000 peak   647 spectrum    1 weight  0.10000E+01 volume  0.25681E-02 ppm1      4.045 ppm2      7.096 CV     1
 OR {  647}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  648}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HD22))
      3.700     1.700     1.700 peak   648 spectrum    1 weight  0.10000E+01 volume  0.11125E-02 ppm1      3.085 ppm2      7.110 CV     1
 OR {  648}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HD22))
 ASSI {  652}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 171  and name HZ3 ))
      2.700     2.700     3.300 peak   652 spectrum    1 weight  0.10000E+01 volume  0.69711E-02 ppm1      1.997 ppm2      7.102 CV     1
 OR {  652}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 71   and name HZ3 ))
 OR {  652}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 171  and name HZ3 ))
 OR {  652}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 71   and name HZ3 ))
 ASSI {  653}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 71   and name HZ3 ))
      2.500     2.500     3.500 peak   653 spectrum    1 weight  0.10000E+01 volume  0.63924E-02 ppm1      1.942 ppm2      7.100 CV     1
 OR {  653}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 171  and name HZ3 ))
 OR {  653}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 171  and name HZ3 ))
 OR {  653}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 170  and name HD22))
 OR {  653}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 70   and name HD22))
 ASSI {  656}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 171  and name HZ3 ))
      5.500     3.800     0.500 peak   656 spectrum    1 weight  0.10000E+01 volume  0.74932E-04 ppm1      1.571 ppm2      7.123 CV     1
 OR {  656}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 71   and name HZ3 ))
 OR {  656}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 174  and name HN  ))
 ASSI {  657}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 74   and name HN  ))
      3.100     3.100     2.900 peak   657 spectrum    1 weight  0.10000E+01 volume  0.28481E-03 ppm1      1.503 ppm2      7.098 CV     1
 OR {  657}
   (( segid "    " and resid 173  and name HG2 ))
   (( segid "    " and resid 174  and name HN  ))
 ASSI {  660}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 174  and name HN  ))
      5.300     3.500     0.700 peak   660 spectrum    1 weight  0.10000E+01 volume  0.11772E-03 ppm1      1.670 ppm2      7.087 CV     1
 OR {  660}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  667}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 49   and name HD% )
      2.900     1.000     1.000 peak   667 spectrum    1 weight  0.10000E+01 volume  0.17223E-02 ppm1      3.109 ppm2      6.976 CV     1
 OR {  667}
   (( segid "    " and resid 149  and name HB2 ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  668}
   (( segid "    " and resid 65   and name HB2 ))
   (  segid "    " and resid 141  and name HE% )
      3.700     1.700     1.700 peak   668 spectrum    1 weight  0.10000E+01 volume  0.70754E-03 ppm1      2.666 ppm2      6.966 CV     1
 OR {  668}
   (( segid "    " and resid 165  and name HB2 ))
   (  segid "    " and resid 41   and name HE% )
 OR {  668}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 66   and name HE21))
 OR {  668}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 66   and name HE21))
 ASSI {  669}
   (( segid "    " and resid 72   and name HG  ))
   (  segid "    " and resid 149  and name HD% )
      5.500     3.700     0.500 peak   669 spectrum    1 weight  0.10000E+01 volume  0.39768E-04 ppm1      2.003 ppm2      6.981 CV     1
 OR {  669}
   (( segid "    " and resid 172  and name HG  ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  671}
   (  segid "    " and resid 72   and name HD1%)
   (  segid "    " and resid 149  and name HD% )
      2.300     2.300     3.700 peak   671 spectrum    1 weight  0.10000E+01 volume  0.29080E-02 ppm1      0.879 ppm2      6.967 CV     1
 OR {  671}
   (  segid "    " and resid 172  and name HD1%)
   (  segid "    " and resid 49   and name HD% )
 ASSI {  672}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 141  and name HE% )
      2.600     0.800     0.800 peak   672 spectrum    1 weight  0.10000E+01 volume  0.31849E-02 ppm1      3.911 ppm2      6.950 CV     1
 OR {  672}
   (( segid "    " and resid 165  and name HA  ))
   (  segid "    " and resid 41   and name HE% )
 ASSI {  674}
   (( segid "    " and resid 46   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
      3.900     1.900     1.900 peak   674 spectrum    1 weight  0.10000E+01 volume  0.85907E-03 ppm1      3.861 ppm2      6.962 CV     1
 OR {  674}
   (( segid "    " and resid 146  and name HA  ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  675}
   (( segid "    " and resid 161  and name HA  ))
   (  segid "    " and resid 141  and name HE% )
      4.000     2.000     2.000 peak   675 spectrum    1 weight  0.10000E+01 volume  0.77994E-03 ppm1      3.844 ppm2      6.963 CV     1
 OR {  675}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  675}
   (( segid "    " and resid 161  and name HA  ))
   (  segid "    " and resid 149  and name HD% )
 OR {  675}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  676}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 49   and name HD% )
      2.400     0.700     0.700 peak   676 spectrum    1 weight  0.10000E+01 volume  0.27810E-02 ppm1      3.241 ppm2      6.959 CV     1
 OR {  676}
   (( segid "    " and resid 149  and name HB1 ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  684}
   (( segid "    " and resid 64   and name HB  ))
   (  segid "    " and resid 141  and name HE% )
      6.000     4.700     0.000 peak   684 spectrum    1 weight  0.10000E+01 volume  0.38913E-04 ppm1      2.109 ppm2      6.954 CV     1
 OR {  684}
   (( segid "    " and resid 164  and name HB  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  684}
   (( segid "    " and resid 64   and name HB  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  684}
   (( segid "    " and resid 164  and name HB  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {  686}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 41   and name HE% )
      3.300     1.400     1.400 peak   686 spectrum    1 weight  0.10000E+01 volume  0.88297E-03 ppm1      1.820 ppm2      6.942 CV     1
 OR {  686}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 41   and name HE% )
 OR {  686}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 49   and name HD% )
 OR {  686}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  687}
   (( segid "    " and resid 39   and name HB  ))
   (  segid "    " and resid 41   and name HE% )
      2.700     0.900     0.900 peak   687 spectrum    1 weight  0.10000E+01 volume  0.34944E-02 ppm1      1.807 ppm2      6.945 CV     1
 OR {  687}
   (( segid "    " and resid 139  and name HB  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {  689}
   (  segid "    " and resid 164  and name HG1%)
   (  segid "    " and resid 41   and name HE% )
      2.400     2.400     3.600 peak   689 spectrum    1 weight  0.10000E+01 volume  0.48750E-02 ppm1      1.141 ppm2      6.927 CV     1
 OR {  689}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 41   and name HE% )
 OR {  689}
   (  segid "    " and resid 164  and name HG1%)
   (  segid "    " and resid 141  and name HE% )
 ASSI {  690}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 49   and name HD% )
      3.300     1.400     1.400 peak   690 spectrum    1 weight  0.10000E+01 volume  0.11407E-02 ppm1      0.838 ppm2      6.941 CV     1
 OR {  690}
   (  segid "    " and resid 163  and name HG1%)
   (  segid "    " and resid 149  and name HD% )
 ASSI {  691}
   (  segid "    " and resid 137  and name HG1%)
   (  segid "    " and resid 41   and name HE% )
      2.500     2.500     3.500 peak   691 spectrum    1 weight  0.10000E+01 volume  0.41806E-02 ppm1      0.828 ppm2      6.947 CV     1
 OR {  691}
   (  segid "    " and resid 37   and name HG1%)
   (  segid "    " and resid 141  and name HE% )
 ASSI {  693}
   (  segid "    " and resid 137  and name HG2%)
   (  segid "    " and resid 41   and name HE% )
      2.600     2.600     3.400 peak   693 spectrum    1 weight  0.10000E+01 volume  0.26397E-02 ppm1      0.655 ppm2      6.946 CV     1
 OR {  693}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 141  and name HE% )
 ASSI {  694}
   (  segid "    " and resid 160  and name HG2%)
   (  segid "    " and resid 149  and name HD% )
      4.000     2.000     2.000 peak   694 spectrum    1 weight  0.10000E+01 volume  0.21588E-02 ppm1      0.629 ppm2      6.947 CV     1
 OR {  694}
   (  segid "    " and resid 60   and name HG2%)
   (  segid "    " and resid 49   and name HD% )
 ASSI {  695}
   (  segid "    " and resid 160  and name HD1%)
   (  segid "    " and resid 149  and name HD% )
      2.400     2.400     3.600 peak   695 spectrum    1 weight  0.10000E+01 volume  0.33699E-02 ppm1      0.516 ppm2      6.958 CV     1
 OR {  695}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 49   and name HD% )
 ASSI {  697}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 141  and name HE% )
      2.400     0.700     0.700 peak   697 spectrum    1 weight  0.10000E+01 volume  0.60624E-02 ppm1      0.053 ppm2      6.945 CV     1
 OR {  697}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 41   and name HE% )
 ASSI {  700}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 141  and name HE% )
      2.200     2.200     3.800 peak   700 spectrum    1 weight  0.10000E+01 volume  0.82140E-02 ppm1      0.614 ppm2      6.920 CV     1
 OR {  700}
   (  segid "    " and resid 168  and name HG2%)
   (  segid "    " and resid 41   and name HE% )
 OR {  700}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 141  and name HZ  ))
 ASSI {  701}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 71   and name HH2 ))
      2.500     0.800     0.800 peak   701 spectrum    1 weight  0.10000E+01 volume  0.32495E-02 ppm1      3.975 ppm2      6.798 CV     1
 OR {  701}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 171  and name HH2 ))
 ASSI {  702}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 71   and name HH2 ))
      6.000     5.200     0.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.20415E-04 ppm1      1.932 ppm2      6.805 CV     1
 OR {  702}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 171  and name HH2 ))
 ASSI {  706}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 71   and name HH2 ))
      3.300     3.300     2.700 peak   706 spectrum    1 weight  0.10000E+01 volume  0.11031E-02 ppm1      1.185 ppm2      6.790 CV     1
 OR {  706}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 171  and name HH2 ))
 ASSI {  709}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HD21))
      5.100     3.200     0.900 peak   709 spectrum    1 weight  0.10000E+01 volume  0.21243E-03 ppm1      4.562 ppm2      6.740 CV     1
 OR {  709}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  710}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 75   and name HD21))
      3.200     1.300     1.300 peak   710 spectrum    1 weight  0.10000E+01 volume  0.13685E-02 ppm1      4.190 ppm2      6.732 CV     1
 OR {  710}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  712}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 75   and name HD21))
      3.400     3.400     2.600 peak   712 spectrum    1 weight  0.10000E+01 volume  0.15256E-02 ppm1      1.943 ppm2      6.736 CV     1
 OR {  712}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  715}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HD21))
      3.600     3.600     2.400 peak   715 spectrum    1 weight  0.10000E+01 volume  0.17980E-02 ppm1      1.790 ppm2      6.734 CV     1
 OR {  715}
   (( segid "    " and resid 174  and name HB2 ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  716}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HD21))
      3.400     1.400     1.400 peak   716 spectrum    1 weight  0.10000E+01 volume  0.20254E-02 ppm1      1.693 ppm2      6.740 CV     1
 OR {  716}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  717}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HD21))
      2.400     0.700     0.700 peak   717 spectrum    1 weight  0.10000E+01 volume  0.15146E-02 ppm1      0.783 ppm2      6.742 CV     1
 OR {  717}
   (( segid "    " and resid 175  and name HB1 ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {  722}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 140  and name HD21))
      3.500     1.500     1.500 peak   722 spectrum    1 weight  0.10000E+01 volume  0.72269E-03 ppm1      1.267 ppm2      6.707 CV     1
 OR {  722}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 40   and name HD21))
 ASSI {  736}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 149  and name HE% )
      2.400     2.400     3.600 peak   736 spectrum    1 weight  0.10000E+01 volume  0.55935E-02 ppm1      0.614 ppm2      6.531 CV     1
 OR {  736}
   (  segid "    " and resid 168  and name HG2%)
   (  segid "    " and resid 49   and name HE% )
 ASSI {  748}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 75   and name HD22))
      3.900     1.900     1.900 peak   748 spectrum    1 weight  0.10000E+01 volume  0.16815E-02 ppm1      4.197 ppm2      6.058 CV     1
 OR {  748}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 175  and name HD22))
 ASSI {  750}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 75   and name HD22))
      3.500     3.500     2.500 peak   750 spectrum    1 weight  0.10000E+01 volume  0.88867E-03 ppm1      1.939 ppm2      6.054 CV     1
 OR {  750}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 175  and name HD22))
 ASSI {  751}
   (( segid "    " and resid 74   and name HB2 ))
   (( segid "    " and resid 75   and name HD22))
      4.200     2.200     1.800 peak   751 spectrum    1 weight  0.10000E+01 volume  0.14232E-02 ppm1      1.789 ppm2      6.049 CV     1
 OR {  751}
   (( segid "    " and resid 174  and name HB2 ))
   (( segid "    " and resid 175  and name HD22))
 ASSI {  752}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 175  and name HD22))
      3.500     1.500     1.500 peak   752 spectrum    1 weight  0.10000E+01 volume  0.25891E-02 ppm1      1.698 ppm2      6.053 CV     1
 OR {  752}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HD22))
 ASSI {  753}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HD22))
      3.400     1.400     1.400 peak   753 spectrum    1 weight  0.10000E+01 volume  0.22238E-02 ppm1      0.784 ppm2      6.054 CV     1
 OR {  753}
   (( segid "    " and resid 175  and name HB1 ))
   (( segid "    " and resid 175  and name HD22))
 ASSI {  760}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      5.500     3.800     0.500 peak   760 spectrum    1 weight  0.10000E+01 volume  0.78646E-04 ppm1      3.982 ppm2      5.140 CV     1
 OR {  760}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
 OR {  760}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HA  ))
 OR {  760}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HA  ))
 ASSI {  761}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      5.000     3.100     1.000 peak   761 spectrum    1 weight  0.10000E+01 volume  0.15521E-03 ppm1      3.970 ppm2      5.123 CV     1
 OR {  761}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  763}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 141  and name HA  ))
      4.500     2.500     1.500 peak   763 spectrum    1 weight  0.10000E+01 volume  0.15258E-02 ppm1      2.841 ppm2      5.128 CV     1
 OR {  763}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI {  766}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 141  and name HA  ))
      4.500     2.500     1.500 peak   766 spectrum    1 weight  0.10000E+01 volume  0.73834E-03 ppm1      2.736 ppm2      5.124 CV     1
 OR {  766}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
 ASSI {  768}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      3.600     1.600     1.600 peak   768 spectrum    1 weight  0.10000E+01 volume  0.12296E-02 ppm1      0.655 ppm2      5.144 CV     1
 OR {  768}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 140  and name HA  ))
 OR {  768}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 141  and name HA  ))
 ASSI {  769}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 138  and name HA  ))
      3.300     1.300     1.300 peak   769 spectrum    1 weight  0.10000E+01 volume  0.15586E-02 ppm1      0.472 ppm2      5.120 CV     1
 OR {  769}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  770}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HA  ))
      4.700     2.700     1.300 peak   770 spectrum    1 weight  0.10000E+01 volume  0.23796E-03 ppm1      4.147 ppm2      5.111 CV     1
 OR {  770}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  775}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 138  and name HA  ))
      6.000     5.600     0.000 peak   775 spectrum    1 weight  0.10000E+01 volume  0.19404E-04 ppm1      2.218 ppm2      5.101 CV     1
 OR {  775}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 38   and name HA  ))
 OR {  775}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 138  and name HA  ))
 OR {  775}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 141  and name HA  ))
 ASSI {  776}
   (( segid "    " and resid 139  and name HB  ))
   (( segid "    " and resid 138  and name HA  ))
      4.200     2.200     1.800 peak   776 spectrum    1 weight  0.10000E+01 volume  0.68507E-03 ppm1      1.806 ppm2      5.101 CV     1
 OR {  776}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  777}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 138  and name HA  ))
      3.300     3.300     2.700 peak   777 spectrum    1 weight  0.10000E+01 volume  0.12443E-02 ppm1      0.827 ppm2      5.099 CV     1
 OR {  777}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  778}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 41   and name HA  ))
      3.200     1.300     1.300 peak   778 spectrum    1 weight  0.10000E+01 volume  0.22626E-02 ppm1      0.776 ppm2      5.095 CV     1
 OR {  778}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 138  and name HA  ))
 OR {  778}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 38   and name HA  ))
 ASSI {  779}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 58   and name HA  ))
      2.300     0.600     0.600 peak   779 spectrum    1 weight  0.10000E+01 volume  0.57373E-02 ppm1      3.976 ppm2      4.961 CV     1
 OR {  779}
   (( segid "    " and resid 158  and name HB  ))
   (( segid "    " and resid 158  and name HA  ))
 ASSI {  780}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
      3.200     1.300     1.300 peak   780 spectrum    1 weight  0.10000E+01 volume  0.19895E-02 ppm1      1.185 ppm2      4.948 CV     1
 OR {  780}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 158  and name HA  ))
 ASSI {  781}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HA  ))
      3.400     1.400     1.400 peak   781 spectrum    1 weight  0.10000E+01 volume  0.67685E-03 ppm1      3.260 ppm2      4.881 CV     1
 OR {  781}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  783}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 149  and name HA  ))
      3.900     1.900     1.900 peak   783 spectrum    1 weight  0.10000E+01 volume  0.21911E-03 ppm1      3.094 ppm2      4.885 CV     1
 OR {  783}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  784}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 49   and name HA  ))
      2.500     2.500     3.500 peak   784 spectrum    1 weight  0.10000E+01 volume  0.29676E-02 ppm1      1.820 ppm2      4.887 CV     1
 OR {  784}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  786}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 149  and name HA  ))
      3.600     1.600     1.600 peak   786 spectrum    1 weight  0.10000E+01 volume  0.90993E-03 ppm1      0.877 ppm2      4.886 CV     1
 OR {  786}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  797}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 142  and name HA  ))
      2.300     0.700     0.700 peak   797 spectrum    1 weight  0.10000E+01 volume  0.53224E-02 ppm1      2.842 ppm2      4.810 CV     1
 OR {  797}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  798}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 42   and name HA  ))
      2.500     0.800     0.800 peak   798 spectrum    1 weight  0.10000E+01 volume  0.46876E-02 ppm1      2.736 ppm2      4.812 CV     1
 OR {  798}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  799}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 142  and name HA  ))
      6.000     6.000     0.000 peak   799 spectrum    1 weight  0.10000E+01 volume  0.19116E-04 ppm1      2.097 ppm2      4.797 CV     1
 OR {  799}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 42   and name HA  ))
 OR {  799}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  800}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 142  and name HA  ))
      2.100     2.100     3.900 peak   800 spectrum    1 weight  0.10000E+01 volume  0.28718E-02 ppm1      0.737 ppm2      4.805 CV     1
 OR {  800}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  801}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 142  and name HA  ))
      3.300     1.300     1.300 peak   801 spectrum    1 weight  0.10000E+01 volume  0.11332E-02 ppm1      0.716 ppm2      4.804 CV     1
 OR {  801}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  802}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HA  ))
      2.500     0.800     0.800 peak   802 spectrum    1 weight  0.10000E+01 volume  0.37193E-02 ppm1      4.106 ppm2      4.751 CV     1
 OR {  802}
   (( segid "    " and resid 159  and name HB1 ))
   (( segid "    " and resid 159  and name HA  ))
 OR {  802}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
 OR {  802}
   (( segid "    " and resid 159  and name HB2 ))
   (( segid "    " and resid 159  and name HA  ))
 ASSI {  803}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 59   and name HA  ))
      3.100     3.100     2.900 peak   803 spectrum    1 weight  0.10000E+01 volume  0.48221E-02 ppm1      3.837 ppm2      4.754 CV     1
 OR {  803}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 159  and name HA  ))
 ASSI {  807}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      4.500     2.500     1.500 peak   807 spectrum    1 weight  0.10000E+01 volume  0.14335E-03 ppm1      3.194 ppm2      4.769 CV     1
 OR {  807}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI {  815}
   (( segid "    " and resid 18   and name HB1 ))
   (( segid "    " and resid 18   and name HA  ))
      2.900     1.100     1.100 peak   815 spectrum    1 weight  0.10000E+01 volume  0.18670E-02 ppm1      2.867 ppm2      4.693 CV     1
 OR {  815}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI {  817}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HA  ))
      2.900     1.100     1.100 peak   817 spectrum    1 weight  0.10000E+01 volume  0.18227E-02 ppm1      2.769 ppm2      4.690 CV     1
 OR {  817}
   (( segid "    " and resid 18   and name HB2 ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  822}
   (( segid "    " and resid 115  and name HB2 ))
   (( segid "    " and resid 115  and name HA  ))
      2.800     1.000     1.000 peak   822 spectrum    1 weight  0.10000E+01 volume  0.19860E-02 ppm1      3.032 ppm2      4.650 CV     1
 OR {  822}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  826}
   (( segid "    " and resid 36   and name HD2 ))
   (( segid "    " and resid 36   and name HA  ))
      3.900     1.900     1.900 peak   826 spectrum    1 weight  0.10000E+01 volume  0.70889E-03 ppm1      3.098 ppm2      4.585 CV     1
 OR {  826}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HA  ))
 ASSI {  830}
   (( segid "    " and resid 120  and name HB1 ))
   (( segid "    " and resid 120  and name HA  ))
      2.800     1.000     1.000 peak   830 spectrum    1 weight  0.10000E+01 volume  0.26083E-02 ppm1      2.616 ppm2      4.572 CV     1
 OR {  830}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  832}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 136  and name HA  ))
      4.100     2.100     1.900 peak   832 spectrum    1 weight  0.10000E+01 volume  0.62970E-03 ppm1      2.217 ppm2      4.596 CV     1
 OR {  832}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  842}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 136  and name HA  ))
      6.000     6.000     0.000 peak   842 spectrum    1 weight  0.10000E+01 volume  0.19242E-04 ppm1      0.824 ppm2      4.576 CV     1
 OR {  842}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  844}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 136  and name HA  ))
      2.900     2.900     3.100 peak   844 spectrum    1 weight  0.10000E+01 volume  0.21908E-02 ppm1      0.658 ppm2      4.581 CV     1
 OR {  844}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  846}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 75   and name HA  ))
      3.100     3.100     2.900 peak   846 spectrum    1 weight  0.10000E+01 volume  0.54710E-02 ppm1      3.883 ppm2      4.543 CV     1
 OR {  846}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI {  847}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HA  ))
      2.400     0.700     0.700 peak   847 spectrum    1 weight  0.10000E+01 volume  0.53662E-02 ppm1      3.868 ppm2      4.550 CV     1
 OR {  847}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HA  ))
 ASSI {  848}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HA  ))
      3.700     1.700     1.700 peak   848 spectrum    1 weight  0.10000E+01 volume  0.59291E-03 ppm1      3.178 ppm2      4.568 CV     1
 OR {  848}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HA  ))
 OR {  848}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  852}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
      2.300     0.700     0.700 peak   852 spectrum    1 weight  0.10000E+01 volume  0.45905E-02 ppm1      1.697 ppm2      4.563 CV     1
 OR {  852}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI {  853}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HA  ))
      2.800     1.000     1.000 peak   853 spectrum    1 weight  0.10000E+01 volume  0.30122E-02 ppm1      1.531 ppm2      4.538 CV     1
 OR {  853}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  854}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HA  ))
      2.000     0.500     0.500 peak   854 spectrum    1 weight  0.10000E+01 volume  0.11728E-01 ppm1      1.480 ppm2      4.528 CV     1
 OR {  854}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HA  ))
 OR {  854}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  854}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  855}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HA  ))
      2.900     1.000     1.000 peak   855 spectrum    1 weight  0.10000E+01 volume  0.22379E-02 ppm1      1.434 ppm2      4.542 CV     1
 OR {  855}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI {  856}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
      3.100     1.200     1.200 peak   856 spectrum    1 weight  0.10000E+01 volume  0.21064E-02 ppm1      0.784 ppm2      4.558 CV     1
 OR {  856}
   (( segid "    " and resid 175  and name HB1 ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI {  858}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      2.100     0.600     0.600 peak   858 spectrum    1 weight  0.10000E+01 volume  0.12578E-01 ppm1      3.973 ppm2      4.507 CV     1
 OR {  858}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI {  860}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HA  ))
      2.000     0.500     0.500 peak   860 spectrum    1 weight  0.10000E+01 volume  0.17546E-01 ppm1      3.929 ppm2      4.523 CV     1
 OR {  860}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
 OR {  860}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HA  ))
 OR {  860}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  860}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 130  and name HA  ))
 OR {  860}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  860}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 130  and name HA  ))
 ASSI {  861}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HA  ))
      2.400     0.700     0.700 peak   861 spectrum    1 weight  0.10000E+01 volume  0.86988E-02 ppm1      3.089 ppm2      4.493 CV     1
 OR {  861}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI {  862}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 113  and name HA  ))
      2.600     2.600     3.400 peak   862 spectrum    1 weight  0.10000E+01 volume  0.73561E-03 ppm1      3.016 ppm2      4.494 CV     1
 OR {  862}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR {  862}
   (( segid "    " and resid 112  and name HE1 ))
   (( segid "    " and resid 113  and name HA  ))
 OR {  862}
   (( segid "    " and resid 12   and name HE1 ))
   (( segid "    " and resid 13   and name HA  ))
 OR {  862}
   (( segid "    " and resid 33   and name HE2 ))
   (( segid "    " and resid 31   and name HA  ))
 OR {  862}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 131  and name HA  ))
 OR {  862}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 134  and name HA  ))
 OR {  862}
   (( segid "    " and resid 33   and name HE2 ))
   (( segid "    " and resid 34   and name HA  ))
 OR {  862}
   (( segid "    " and resid 33   and name HE1 ))
   (( segid "    " and resid 31   and name HA  ))
 OR {  862}
   (( segid "    " and resid 133  and name HE1 ))
   (( segid "    " and resid 131  and name HA  ))
 OR {  862}
   (( segid "    " and resid 33   and name HE1 ))
   (( segid "    " and resid 34   and name HA  ))
 OR {  862}
   (( segid "    " and resid 133  and name HE1 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {  864}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 135  and name HA  ))
      6.000     5.100     0.000 peak   864 spectrum    1 weight  0.10000E+01 volume  0.19579E-04 ppm1      2.793 ppm2      4.507 CV     1
 OR {  864}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 35   and name HA  ))
 OR {  864}
   (( segid "    " and resid 135  and name HE2 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  864}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 35   and name HA  ))
 ASSI {  866}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 28   and name HA  ))
      6.000     6.000     0.000 peak   866 spectrum    1 weight  0.10000E+01 volume  0.19607E-04 ppm1      2.095 ppm2      4.507 CV     1
 OR {  866}
   (( segid "    " and resid 129  and name HB  ))
   (( segid "    " and resid 128  and name HA  ))
 OR {  866}
   (( segid "    " and resid 110  and name HB  ))
   (( segid "    " and resid 109  and name HA  ))
 OR {  866}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI {  867}
   (( segid "    " and resid 28   and name HG1 ))
   (( segid "    " and resid 28   and name HA  ))
      3.200     1.300     1.300 peak   867 spectrum    1 weight  0.10000E+01 volume  0.28614E-02 ppm1      2.036 ppm2      4.487 CV     1
 OR {  867}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HA  ))
 OR {  867}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HA  ))
 OR {  867}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HA  ))
 ASSI {  868}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 134  and name HA  ))
      2.600     2.600     3.400 peak   868 spectrum    1 weight  0.10000E+01 volume  0.60862E-02 ppm1      2.000 ppm2      4.496 CV     1
 OR {  868}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  868}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 134  and name HA  ))
 OR {  868}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI {  871}
   (( segid "    " and resid 134  and name HG11))
   (( segid "    " and resid 134  and name HA  ))
      2.600     0.800     0.800 peak   871 spectrum    1 weight  0.10000E+01 volume  0.31599E-02 ppm1      1.212 ppm2      4.490 CV     1
 OR {  871}
   (( segid "    " and resid 34   and name HG12))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  872}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HA  ))
      3.300     1.400     1.400 peak   872 spectrum    1 weight  0.10000E+01 volume  0.21815E-02 ppm1      1.206 ppm2      4.522 CV     1
 OR {  872}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  872}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  874}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HA  ))
      2.600     0.900     0.900 peak   874 spectrum    1 weight  0.10000E+01 volume  0.23853E-02 ppm1      0.948 ppm2      4.523 CV     1
 OR {  874}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HA  ))
 OR {  874}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  875}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 134  and name HA  ))
      2.800     2.800     3.200 peak   875 spectrum    1 weight  0.10000E+01 volume  0.67897E-02 ppm1      0.737 ppm2      4.505 CV     1
 OR {  875}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  876}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 134  and name HA  ))
      2.100     2.100     3.900 peak   876 spectrum    1 weight  0.10000E+01 volume  0.98186E-02 ppm1      0.716 ppm2      4.514 CV     1
 OR {  876}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  877}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HA  ))
      2.200     0.600     0.600 peak   877 spectrum    1 weight  0.10000E+01 volume  0.79562E-02 ppm1      2.300 ppm2      4.476 CV     1
 OR {  877}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HA  ))
 ASSI {  879}
   (( segid "    " and resid 174  and name HG1 ))
   (( segid "    " and resid 170  and name HA  ))
      3.100     1.200     1.200 peak   879 spectrum    1 weight  0.10000E+01 volume  0.83846E-03 ppm1      2.284 ppm2      4.478 CV     1
 OR {  879}
   (( segid "    " and resid 74   and name HG1 ))
   (( segid "    " and resid 70   and name HA  ))
 OR {  879}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 134  and name HA  ))
 OR {  879}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {  880}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HA  ))
      2.400     0.700     0.700 peak   880 spectrum    1 weight  0.10000E+01 volume  0.41820E-02 ppm1      1.905 ppm2      4.480 CV     1
 OR {  880}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HA  ))
 ASSI {  882}
   (( segid "    " and resid 134  and name HB  ))
   (( segid "    " and resid 134  and name HA  ))
      2.300     0.700     0.700 peak   882 spectrum    1 weight  0.10000E+01 volume  0.68399E-02 ppm1      1.754 ppm2      4.474 CV     1
 OR {  882}
   (( segid "    " and resid 34   and name HB  ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  884}
   (( segid "    " and resid 34   and name HG11))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.900     0.900 peak   884 spectrum    1 weight  0.10000E+01 volume  0.26349E-02 ppm1      1.419 ppm2      4.477 CV     1
 OR {  884}
   (( segid "    " and resid 134  and name HG12))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {  889}
   (( segid "    " and resid 162  and name HB1 ))
   (( segid "    " and resid 162  and name HA  ))
      2.500     0.800     0.800 peak   889 spectrum    1 weight  0.10000E+01 volume  0.48157E-02 ppm1      2.591 ppm2      4.431 CV     1
 OR {  889}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  905}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 156  and name HA  ))
      3.800     1.800     1.800 peak   905 spectrum    1 weight  0.10000E+01 volume  0.31908E-03 ppm1      1.182 ppm2      4.421 CV     1
 OR {  905}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 162  and name HA  ))
 OR {  905}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  906}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HA  ))
      2.900     1.100     1.100 peak   906 spectrum    1 weight  0.10000E+01 volume  0.33012E-02 ppm1      4.159 ppm2      4.387 CV     1
 OR {  906}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 156  and name HA  ))
 OR {  906}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 169  and name HA  ))
 OR {  906}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  907}
   (( segid "    " and resid 169  and name HB2 ))
   (( segid "    " and resid 169  and name HA  ))
      2.500     0.800     0.800 peak   907 spectrum    1 weight  0.10000E+01 volume  0.55524E-02 ppm1      2.977 ppm2      4.390 CV     1
 OR {  907}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HA  ))
 OR {  907}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  908}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 62   and name HA  ))
      2.100     0.500     0.500 peak   908 spectrum    1 weight  0.10000E+01 volume  0.11335E-01 ppm1      2.668 ppm2      4.394 CV     1
 OR {  908}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
 OR {  908}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 169  and name HA  ))
 OR {  908}
   (( segid "    " and resid 162  and name HB2 ))
   (( segid "    " and resid 162  and name HA  ))
 OR {  908}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  909}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
      3.300     1.300     1.300 peak   909 spectrum    1 weight  0.10000E+01 volume  0.54842E-03 ppm1      2.090 ppm2      4.381 CV     1
 OR {  909}
   (( segid "    " and resid 172  and name HB1 ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI {  915}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 69   and name HA  ))
      3.300     1.400     1.400 peak   915 spectrum    1 weight  0.10000E+01 volume  0.82431E-03 ppm1      0.053 ppm2      4.390 CV     1
 OR {  915}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 169  and name HA  ))
 ASSI {  917}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HA  ))
      2.400     0.700     0.700 peak   917 spectrum    1 weight  0.10000E+01 volume  0.46175E-02 ppm1      1.835 ppm2      4.344 CV     1
 OR {  917}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  918}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      2.200     0.600     0.600 peak   918 spectrum    1 weight  0.10000E+01 volume  0.94725E-02 ppm1      1.760 ppm2      4.320 CV     1
 OR {  918}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HA  ))
 OR {  918}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HA  ))
 OR {  918}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HA  ))
 OR {  918}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI {  924}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HA  ))
      2.700     0.900     0.900 peak   924 spectrum    1 weight  0.10000E+01 volume  0.33755E-02 ppm1      1.131 ppm2      4.330 CV     1
 OR {  924}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HA  ))
 OR {  924}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HA  ))
 OR {  924}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HA  ))
 ASSI {  925}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 69   and name HA  ))
      3.400     3.400     2.600 peak   925 spectrum    1 weight  0.10000E+01 volume  0.12766E-02 ppm1      1.059 ppm2      4.344 CV     1
 OR {  925}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 169  and name HA  ))
 ASSI {  926}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 152  and name HA  ))
      5.500     3.700     0.500 peak   926 spectrum    1 weight  0.10000E+01 volume  0.38793E-04 ppm1      3.884 ppm2      4.287 CV     1
 OR {  926}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  927}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HA  ))
      3.800     1.800     1.800 peak   927 spectrum    1 weight  0.10000E+01 volume  0.86348E-03 ppm1      3.177 ppm2      4.302 CV     1
 OR {  927}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HA  ))
 OR {  927}
   (( segid "    " and resid 19   and name HD1 ))
   (( segid "    " and resid 19   and name HA  ))
 OR {  927}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HA  ))
 OR {  927}
   (( segid "    " and resid 19   and name HD2 ))
   (( segid "    " and resid 19   and name HA  ))
 OR {  927}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HA  ))
 OR {  927}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HA  ))
 ASSI {  928}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
      2.500     0.800     0.800 peak   928 spectrum    1 weight  0.10000E+01 volume  0.24144E-02 ppm1      2.116 ppm2      4.297 CV     1
 OR {  928}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 152  and name HA  ))
 ASSI {  932}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      2.400     0.700     0.700 peak   932 spectrum    1 weight  0.10000E+01 volume  0.63384E-02 ppm1      1.813 ppm2      4.303 CV     1
 OR {  932}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI {  934}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
      2.200     0.600     0.600 peak   934 spectrum    1 weight  0.10000E+01 volume  0.79512E-02 ppm1      1.745 ppm2      4.302 CV     1
 OR {  934}
   (( segid "    " and resid 12   and name HB1 ))
   (( segid "    " and resid 12   and name HA  ))
 OR {  934}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HA  ))
 OR {  934}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HA  ))
 OR {  934}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI {  937}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 19   and name HA  ))
      2.300     0.700     0.700 peak   937 spectrum    1 weight  0.10000E+01 volume  0.58134E-02 ppm1      1.626 ppm2      4.298 CV     1
 OR {  937}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 119  and name HA  ))
 OR {  937}
   (( segid "    " and resid 123  and name HG1 ))
   (( segid "    " and resid 123  and name HA  ))
 OR {  937}
   (( segid "    " and resid 23   and name HG1 ))
   (( segid "    " and resid 23   and name HA  ))
 OR {  937}
   (( segid "    " and resid 123  and name HG2 ))
   (( segid "    " and resid 123  and name HA  ))
 OR {  937}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HA  ))
 OR {  937}
   (( segid "    " and resid 119  and name HG2 ))
   (( segid "    " and resid 119  and name HA  ))
 ASSI {  938}
   (( segid "    " and resid 103  and name HB1 ))
   (( segid "    " and resid 105  and name HA  ))
      2.600     2.600     3.400 peak   938 spectrum    1 weight  0.10000E+01 volume  0.50714E-02 ppm1      1.608 ppm2      4.280 CV     1
 OR {  938}
   (( segid "    " and resid 3    and name HB2 ))
   (( segid "    " and resid 5    and name HA  ))
 ASSI {  939}
   (( segid "    " and resid 111  and name HG1 ))
   (( segid "    " and resid 111  and name HA  ))
      3.300     1.400     1.400 peak   939 spectrum    1 weight  0.10000E+01 volume  0.70140E-03 ppm1      1.446 ppm2      4.295 CV     1
 OR {  939}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HA  ))
 OR {  939}
   (( segid "    " and resid 112  and name HG1 ))
   (( segid "    " and resid 112  and name HA  ))
 OR {  939}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI {  940}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HA  ))
      4.200     2.200     1.800 peak   940 spectrum    1 weight  0.10000E+01 volume  0.29001E-03 ppm1      0.936 ppm2      4.284 CV     1
 OR {  940}
   (  segid "    " and resid 21   and name HD2%)
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  942}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 174  and name HA  ))
      3.100     1.200     1.200 peak   942 spectrum    1 weight  0.10000E+01 volume  0.15126E-02 ppm1      4.039 ppm2      4.248 CV     1
 OR {  942}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  943}
   (( segid "    " and resid 122  and name HG1 ))
   (( segid "    " and resid 122  and name HA  ))
      2.000     0.500     0.500 peak   943 spectrum    1 weight  0.10000E+01 volume  0.11464E-01 ppm1      2.303 ppm2      4.247 CV     1
 OR {  943}
   (( segid "    " and resid 22   and name HG1 ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  944}
   (( segid "    " and resid 104  and name HG2 ))
   (( segid "    " and resid 104  and name HA  ))
      2.800     1.000     1.000 peak   944 spectrum    1 weight  0.10000E+01 volume  0.27291E-02 ppm1      2.242 ppm2      4.262 CV     1
 OR {  944}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  944}
   (( segid "    " and resid 122  and name HG2 ))
   (( segid "    " and resid 122  and name HA  ))
 OR {  944}
   (( segid "    " and resid 22   and name HG2 ))
   (( segid "    " and resid 22   and name HA  ))
 OR {  944}
   (( segid "    " and resid 104  and name HG1 ))
   (( segid "    " and resid 104  and name HA  ))
 ASSI {  946}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      2.400     0.700     0.700 peak   946 spectrum    1 weight  0.10000E+01 volume  0.77912E-02 ppm1      2.052 ppm2      4.258 CV     1
 OR {  946}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  953}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 117  and name HA  ))
      2.300     0.700     0.700 peak   953 spectrum    1 weight  0.10000E+01 volume  0.76153E-02 ppm1      1.945 ppm2      4.265 CV     1
 OR {  953}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HA  ))
 OR {  953}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  953}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 104  and name HA  ))
 OR {  953}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HA  ))
 OR {  953}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 104  and name HA  ))
 OR {  953}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 4    and name HA  ))
 OR {  953}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HA  ))
 OR {  953}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  960}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 106  and name HA  ))
      2.100     0.500     0.500 peak   960 spectrum    1 weight  0.10000E+01 volume  0.14952E-01 ppm1      1.362 ppm2      4.273 CV     1
 OR {  960}
   (  segid "    " and resid 6    and name HB% )
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  964}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
      5.200     3.400     0.800 peak   964 spectrum    1 weight  0.10000E+01 volume  0.21009E-03 ppm1      4.562 ppm2      4.219 CV     1
 OR {  964}
   (( segid "    " and resid 175  and name HA  ))
   (( segid "    " and resid 171  and name HA  ))
 ASSI {  965}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 144  and name HA  ))
      2.300     0.700     0.700 peak   965 spectrum    1 weight  0.10000E+01 volume  0.52379E-02 ppm1      4.428 ppm2      4.196 CV     1
 OR {  965}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI {  968}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 44   and name HA  ))
      2.700     2.700     3.300 peak   968 spectrum    1 weight  0.10000E+01 volume  0.53210E-02 ppm1      3.352 ppm2      4.195 CV     1
 OR {  968}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 144  and name HA  ))
 OR {  968}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  969}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 51   and name HA  ))
      1.700     1.700     4.300 peak   969 spectrum    1 weight  0.10000E+01 volume  0.49704E-01 ppm1      1.558 ppm2      4.217 CV     1
 OR {  969}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  971}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
      3.700     1.700     1.700 peak   971 spectrum    1 weight  0.10000E+01 volume  0.68666E-03 ppm1      3.960 ppm2      4.172 CV     1
 OR {  971}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HA  ))
 OR {  971}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 148  and name HA  ))
 OR {  971}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  972}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 148  and name HA  ))
      6.000     4.600     0.000 peak   972 spectrum    1 weight  0.10000E+01 volume  0.41210E-04 ppm1      3.654 ppm2      4.182 CV     1
 OR {  972}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
 OR {  972}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 44   and name HA  ))
 OR {  972}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  973}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 167  and name HA  ))
      6.000     6.000     0.000 peak   973 spectrum    1 weight  0.10000E+01 volume  0.20422E-04 ppm1      3.403 ppm2      4.178 CV     1
 OR {  973}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  973}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  973}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {  975}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 167  and name HA  ))
      5.600     3.900     0.400 peak   975 spectrum    1 weight  0.10000E+01 volume  0.12141E-03 ppm1      3.287 ppm2      4.185 CV     1
 OR {  975}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  975}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 171  and name HA  ))
 OR {  975}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  977}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HA  ))
      3.900     1.900     1.900 peak   977 spectrum    1 weight  0.10000E+01 volume  0.64044E-03 ppm1      3.265 ppm2      4.150 CV     1
 OR {  977}
   (( segid "    " and resid 55   and name HD2 ))
   (( segid "    " and resid 55   and name HA  ))
 OR {  977}
   (( segid "    " and resid 155  and name HD2 ))
   (( segid "    " and resid 155  and name HA  ))
 OR {  977}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  979}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 67   and name HA  ))
      2.600     0.900     0.900 peak   979 spectrum    1 weight  0.10000E+01 volume  0.22112E-02 ppm1      3.092 ppm2      4.173 CV     1
 OR {  979}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  979}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HA  ))
 OR {  979}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  980}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 67   and name HA  ))
      3.200     1.300     1.300 peak   980 spectrum    1 weight  0.10000E+01 volume  0.98615E-03 ppm1      3.076 ppm2      4.182 CV     1
 OR {  980}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  980}
   (( segid "    " and resid 170  and name HB1 ))
   (( segid "    " and resid 171  and name HA  ))
 OR {  980}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
 OR {  980}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HA  ))
 OR {  980}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
 OR {  980}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  980}
   (( segid "    " and resid 170  and name HB1 ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {  983}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 166  and name HA  ))
      3.100     1.200     1.200 peak   983 spectrum    1 weight  0.10000E+01 volume  0.24654E-02 ppm1      2.675 ppm2      4.158 CV     1
 OR {  983}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  983}
   (( segid "    " and resid 165  and name HB2 ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {  986}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HA  ))
      2.500     0.800     0.800 peak   986 spectrum    1 weight  0.10000E+01 volume  0.48550E-02 ppm1      2.432 ppm2      4.159 CV     1
 OR {  986}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {  995}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 67   and name HA  ))
      3.600     1.600     1.600 peak   995 spectrum    1 weight  0.10000E+01 volume  0.91054E-03 ppm1      2.012 ppm2      4.172 CV     1
 OR {  995}
   (( segid "    " and resid 167  and name HG  ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  995}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  997}
   (( segid "    " and resid 148  and name HG2 ))
   (( segid "    " and resid 148  and name HA  ))
      2.400     0.700     0.700 peak   997 spectrum    1 weight  0.10000E+01 volume  0.51337E-02 ppm1      1.925 ppm2      4.159 CV     1
 OR {  997}
   (( segid "    " and resid 55   and name HG2 ))
   (( segid "    " and resid 55   and name HA  ))
 OR {  997}
   (( segid "    " and resid 155  and name HG2 ))
   (( segid "    " and resid 155  and name HA  ))
 OR {  997}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 55   and name HA  ))
 OR {  997}
   (( segid "    " and resid 155  and name HG1 ))
   (( segid "    " and resid 155  and name HA  ))
 ASSI {  998}
   (( segid "    " and resid 167  and name HB1 ))
   (( segid "    " and resid 167  and name HA  ))
      2.600     0.800     0.800 peak   998 spectrum    1 weight  0.10000E+01 volume  0.18982E-02 ppm1      1.917 ppm2      4.178 CV     1
 OR {  998}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  998}
   (( segid "    " and resid 167  and name HB2 ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  998}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  998}
   (( segid "    " and resid 167  and name HB2 ))
   (( segid "    " and resid 67   and name HA  ))
 OR {  998}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI { 1000}
   (  segid "    " and resid 127  and name HB% )
   (( segid "    " and resid 129  and name HA  ))
      4.400     2.400     1.600 peak  1000 spectrum    1 weight  0.10000E+01 volume  0.13300E-03 ppm1      1.372 ppm2      4.163 CV     1
 OR { 1000}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 29   and name HA  ))
 ASSI { 1005}
   (  segid "    " and resid 126  and name HG2%)
   (( segid "    " and resid 125  and name HA  ))
      2.400     2.400     3.600 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.13275E-01 ppm1      1.204 ppm2      4.157 CV     1
 OR { 1005}
   (  segid "    " and resid 26   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
 ASSI { 1008}
   (  segid "    " and resid 114  and name HG2%)
   (( segid "    " and resid 114  and name HB  ))
      2.300     0.700     0.700 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.60304E-02 ppm1      1.130 ppm2      4.152 CV     1
 OR { 1008}
   (  segid "    " and resid 14   and name HG2%)
   (( segid "    " and resid 14   and name HB  ))
 OR { 1008}
   (  segid "    " and resid 108  and name HG2%)
   (( segid "    " and resid 108  and name HB  ))
 OR { 1008}
   (  segid "    " and resid 8    and name HG2%)
   (( segid "    " and resid 8    and name HB  ))
 ASSI { 1009}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 67   and name HA  ))
      2.400     2.400     3.600 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.19889E-01 ppm1      1.079 ppm2      4.173 CV     1
 OR { 1009}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 167  and name HA  ))
 OR { 1009}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 171  and name HA  ))
 ASSI { 1012}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 108  and name HB  ))
      1.600     1.600     4.400 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.14418E-01 ppm1      0.927 ppm2      4.169 CV     1
 OR { 1012}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 8    and name HB  ))
 OR { 1012}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 108  and name HB  ))
 ASSI { 1013}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 148  and name HA  ))
      6.000     5.900     0.000 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.20633E-04 ppm1      0.876 ppm2      4.172 CV     1
 OR { 1013}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 144  and name HA  ))
 OR { 1013}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 71   and name HA  ))
 ASSI { 1014}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
      5.000     3.200     1.000 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.27132E-03 ppm1      0.620 ppm2      4.168 CV     1
 OR { 1014}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 167  and name HA  ))
 OR { 1014}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 167  and name HA  ))
 OR { 1014}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 67   and name HA  ))
 OR { 1014}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
 OR { 1014}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 171  and name HA  ))
 ASSI { 1015}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 167  and name HA  ))
      3.000     1.100     1.100 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.40790E-02 ppm1      0.567 ppm2      4.174 CV     1
 OR { 1015}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 67   and name HA  ))
 ASSI { 1016}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 166  and name HA  ))
      6.000     6.000     0.000 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.19867E-04 ppm1      0.053 ppm2      4.168 CV     1
 OR { 1016}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
 OR { 1016}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 167  and name HA  ))
 OR { 1016}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 67   and name HA  ))
 OR { 1016}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 167  and name HA  ))
 OR { 1016}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 67   and name HA  ))
 OR { 1016}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 171  and name HA  ))
 ASSI { 1017}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 67   and name HA  ))
      5.700     4.100     0.300 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.83435E-04 ppm1     -0.195 ppm2      4.176 CV     1
 OR { 1017}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name HA  ))
 OR { 1017}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 171  and name HA  ))
 OR { 1017}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 166  and name HA  ))
 ASSI { 1018}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HA  ))
      6.000     6.000     0.000 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.19284E-04 ppm1      4.586 ppm2      4.117 CV     1
 OR { 1018}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI { 1020}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HB  ))
      1.700     0.300     0.500 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.39049E-01 ppm1      4.325 ppm2      4.133 CV     1
 OR { 1020}
   (( segid "    " and resid 114  and name HA  ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 1022}
   (( segid "    " and resid 165  and name HB1 ))
   (( segid "    " and resid 166  and name HA  ))
      2.600     2.600     3.400 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.30484E-02 ppm1      2.982 ppm2      4.146 CV     1
 OR { 1022}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 1026}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HA  ))
      2.300     0.700     0.700 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.70853E-02 ppm1      2.126 ppm2      4.138 CV     1
 OR { 1026}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 1027}
   (( segid "    " and resid 110  and name HB  ))
   (( segid "    " and resid 110  and name HA  ))
      2.100     0.500     0.500 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.11442E-01 ppm1      2.086 ppm2      4.148 CV     1
 OR { 1027}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 10   and name HA  ))
 OR { 1027}
   (( segid "    " and resid 29   and name HB  ))
   (( segid "    " and resid 29   and name HA  ))
 OR { 1027}
   (( segid "    " and resid 129  and name HB  ))
   (( segid "    " and resid 129  and name HA  ))
 OR { 1027}
   (( segid "    " and resid 24   and name HB  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI { 1033}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HA  ))
      2.200     2.200     3.800 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.12830E-01 ppm1      0.951 ppm2      4.144 CV     1
 OR { 1033}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HA  ))
 OR { 1033}
   (  segid "    " and resid 125  and name HG2%)
   (( segid "    " and resid 124  and name HA  ))
 ASSI { 1034}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 10   and name HA  ))
      2.300     0.600     0.600 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.86089E-02 ppm1      0.915 ppm2      4.124 CV     1
 OR { 1034}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 110  and name HA  ))
 OR { 1034}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 110  and name HA  ))
 ASSI { 1036}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 137  and name HA  ))
      2.200     2.200     3.800 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.75369E-02 ppm1      0.657 ppm2      4.139 CV     1
 OR { 1036}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 37   and name HA  ))
 ASSI { 1037}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
      6.000     5.600     0.000 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.19734E-04 ppm1      4.435 ppm2      4.073 CV     1
 OR { 1037}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 161  and name HB  ))
 OR { 1037}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 159  and name HB2 ))
 OR { 1037}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1038}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
      2.100     0.600     0.600 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.13498E-01 ppm1      3.842 ppm2      4.089 CV     1
 OR { 1038}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 161  and name HB  ))
 ASSI { 1040}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 59   and name HB1 ))
      6.000     6.000     0.000 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.20548E-04 ppm1      1.632 ppm2      4.087 CV     1
 OR { 1040}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 159  and name HB1 ))
 OR { 1040}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 59   and name HB2 ))
 OR { 1040}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 159  and name HB2 ))
 ASSI { 1041}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HB  ))
      2.000     0.500     0.500 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.11840E-01 ppm1      1.267 ppm2      4.078 CV     1
 OR { 1041}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 161  and name HB  ))
 ASSI { 1043}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 159  and name HB1 ))
      4.100     2.200     1.900 peak  1043 spectrum    1 weight  0.10000E+01 volume  0.56117E-03 ppm1      0.628 ppm2      4.082 CV     1
 OR { 1043}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 59   and name HB1 ))
 OR { 1043}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 161  and name HB  ))
 OR { 1043}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name HB  ))
 OR { 1043}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1047}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HA  ))
      3.600     1.600     1.600 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.27281E-02 ppm1      1.748 ppm2      4.043 CV     1
 OR { 1047}
   (( segid "    " and resid 173  and name HD1 ))
   (( segid "    " and resid 173  and name HA  ))
 OR { 1047}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 73   and name HA  ))
 OR { 1047}
   (( segid "    " and resid 173  and name HD2 ))
   (( segid "    " and resid 173  and name HA  ))
 ASSI { 1049}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HA  ))
      2.000     0.500     0.500 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.88752E-02 ppm1      1.500 ppm2      4.031 CV     1
 OR { 1049}
   (( segid "    " and resid 173  and name HG2 ))
   (( segid "    " and resid 173  and name HA  ))
 ASSI { 1050}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
      4.500     2.600     1.500 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.16998E-03 ppm1      2.265 ppm2      3.988 CV     1
 OR { 1050}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 58   and name HB  ))
 OR { 1050}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 158  and name HB  ))
 OR { 1050}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 153  and name HA  ))
 OR { 1050}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name HA2 ))
 OR { 1050}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name HA1 ))
 OR { 1050}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 157  and name HA2 ))
 ASSI { 1052}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 157  and name HA2 ))
      3.600     1.600     1.600 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.16216E-02 ppm1      1.542 ppm2      4.014 CV     1
 OR { 1052}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 57   and name HA2 ))
 OR { 1052}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 53   and name HA  ))
 OR { 1052}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 153  and name HA  ))
 ASSI { 1054}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 132  and name HA2 ))
      2.400     2.400     3.600 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.12250E-02 ppm1      0.736 ppm2      3.987 CV     1
 OR { 1054}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 32   and name HA2 ))
 OR { 1054}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 32   and name HA1 ))
 OR { 1054}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 132  and name HA1 ))
 ASSI { 1055}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 132  and name HA2 ))
      4.200     2.200     1.800 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.11245E-03 ppm1      0.717 ppm2      4.008 CV     1
 OR { 1055}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 32   and name HA2 ))
 OR { 1055}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 1057}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB1 ))
      1.900     0.500     0.500 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.19912E-01 ppm1      4.506 ppm2      3.957 CV     1
 OR { 1057}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
 OR { 1057}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
 OR { 1057}
   (( segid "    " and resid 131  and name HA  ))
   (( segid "    " and resid 131  and name HB2 ))
 ASSI { 1059}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HA1 ))
      4.800     2.900     1.200 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.16118E-03 ppm1      4.423 ppm2      3.973 CV     1
 OR { 1059}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 157  and name HA1 ))
 OR { 1059}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 153  and name HA  ))
 OR { 1059}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 1060}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 145  and name HA  ))
      4.000     2.000     2.000 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.68728E-03 ppm1      3.395 ppm2      3.961 CV     1
 OR { 1060}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 1062}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HA  ))
      5.100     3.200     0.900 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.75296E-04 ppm1      3.165 ppm2      3.942 CV     1
 OR { 1062}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI { 1068}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 153  and name HA  ))
      3.600     1.600     1.600 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.60406E-03 ppm1      1.936 ppm2      3.968 CV     1
 OR { 1068}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 158  and name HB  ))
 OR { 1068}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 58   and name HB  ))
 OR { 1068}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 1070}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HA  ))
      3.500     1.600     1.600 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.10835E-02 ppm1      1.828 ppm2      3.942 CV     1
 OR { 1070}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HA  ))
 OR { 1070}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HA  ))
 OR { 1070}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 1071}
   (( segid "    " and resid 139  and name HB  ))
   (( segid "    " and resid 139  and name HA  ))
      2.700     0.900     0.900 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.29491E-02 ppm1      1.804 ppm2      3.974 CV     1
 OR { 1071}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 1073}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 45   and name HA  ))
      2.500     0.800     0.800 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.34480E-02 ppm1      1.422 ppm2      3.962 CV     1
 OR { 1073}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HA  ))
 OR { 1073}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 45   and name HA  ))
 OR { 1073}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 1074}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 158  and name HB  ))
      1.900     0.500     0.500 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.17778E-01 ppm1      1.183 ppm2      3.975 CV     1
 OR { 1074}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HB  ))
 OR { 1074}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 1075}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 153  and name HA  ))
      2.900     1.000     1.000 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.17865E-02 ppm1      0.835 ppm2      3.972 CV     1
 OR { 1075}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 53   and name HA  ))
 ASSI { 1077}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      2.100     0.600     0.600 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.11053E-01 ppm1      0.473 ppm2      3.946 CV     1
 OR { 1077}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 1081}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB1 ))
      2.100     0.500     0.500 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.13601E-01 ppm1      4.554 ppm2      3.903 CV     1
 OR { 1081}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB1 ))
 OR { 1081}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
 OR { 1081}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR { 1081}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
 OR { 1081}
   (( segid "    " and resid 130  and name HA  ))
   (( segid "    " and resid 130  and name HB1 ))
 OR { 1081}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB2 ))
 ASSI { 1086}
   (( segid "    " and resid 45   and name HE1 ))
   (( segid "    " and resid 45   and name HA  ))
      5.000     3.100     1.000 peak  1086 spectrum    1 weight  0.10000E+01 volume  0.82748E-04 ppm1      2.886 ppm2      3.931 CV     1
 OR { 1086}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 1087}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 143  and name HA  ))
      5.100     3.300     0.900 peak  1087 spectrum    1 weight  0.10000E+01 volume  0.16095E-03 ppm1      2.835 ppm2      3.920 CV     1
 OR { 1087}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 1092}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
      2.500     0.800     0.800 peak  1092 spectrum    1 weight  0.10000E+01 volume  0.38144E-02 ppm1      1.924 ppm2      3.936 CV     1
 OR { 1092}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 165  and name HA  ))
 OR { 1092}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 65   and name HA  ))
 OR { 1092}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI { 1097}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HA  ))
      5.200     3.400     0.800 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.22436E-03 ppm1      4.421 ppm2      3.897 CV     1
 OR { 1097}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 165  and name HA  ))
 ASSI { 1100}
   (( segid "    " and resid 71   and name HB1 ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     6.000     0.000 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.21686E-04 ppm1      3.324 ppm2      3.877 CV     1
 OR { 1100}
   (( segid "    " and resid 171  and name HB1 ))
   (( segid "    " and resid 172  and name HA  ))
 OR { 1100}
   (( segid "    " and resid 171  and name HB2 ))
   (( segid "    " and resid 172  and name HA  ))
 ASSI { 1101}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.800     1.800     1.800 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.39049E-03 ppm1      3.250 ppm2      3.873 CV     1
 OR { 1101}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 146  and name HA  ))
 OR { 1101}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 172  and name HA  ))
 OR { 1101}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 72   and name HA  ))
 OR { 1101}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 1102}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 146  and name HA  ))
      4.500     2.600     1.500 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.28911E-03 ppm1      3.238 ppm2      3.862 CV     1
 OR { 1102}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 1103}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.400     1.500     1.500 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.20594E-03 ppm1      3.098 ppm2      3.861 CV     1
 OR { 1103}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 146  and name HA  ))
 ASSI { 1104}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 146  and name HA  ))
      2.200     0.600     0.600 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.45590E-02 ppm1      2.964 ppm2      3.879 CV     1
 OR { 1104}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
 OR { 1104}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI { 1105}
   (( segid "    " and resid 176  and name HG2 ))
   (( segid "    " and resid 176  and name HA  ))
      2.100     0.600     0.600 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.97267E-02 ppm1      2.304 ppm2      3.890 CV     1
 OR { 1105}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HA  ))
 OR { 1105}
   (( segid "    " and resid 176  and name HG1 ))
   (( segid "    " and resid 176  and name HA  ))
 OR { 1105}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI { 1107}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 76   and name HA  ))
      2.800     2.800     3.200 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.63055E-02 ppm1      2.280 ppm2      3.886 CV     1
 OR { 1107}
   (( segid "    " and resid 174  and name HG2 ))
   (( segid "    " and resid 176  and name HA  ))
 OR { 1107}
   (( segid "    " and resid 74   and name HG2 ))
   (( segid "    " and resid 72   and name HA  ))
 OR { 1107}
   (( segid "    " and resid 174  and name HG2 ))
   (( segid "    " and resid 172  and name HA  ))
 OR { 1107}
   (( segid "    " and resid 74   and name HG1 ))
   (( segid "    " and resid 72   and name HA  ))
 OR { 1107}
   (( segid "    " and resid 174  and name HG1 ))
   (( segid "    " and resid 172  and name HA  ))
 OR { 1107}
   (( segid "    " and resid 174  and name HG1 ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 1108}
   (( segid "    " and resid 164  and name HB  ))
   (( segid "    " and resid 165  and name HA  ))
      2.700     0.900     0.900 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.32231E-02 ppm1      2.101 ppm2      3.874 CV     1
 OR { 1108}
   (( segid "    " and resid 64   and name HB  ))
   (( segid "    " and resid 65   and name HA  ))
 ASSI { 1112}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 72   and name HA  ))
      2.500     2.500     3.500 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.71238E-02 ppm1      1.820 ppm2      3.898 CV     1
 OR { 1112}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 172  and name HA  ))
 OR { 1112}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 1115}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 146  and name HA  ))
      3.400     1.400     1.400 peak  1115 spectrum    1 weight  0.10000E+01 volume  0.20093E-02 ppm1      1.477 ppm2      3.890 CV     1
 OR { 1115}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
 OR { 1115}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
 OR { 1115}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 143  and name HA  ))
 OR { 1115}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 43   and name HA  ))
 OR { 1115}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 143  and name HA  ))
 ASSI { 1116}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 43   and name HA  ))
      3.000     1.100     1.100 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.12721E-02 ppm1      1.210 ppm2      3.891 CV     1
 OR { 1116}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 143  and name HA  ))
 OR { 1116}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 146  and name HA  ))
 ASSI { 1117}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 165  and name HA  ))
      3.100     3.100     2.900 peak  1117 spectrum    1 weight  0.10000E+01 volume  0.18596E-02 ppm1      1.139 ppm2      3.872 CV     1
 OR { 1117}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
 ASSI { 1118}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 72   and name HA  ))
      2.200     2.200     3.800 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.13341E-01 ppm1      1.060 ppm2      3.878 CV     1
 OR { 1118}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 172  and name HA  ))
 ASSI { 1119}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 72   and name HA  ))
      2.800     1.000     1.000 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.36098E-02 ppm1      0.877 ppm2      3.890 CV     1
 OR { 1119}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 172  and name HA  ))
 ASSI { 1120}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 146  and name HA  ))
      4.100     2.100     1.900 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.43855E-03 ppm1      0.660 ppm2      3.872 CV     1
 OR { 1120}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
 OR { 1120}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 165  and name HA  ))
 ASSI { 1121}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 146  and name HA  ))
      3.600     1.600     1.600 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.98923E-03 ppm1      0.512 ppm2      3.868 CV     1
 OR { 1121}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 1122}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 165  and name HA  ))
      3.000     1.100     1.100 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.16160E-02 ppm1      0.051 ppm2      3.888 CV     1
 OR { 1122}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 65   and name HA  ))
 ASSI { 1124}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HD2 ))
      1.800     0.400     0.400 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.18938E-01 ppm1      4.608 ppm2      3.820 CV     1
 OR { 1124}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HD1 ))
 ASSI { 1125}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HD1 ))
      4.000     2.000     2.000 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.36247E-03 ppm1      4.468 ppm2      3.827 CV     1
 OR { 1125}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HD2 ))
 ASSI { 1127}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 72   and name HA  ))
      3.600     1.600     1.600 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.48509E-03 ppm1      4.055 ppm2      3.834 CV     1
 OR { 1127}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 172  and name HA  ))
 ASSI { 1129}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HD2 ))
      3.800     1.800     1.800 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.11465E-02 ppm1      2.299 ppm2      3.835 CV     1
 OR { 1129}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HD1 ))
 ASSI { 1130}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD1 ))
      2.000     0.500     0.500 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.14201E-01 ppm1      2.034 ppm2      3.822 CV     1
 OR { 1130}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HD2 ))
 OR { 1130}
   (( segid "    " and resid 28   and name HG1 ))
   (( segid "    " and resid 28   and name HD2 ))
 OR { 1130}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HD1 ))
 ASSI { 1132}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HD1 ))
      3.700     1.700     1.700 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.74025E-03 ppm1      1.907 ppm2      3.832 CV     1
 OR { 1132}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HD2 ))
 ASSI { 1133}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 28   and name HD2 ))
      3.100     1.200     1.200 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.33619E-02 ppm1      1.369 ppm2      3.824 CV     1
 OR { 1133}
   (  segid "    " and resid 127  and name HB% )
   (( segid "    " and resid 128  and name HD1 ))
 ASSI { 1134}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 161  and name HA  ))
      2.100     2.100     3.900 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.85529E-02 ppm1      1.267 ppm2      3.848 CV     1
 OR { 1134}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 1135}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 161  and name HA  ))
      3.200     1.300     1.300 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.11378E-02 ppm1      0.630 ppm2      3.852 CV     1
 OR { 1135}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 1137}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 161  and name HA  ))
      5.600     4.000     0.400 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.98072E-04 ppm1      4.132 ppm2      3.798 CV     1
 OR { 1137}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 1139}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HD2 ))
      1.900     0.400     0.400 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.16947E-01 ppm1      4.608 ppm2      3.654 CV     1
 OR { 1139}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HD1 ))
 ASSI { 1140}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 47   and name HA  ))
      2.700     0.900     0.900 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.28656E-02 ppm1      4.430 ppm2      3.656 CV     1
 OR { 1140}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI { 1141}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 47   and name HA  ))
      5.500     3.800     0.500 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.11404E-03 ppm1      4.189 ppm2      3.662 CV     1
 OR { 1141}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI { 1142}
   (( segid "    " and resid 128  and name HD1 ))
   (( segid "    " and resid 128  and name HD2 ))
      1.300     0.200     0.900 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.71863E-01 ppm1      3.818 ppm2      3.657 CV     1
 OR { 1142}
   (( segid "    " and resid 28   and name HD2 ))
   (( segid "    " and resid 28   and name HD1 ))
 ASSI { 1143}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HD1 ))
      4.100     2.100     1.900 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.41268E-03 ppm1      2.297 ppm2      3.655 CV     1
 OR { 1143}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI { 1144}
   (( segid "    " and resid 28   and name HG1 ))
   (( segid "    " and resid 28   and name HD1 ))
      2.100     0.600     0.600 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.93715E-02 ppm1      2.033 ppm2      3.660 CV     1
 OR { 1144}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HD2 ))
 OR { 1144}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HD2 ))
 OR { 1144}
   (( segid "    " and resid 28   and name HG2 ))
   (( segid "    " and resid 28   and name HD1 ))
 ASSI { 1147}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 47   and name HA  ))
      4.300     2.400     1.700 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.64764E-03 ppm1      1.404 ppm2      3.668 CV     1
 OR { 1147}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI { 1148}
   (  segid "    " and resid 127  and name HB% )
   (( segid "    " and resid 128  and name HD2 ))
      2.900     1.100     1.100 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.49895E-02 ppm1      1.371 ppm2      3.656 CV     1
 OR { 1148}
   (  segid "    " and resid 27   and name HB% )
   (( segid "    " and resid 28   and name HD1 ))
 ASSI { 1150}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HD2 ))
      3.700     1.800     1.800 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.13436E-02 ppm1      1.912 ppm2      3.645 CV     1
 OR { 1150}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HD1 ))
 ASSI { 1151}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 47   and name HA  ))
      4.900     3.000     1.100 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.93078E-04 ppm1      1.256 ppm2      3.638 CV     1
 OR { 1151}
   (( segid "    " and resid 150  and name HG1 ))
   (( segid "    " and resid 147  and name HA  ))
 OR { 1151}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 47   and name HA  ))
 OR { 1151}
   (( segid "    " and resid 150  and name HG2 ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI { 1155}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 63   and name HA  ))
      4.900     3.000     1.100 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.16097E-03 ppm1      2.571 ppm2      3.515 CV     1
 OR { 1155}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 163  and name HA  ))
 ASSI { 1156}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 163  and name HA  ))
      5.500     3.800     0.500 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.80734E-04 ppm1      2.437 ppm2      3.516 CV     1
 OR { 1156}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 1158}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.900     0.900 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.21997E-02 ppm1      2.246 ppm2      3.514 CV     1
 OR { 1158}
   (( segid "    " and resid 166  and name HB2 ))
   (( segid "    " and resid 163  and name HA  ))
 OR { 1158}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI { 1160}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 63   and name HA  ))
      4.600     2.600     1.400 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.11483E-03 ppm1      1.187 ppm2      3.486 CV     1
 OR { 1160}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 163  and name HA  ))
 ASSI { 1162}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 63   and name HA  ))
      2.200     2.200     3.800 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.81515E-02 ppm1     -0.195 ppm2      3.514 CV     1
 OR { 1162}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 163  and name HA  ))
 ASSI { 1164}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      2.400     0.700     0.700 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.34315E-02 ppm1      1.399 ppm2      3.438 CV     1
 OR { 1164}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HA  ))
 ASSI { 1166}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 150  and name HA  ))
      2.000     2.000     4.000 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.40825E-02 ppm1      0.514 ppm2      3.440 CV     1
 OR { 1166}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1167}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 148  and name HD2 ))
      3.200     3.200     2.800 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.22901E-02 ppm1      4.177 ppm2      3.394 CV     1
 OR { 1167}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI { 1168}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      5.200     3.400     0.800 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.41488E-04 ppm1      2.238 ppm2      3.428 CV     1
 OR { 1168}
   (( segid "    " and resid 153  and name HB1 ))
   (( segid "    " and resid 150  and name HA  ))
 ASSI { 1169}
   (( segid "    " and resid 167  and name HB2 ))
   (( segid "    " and resid 164  and name HA  ))
      4.600     2.600     1.400 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.56989E-03 ppm1      1.918 ppm2      3.396 CV     1
 OR { 1169}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
 OR { 1169}
   (( segid "    " and resid 167  and name HB1 ))
   (( segid "    " and resid 164  and name HA  ))
 OR { 1169}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
 OR { 1169}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 164  and name HA  ))
 ASSI { 1171}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 155  and name HD1 ))
      4.800     2.900     1.200 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.21515E-03 ppm1      1.558 ppm2      3.430 CV     1
 OR { 1171}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 150  and name HA  ))
 OR { 1171}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1173}
   (( segid "    " and resid 60   and name HG12))
   (( segid "    " and resid 64   and name HA  ))
      6.000     5.300     0.000 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.19965E-04 ppm1      1.272 ppm2      3.419 CV     1
 OR { 1173}
   (( segid "    " and resid 160  and name HG12))
   (( segid "    " and resid 164  and name HA  ))
 ASSI { 1178}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 164  and name HA  ))
      6.000     6.000     0.000 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.72060E-04 ppm1      4.162 ppm2      3.386 CV     1
 OR { 1178}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1179}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HD1 ))
      3.000     1.100     1.100 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.29181E-02 ppm1      4.152 ppm2      3.368 CV     1
 OR { 1179}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HD1 ))
 OR { 1179}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 155  and name HD1 ))
 OR { 1179}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HD2 ))
 ASSI { 1181}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 148  and name HD2 ))
      4.100     2.100     1.900 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.68043E-03 ppm1      3.964 ppm2      3.375 CV     1
 OR { 1181}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HD1 ))
 OR { 1181}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 146  and name HB1 ))
 ASSI { 1182}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 46   and name HB1 ))
      2.300     0.700     0.700 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.45957E-02 ppm1      3.886 ppm2      3.361 CV     1
 OR { 1182}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 146  and name HB1 ))
 ASSI { 1184}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HB1 ))
      1.800     0.400     0.400 peak  1184 spectrum    1 weight  0.10000E+01 volume  0.65216E-02 ppm1      2.959 ppm2      3.356 CV     1
 OR { 1184}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 146  and name HB1 ))
 ASSI { 1185}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HD1 ))
      2.300     0.600     0.600 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.55512E-02 ppm1      2.111 ppm2      3.379 CV     1
 OR { 1185}
   (( segid "    " and resid 164  and name HB  ))
   (( segid "    " and resid 164  and name HA  ))
 OR { 1185}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HD1 ))
 ASSI { 1186}
   (( segid "    " and resid 167  and name HG  ))
   (( segid "    " and resid 164  and name HA  ))
      2.600     0.900     0.900 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.86536E-03 ppm1      2.023 ppm2      3.371 CV     1
 OR { 1186}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1187}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 148  and name HD2 ))
      2.600     2.600     3.400 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.44204E-02 ppm1      1.979 ppm2      3.385 CV     1
 OR { 1187}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI { 1189}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 48   and name HD1 ))
      5.600     4.000     0.400 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.42921E-04 ppm1      1.823 ppm2      3.358 CV     1
 OR { 1189}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 55   and name HD1 ))
 OR { 1189}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 155  and name HD1 ))
 ASSI { 1193}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 164  and name HA  ))
      2.000     2.000     4.000 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.87898E-02 ppm1      1.142 ppm2      3.392 CV     1
 OR { 1193}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1195}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 64   and name HA  ))
      5.200     3.400     0.800 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.27543E-03 ppm1      0.774 ppm2      3.378 CV     1
 OR { 1195}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 164  and name HA  ))
 ASSI { 1196}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
      6.000     4.800     0.000 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.11212E-03 ppm1      0.472 ppm2      3.376 CV     1
 OR { 1196}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 164  and name HA  ))
 ASSI { 1197}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
      2.000     0.500     0.500 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.99505E-02 ppm1      4.196 ppm2      3.338 CV     1
 OR { 1197}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HB2 ))
 OR { 1197}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 171  and name HB1 ))
 ASSI { 1198}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HB2 ))
      6.000     5.200     0.000 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.20323E-04 ppm1      3.085 ppm2      3.333 CV     1
 OR { 1198}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HB2 ))
 OR { 1198}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 171  and name HB2 ))
 OR { 1198}
   (( segid "    " and resid 170  and name HB2 ))
   (( segid "    " and resid 171  and name HB1 ))
 OR { 1198}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1200}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 71   and name HB1 ))
      5.800     4.100     0.200 peak  1200 spectrum    1 weight  0.10000E+01 volume  0.78182E-04 ppm1      1.579 ppm2      3.349 CV     1
 OR { 1200}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 171  and name HB1 ))
 OR { 1200}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 71   and name HB2 ))
 OR { 1200}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI { 1201}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 171  and name HB1 ))
      2.000     2.000     4.000 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.10234E-01 ppm1      1.080 ppm2      3.346 CV     1
 OR { 1201}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 171  and name HB2 ))
 OR { 1201}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1202}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 71   and name HB1 ))
      1.900     1.900     4.100 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.11133E-01 ppm1      0.567 ppm2      3.346 CV     1
 OR { 1202}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 71   and name HB2 ))
 OR { 1202}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 171  and name HB1 ))
 ASSI { 1203}
   (( segid "    " and resid 152  and name HA  ))
   (( segid "    " and resid 155  and name HD2 ))
      5.400     3.600     0.600 peak  1203 spectrum    1 weight  0.10000E+01 volume  0.81512E-04 ppm1      4.309 ppm2      3.309 CV     1
 OR { 1203}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 55   and name HD2 ))
 ASSI { 1204}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      6.000     6.000     0.000 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.19418E-04 ppm1      3.884 ppm2      3.289 CV     1
 OR { 1204}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR { 1204}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 48   and name HD2 ))
 OR { 1204}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
 OR { 1204}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI { 1205}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 41   and name HB2 ))
      2.300     2.300     3.700 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.57720E-02 ppm1      3.864 ppm2      3.297 CV     1
 OR { 1205}
   (( segid "    " and resid 146  and name HA  ))
   (( segid "    " and resid 141  and name HB1 ))
 ASSI { 1206}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      6.000     6.000     0.000 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.20366E-04 ppm1      3.526 ppm2      3.298 CV     1
 OR { 1206}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR { 1206}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
 OR { 1206}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 171  and name HB2 ))
 OR { 1206}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
 OR { 1206}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 168  and name HA  ))
 ASSI { 1208}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HD2 ))
      2.600     0.800     0.800 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.38975E-02 ppm1      2.125 ppm2      3.299 CV     1
 OR { 1208}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HD2 ))
 ASSI { 1210}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 68   and name HA  ))
      2.300     0.600     0.600 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.66502E-02 ppm1      1.954 ppm2      3.295 CV     1
 OR { 1210}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 168  and name HA  ))
 OR { 1210}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HD2 ))
 OR { 1210}
   (( segid "    " and resid 155  and name HB2 ))
   (( segid "    " and resid 155  and name HD2 ))
 ASSI { 1211}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 68   and name HA  ))
      2.300     0.700     0.700 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.59664E-02 ppm1      1.932 ppm2      3.289 CV     1
 OR { 1211}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 168  and name HA  ))
 OR { 1211}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 148  and name HD1 ))
 OR { 1211}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 48   and name HD2 ))
 OR { 1211}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HD2 ))
 ASSI { 1212}
   (( segid "    " and resid 148  and name HG2 ))
   (( segid "    " and resid 148  and name HD1 ))
      2.100     0.600     0.600 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.66432E-02 ppm1      1.917 ppm2      3.298 CV     1
 OR { 1212}
   (( segid "    " and resid 155  and name HG1 ))
   (( segid "    " and resid 155  and name HD2 ))
 OR { 1212}
   (( segid "    " and resid 55   and name HG1 ))
   (( segid "    " and resid 55   and name HD2 ))
 OR { 1212}
   (( segid "    " and resid 155  and name HG2 ))
   (( segid "    " and resid 155  and name HD2 ))
 OR { 1212}
   (( segid "    " and resid 55   and name HG2 ))
   (( segid "    " and resid 55   and name HD2 ))
 ASSI { 1213}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 48   and name HD2 ))
      2.300     2.300     3.700 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.40493E-02 ppm1      1.058 ppm2      3.270 CV     1
 OR { 1213}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 148  and name HD1 ))
 ASSI { 1214}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 68   and name HA  ))
      2.100     2.100     3.900 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.10435E-01 ppm1      0.614 ppm2      3.296 CV     1
 OR { 1214}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 168  and name HA  ))
 OR { 1214}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1215}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 68   and name HA  ))
      2.200     2.200     3.800 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.87431E-02 ppm1      0.053 ppm2      3.287 CV     1
 OR { 1215}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 168  and name HA  ))
 OR { 1215}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 71   and name HB1 ))
 ASSI { 1218}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 48   and name HD2 ))
      3.000     1.100     1.100 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.41688E-02 ppm1      0.878 ppm2      3.235 CV     1
 OR { 1218}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 148  and name HD1 ))
 OR { 1218}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 149  and name HB1 ))
 ASSI { 1220}
   (( segid "    " and resid 115  and name HA  ))
   (( segid "    " and resid 115  and name HB1 ))
      2.600     0.800     0.800 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.33288E-02 ppm1      4.653 ppm2      3.191 CV     1
 OR { 1220}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HB1 ))
 ASSI { 1223}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HD1 ))
      2.900     1.000     1.000 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.16384E-02 ppm1      1.838 ppm2      3.202 CV     1
 OR { 1223}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HD1 ))
 OR { 1223}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HD2 ))
 ASSI { 1224}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HD1 ))
      2.600     0.900     0.900 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.30736E-02 ppm1      1.762 ppm2      3.196 CV     1
 OR { 1224}
   (( segid "    " and resid 123  and name HB2 ))
   (( segid "    " and resid 123  and name HD2 ))
 OR { 1224}
   (( segid "    " and resid 23   and name HB2 ))
   (( segid "    " and resid 23   and name HD2 ))
 OR { 1224}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HD1 ))
 OR { 1224}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HD2 ))
 OR { 1224}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HD2 ))
 OR { 1224}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HD2 ))
 OR { 1224}
   (( segid "    " and resid 123  and name HB1 ))
   (( segid "    " and resid 123  and name HD1 ))
 OR { 1224}
   (( segid "    " and resid 23   and name HB1 ))
   (( segid "    " and resid 23   and name HD1 ))
 OR { 1224}
   (( segid "    " and resid 119  and name HB1 ))
   (( segid "    " and resid 119  and name HD2 ))
 ASSI { 1226}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 19   and name HD2 ))
      1.900     0.500     0.500 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.15702E-01 ppm1      1.625 ppm2      3.191 CV     1
 OR { 1226}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 119  and name HD2 ))
 OR { 1226}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 123  and name HG2 ))
   (( segid "    " and resid 123  and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 23   and name HG1 ))
   (( segid "    " and resid 23   and name HD2 ))
 OR { 1226}
   (( segid "    " and resid 123  and name HG1 ))
   (( segid "    " and resid 123  and name HD2 ))
 OR { 1226}
   (( segid "    " and resid 23   and name HG2 ))
   (( segid "    " and resid 23   and name HD2 ))
 OR { 1226}
   (( segid "    " and resid 123  and name HG2 ))
   (( segid "    " and resid 123  and name HD2 ))
 OR { 1226}
   (( segid "    " and resid 23   and name HG1 ))
   (( segid "    " and resid 23   and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 123  and name HG1 ))
   (( segid "    " and resid 123  and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 19   and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 119  and name HG1 ))
   (( segid "    " and resid 119  and name HD1 ))
 OR { 1226}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HD2 ))
 ASSI { 1232}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HD2 ))
      3.900     1.900     1.900 peak  1232 spectrum    1 weight  0.10000E+01 volume  0.68736E-03 ppm1      4.299 ppm2      3.169 CV     1
 OR { 1232}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HD2 ))
 OR { 1232}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HD1 ))
 OR { 1232}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HD1 ))
 ASSI { 1233}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 45   and name HE2 ))
      3.100     3.100     2.900 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.26987E-02 ppm1      4.168 ppm2      3.153 CV     1
 OR { 1233}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 145  and name HE1 ))
 OR { 1233}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 145  and name HE1 ))
 OR { 1233}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 45   and name HE2 ))
 ASSI { 1239}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 145  and name HE1 ))
      3.000     3.000     3.000 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.34691E-02 ppm1      1.979 ppm2      3.155 CV     1
 OR { 1239}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 45   and name HE2 ))
 ASSI { 1240}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 45   and name HE2 ))
      2.700     0.900     0.900 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.31426E-02 ppm1      1.932 ppm2      3.146 CV     1
 OR { 1240}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 145  and name HE1 ))
 ASSI { 1243}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HE2 ))
      2.300     0.600     0.600 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.53357E-02 ppm1      1.822 ppm2      3.172 CV     1
 OR { 1243}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HE2 ))
 OR { 1243}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HE1 ))
 OR { 1243}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HE1 ))
 ASSI { 1247}
   (( segid "    " and resid 163  and name HB  ))
   (( segid "    " and resid 160  and name HA  ))
      4.800     2.900     1.200 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.24914E-03 ppm1      1.657 ppm2      3.156 CV     1
 OR { 1247}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI { 1248}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HA  ))
      2.800     1.000     1.000 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.12397E-02 ppm1      1.627 ppm2      3.156 CV     1
 OR { 1248}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 160  and name HA  ))
 ASSI { 1251}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
      2.700     2.700     3.300 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.11269E-02 ppm1      1.141 ppm2      3.154 CV     1
 OR { 1251}
   (  segid "    " and resid 164  and name HG1%)
   (( segid "    " and resid 45   and name HE2 ))
 OR { 1251}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 45   and name HE2 ))
 ASSI { 1254}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak  1254 spectrum    1 weight  0.10000E+01 volume  0.27649E-02 ppm1      0.630 ppm2      3.147 CV     1
 OR { 1254}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 160  and name HA  ))
 ASSI { 1255}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HA  ))
      2.900     1.100     1.100 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.43917E-02 ppm1      0.514 ppm2      3.147 CV     1
 OR { 1255}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 160  and name HA  ))
 ASSI { 1265}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 60   and name HA  ))
      6.000     6.000     0.000 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.20260E-04 ppm1      1.176 ppm2      3.112 CV     1
 OR { 1265}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 160  and name HA  ))
 ASSI { 1268}
   (( segid "    " and resid 160  and name HG11))
   (( segid "    " and resid 160  and name HA  ))
      2.300     0.600     0.600 peak  1268 spectrum    1 weight  0.10000E+01 volume  0.25505E-02 ppm1     -0.255 ppm2      3.139 CV     1
 OR { 1268}
   (( segid "    " and resid 60   and name HG11))
   (( segid "    " and resid 60   and name HA  ))
 ASSI { 1270}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 170  and name HB1 ))
      3.700     1.700     1.700 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.56369E-03 ppm1      4.194 ppm2      3.095 CV     1
 OR { 1270}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
 OR { 1270}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 170  and name HB2 ))
 OR { 1270}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 1271}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.800     0.900     0.900 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.20591E-02 ppm1      4.183 ppm2      3.070 CV     1
 OR { 1271}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 170  and name HB2 ))
 OR { 1271}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
 OR { 1271}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 170  and name HB1 ))
 ASSI { 1274}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HB2 ))
      1.800     0.400     0.400 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.66467E-02 ppm1      3.242 ppm2      3.081 CV     1
 OR { 1274}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HB2 ))
 ASSI { 1276}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 70   and name HB1 ))
      2.800     2.800     3.200 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.43573E-03 ppm1      1.693 ppm2      3.076 CV     1
 OR { 1276}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 170  and name HB1 ))
 OR { 1276}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 70   and name HB2 ))
 OR { 1276}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 170  and name HB2 ))
 OR { 1276}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 170  and name HB2 ))
 OR { 1276}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 70   and name HB2 ))
 OR { 1276}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 170  and name HB1 ))
 ASSI { 1278}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 149  and name HB2 ))
      5.600     3.900     0.400 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.77278E-04 ppm1      0.613 ppm2      3.098 CV     1
 OR { 1278}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 49   and name HB2 ))
 OR { 1278}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 70   and name HB2 ))
 OR { 1278}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 170  and name HB2 ))
 OR { 1278}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 70   and name HB1 ))
 OR { 1278}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 170  and name HB1 ))
 ASSI { 1281}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.200     1.300     1.300 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.34509E-02 ppm1      4.170 ppm2      3.034 CV     1
 OR { 1281}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 170  and name HB1 ))
 ASSI { 1289}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HE1 ))
      2.700     2.700     3.300 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.24434E-02 ppm1      1.409 ppm2      3.018 CV     1
 OR { 1289}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name HE2 ))
 OR { 1289}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HE2 ))
 OR { 1289}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 112  and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 5    and name HG1 ))
   (( segid "    " and resid 5    and name HE2 ))
 OR { 1289}
   (( segid "    " and resid 105  and name HG1 ))
   (( segid "    " and resid 105  and name HE2 ))
 OR { 1289}
   (( segid "    " and resid 111  and name HG2 ))
   (( segid "    " and resid 111  and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HE2 ))
 OR { 1289}
   (( segid "    " and resid 5    and name HG2 ))
   (( segid "    " and resid 5    and name HE1 ))
 OR { 1289}
   (( segid "    " and resid 105  and name HG2 ))
   (( segid "    " and resid 105  and name HE1 ))
 ASSI { 1294}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
      2.900     1.100     1.100 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.47772E-02 ppm1      4.427 ppm2      2.993 CV     1
 OR { 1294}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 165  and name HB1 ))
 ASSI { 1295}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 169  and name HB2 ))
      2.200     0.600     0.600 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.78496E-02 ppm1      4.383 ppm2      2.983 CV     1
 OR { 1295}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI { 1296}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      2.300     0.700     0.700 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.48535E-02 ppm1      4.157 ppm2      2.992 CV     1
 OR { 1296}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 169  and name HB2 ))
 ASSI { 1297}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB1 ))
      2.500     0.800     0.800 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.41304E-02 ppm1      3.913 ppm2      2.996 CV     1
 OR { 1297}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 165  and name HB1 ))
 ASSI { 1299}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HB2 ))
      1.500     0.300     0.700 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.29744E-01 ppm1      2.667 ppm2      2.984 CV     1
 OR { 1299}
   (( segid "    " and resid 165  and name HB2 ))
   (( segid "    " and resid 165  and name HB1 ))
 OR { 1299}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 OR { 1299}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 169  and name HB2 ))
 ASSI { 1300}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 46   and name HB2 ))
      2.700     2.700     3.300 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.38975E-02 ppm1      2.000 ppm2      3.006 CV     1
 OR { 1300}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 146  and name HB2 ))
 OR { 1300}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 146  and name HB2 ))
 OR { 1300}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI { 1303}
   (( segid "    " and resid 33   and name HD2 ))
   (( segid "    " and resid 33   and name HE1 ))
      1.900     0.400     0.400 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.20160E-01 ppm1      1.690 ppm2      3.005 CV     1
 OR { 1303}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 111  and name HD1 ))
   (( segid "    " and resid 111  and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 11   and name HD1 ))
   (( segid "    " and resid 11   and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 112  and name HD2 ))
   (( segid "    " and resid 112  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 112  and name HD1 ))
   (( segid "    " and resid 112  and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 12   and name HD1 ))
   (( segid "    " and resid 12   and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 112  and name HD2 ))
   (( segid "    " and resid 112  and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 12   and name HD1 ))
   (( segid "    " and resid 12   and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 112  and name HD1 ))
   (( segid "    " and resid 112  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 33   and name HD1 ))
   (( segid "    " and resid 33   and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 133  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HE2 ))
 OR { 1303}
   (( segid "    " and resid 111  and name HD1 ))
   (( segid "    " and resid 111  and name HE1 ))
 OR { 1303}
   (( segid "    " and resid 11   and name HD1 ))
   (( segid "    " and resid 11   and name HE1 ))
 ASSI { 1308}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 169  and name HB2 ))
      4.300     2.300     1.700 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.27372E-03 ppm1      0.058 ppm2      2.950 CV     1
 OR { 1308}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 69   and name HB2 ))
 ASSI { 1309}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 150  and name HE1 ))
      4.000     2.000     2.000 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.55664E-03 ppm1      3.654 ppm2      2.913 CV     1
 OR { 1309}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name HE1 ))
 ASSI { 1315}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HE1 ))
      5.800     4.100     0.200 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.20043E-04 ppm1      1.402 ppm2      2.918 CV     1
 OR { 1315}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HE1 ))
 ASSI { 1316}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 45   and name HE1 ))
      3.700     1.700     1.700 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.31500E-03 ppm1      0.873 ppm2      2.905 CV     1
 OR { 1316}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 145  and name HE2 ))
 ASSI { 1318}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 45   and name HE1 ))
      1.400     0.200     0.800 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.28912E-01 ppm1      3.169 ppm2      2.880 CV     1
 OR { 1318}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HE2 ))
 ASSI { 1323}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HE2 ))
      3.900     1.900     1.900 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.34060E-03 ppm1      1.666 ppm2      2.877 CV     1
 OR { 1323}
   (( segid "    " and resid 150  and name HB2 ))
   (( segid "    " and resid 150  and name HE2 ))
 ASSI { 1324}
   (( segid "    " and resid 172  and name HB2 ))
   (( segid "    " and resid 45   and name HE1 ))
      3.000     1.100     1.100 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.12202E-02 ppm1      1.573 ppm2      2.886 CV     1
 OR { 1324}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 145  and name HE2 ))
 ASSI { 1327}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HE2 ))
      2.400     0.700     0.700 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.66978E-02 ppm1      1.260 ppm2      2.880 CV     1
 OR { 1327}
   (( segid "    " and resid 150  and name HG1 ))
   (( segid "    " and resid 150  and name HE2 ))
 OR { 1327}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HE2 ))
 OR { 1327}
   (( segid "    " and resid 150  and name HG2 ))
   (( segid "    " and resid 150  and name HE2 ))
 ASSI { 1328}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 141  and name HB2 ))
      3.400     3.400     2.600 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.49052E-03 ppm1      0.521 ppm2      2.853 CV     1
 OR { 1328}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 41   and name HB1 ))
 ASSI { 1330}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 145  and name HE2 ))
      3.900     1.900     1.900 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.22041E-03 ppm1      0.047 ppm2      2.883 CV     1
 OR { 1330}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 45   and name HE1 ))
 ASSI { 1331}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      3.100     1.200     1.200 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.18847E-02 ppm1      3.442 ppm2      2.806 CV     1
 OR { 1331}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 153  and name HB2 ))
 ASSI { 1334}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 41   and name HB1 ))
      4.600     2.700     1.400 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.37478E-03 ppm1      1.424 ppm2      2.846 CV     1
 OR { 1334}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 142  and name HB1 ))
 OR { 1334}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 42   and name HB1 ))
 OR { 1334}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 41   and name HB1 ))
 OR { 1334}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 42   and name HB1 ))
 OR { 1334}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI { 1338}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HE1 ))
      4.900     3.000     1.100 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.20551E-03 ppm1      4.508 ppm2      2.790 CV     1
 OR { 1338}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1338}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 141  and name HB2 ))
 OR { 1338}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HE2 ))
 OR { 1338}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HE2 ))
 ASSI { 1339}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.500     0.800     0.800 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.28194E-02 ppm1      3.980 ppm2      2.795 CV     1
 OR { 1339}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 153  and name HB2 ))
 ASSI { 1340}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 35   and name HE1 ))
      3.000     3.000     3.000 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.29729E-03 ppm1      3.191 ppm2      2.789 CV     1
 OR { 1340}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1340}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 35   and name HE2 ))
 OR { 1340}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 135  and name HE2 ))
 ASSI { 1341}
   (( segid "    " and resid 153  and name HB1 ))
   (( segid "    " and resid 153  and name HB2 ))
      1.900     0.400     0.400 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.72204E-02 ppm1      2.247 ppm2      2.792 CV     1
 OR { 1341}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1342}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 153  and name HB2 ))
      4.900     3.000     1.100 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.32298E-03 ppm1      1.540 ppm2      2.797 CV     1
 OR { 1342}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1344}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HE2 ))
      2.200     0.600     0.600 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.73640E-02 ppm1      1.534 ppm2      2.795 CV     1
 OR { 1344}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1344}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HE2 ))
 OR { 1344}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HE1 ))
 ASSI { 1345}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HE1 ))
      2.500     0.800     0.800 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.44475E-02 ppm1      1.476 ppm2      2.800 CV     1
 OR { 1345}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1345}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HE2 ))
 OR { 1345}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HE2 ))
 OR { 1345}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1345}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HE1 ))
 OR { 1345}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HE2 ))
 OR { 1345}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HE2 ))
 ASSI { 1347}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 135  and name HE2 ))
      2.200     0.600     0.600 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.67976E-02 ppm1      1.429 ppm2      2.791 CV     1
 OR { 1347}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HE1 ))
 OR { 1347}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HE2 ))
 OR { 1347}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 135  and name HE1 ))
 ASSI { 1348}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HE1 ))
      2.500     0.800     0.800 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.34412E-02 ppm1      1.206 ppm2      2.795 CV     1
 OR { 1348}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HE1 ))
 OR { 1348}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HE2 ))
 OR { 1348}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HE2 ))
 ASSI { 1349}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 53   and name HB2 ))
      3.100     1.200     1.200 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.16424E-02 ppm1      1.183 ppm2      2.788 CV     1
 OR { 1349}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 153  and name HB2 ))
 ASSI { 1350}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HE1 ))
      2.500     0.800     0.800 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.40473E-02 ppm1      0.947 ppm2      2.788 CV     1
 OR { 1350}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HE1 ))
 OR { 1350}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HE2 ))
 OR { 1350}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HE2 ))
 ASSI { 1351}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 141  and name HB2 ))
      4.600     2.700     1.400 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.32742E-03 ppm1      0.716 ppm2      2.793 CV     1
 OR { 1351}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 41   and name HB1 ))
 OR { 1351}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 135  and name HE1 ))
 OR { 1351}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 35   and name HE1 ))
 OR { 1351}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 35   and name HE2 ))
 ASSI { 1352}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HB1 ))
      2.400     0.700     0.700 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.61672E-02 ppm1      4.574 ppm2      2.733 CV     1
 OR { 1352}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HB2 ))
 ASSI { 1355}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 142  and name HB2 ))
      3.900     1.900     1.900 peak  1355 spectrum    1 weight  0.10000E+01 volume  0.43450E-03 ppm1      2.018 ppm2      2.714 CV     1
 OR { 1355}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 42   and name HB2 ))
 OR { 1355}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 142  and name HB2 ))
 ASSI { 1356}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.200     0.600     0.600 peak  1356 spectrum    1 weight  0.10000E+01 volume  0.99044E-02 ppm1      4.384 ppm2      2.665 CV     1
 OR { 1356}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 169  and name HB1 ))
 ASSI { 1357}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 165  and name HB2 ))
      2.400     0.700     0.700 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.49082E-02 ppm1      3.914 ppm2      2.660 CV     1
 OR { 1357}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI { 1359}
   (( segid "    " and resid 165  and name HB1 ))
   (( segid "    " and resid 165  and name HB2 ))
      1.500     0.300     0.700 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.26885E-01 ppm1      2.982 ppm2      2.667 CV     1
 OR { 1359}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI { 1362}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 65   and name HB2 ))
      1.900     1.900     4.100 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.14492E-01 ppm1      4.431 ppm2      2.629 CV     1
 OR { 1362}
   (( segid "    " and resid 162  and name HA  ))
   (( segid "    " and resid 165  and name HB2 ))
 ASSI { 1363}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 166  and name HG2 ))
      2.400     0.700     0.700 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.61249E-02 ppm1      4.158 ppm2      2.613 CV     1
 OR { 1363}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI { 1364}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 62   and name HB1 ))
      4.700     2.800     1.300 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.13055E-03 ppm1      1.183 ppm2      2.622 CV     1
 OR { 1364}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 162  and name HB1 ))
 ASSI { 1365}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 62   and name HB1 ))
      3.400     3.400     2.600 peak  1365 spectrum    1 weight  0.10000E+01 volume  0.16003E-02 ppm1      0.837 ppm2      2.627 CV     1
 OR { 1365}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 162  and name HB1 ))
 ASSI { 1366}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 140  and name HB2 ))
      4.600     2.600     1.400 peak  1366 spectrum    1 weight  0.10000E+01 volume  0.35877E-03 ppm1      0.474 ppm2      2.597 CV     1
 OR { 1366}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 1367}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HB2 ))
      3.700     1.700     1.700 peak  1367 spectrum    1 weight  0.10000E+01 volume  0.10727E-02 ppm1      3.970 ppm2      2.578 CV     1
 OR { 1367}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI { 1368}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      4.000     2.000     2.000 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.31174E-03 ppm1      3.518 ppm2      2.578 CV     1
 OR { 1368}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 162  and name HB1 ))
 OR { 1368}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 66   and name HG1 ))
 OR { 1368}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 166  and name HG2 ))
 ASSI { 1370}
   (( segid "    " and resid 166  and name HG1 ))
   (( segid "    " and resid 166  and name HG2 ))
      1.200     0.200     1.000 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.94070E-01 ppm1      2.431 ppm2      2.563 CV     1
 OR { 1370}
   (( segid "    " and resid 66   and name HG2 ))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI { 1372}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HB2 ))
      1.800     0.400     0.400 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.10671E-01 ppm1      2.335 ppm2      2.582 CV     1
 OR { 1372}
   (( segid "    " and resid 140  and name HB1 ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 1376}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 140  and name HB2 ))
      2.900     2.900     3.100 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.40076E-02 ppm1      1.268 ppm2      2.593 CV     1
 OR { 1376}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 162  and name HB1 ))
 OR { 1376}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 62   and name HB1 ))
 ASSI { 1378}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 40   and name HB2 ))
      2.500     2.500     3.500 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.10208E-02 ppm1      0.736 ppm2      2.583 CV     1
 OR { 1378}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 1379}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 40   and name HB2 ))
      2.500     0.800     0.800 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.34283E-02 ppm1      0.716 ppm2      2.584 CV     1
 OR { 1379}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 1383}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HB2 ))
      3.300     1.300     1.300 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.36491E-02 ppm1      4.142 ppm2      2.473 CV     1
 OR { 1383}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR { 1383}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 138  and name HB1 ))
 OR { 1383}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 1390}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 138  and name HB1 ))
      3.700     1.700     1.700 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.14311E-02 ppm1      0.827 ppm2      2.452 CV     1
 OR { 1390}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HB1 ))
 OR { 1390}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 138  and name HB2 ))
 OR { 1390}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1391}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG1 ))
      2.100     0.500     0.500 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.13679E-01 ppm1      4.189 ppm2      2.388 CV     1
 OR { 1391}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 144  and name HG1 ))
 OR { 1391}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 144  and name HG2 ))
 OR { 1391}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
 ASSI { 1393}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HG2 ))
      3.900     1.900     1.900 peak  1393 spectrum    1 weight  0.10000E+01 volume  0.33646E-03 ppm1      3.961 ppm2      2.359 CV     1
 OR { 1393}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 144  and name HG2 ))
 ASSI { 1394}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 144  and name HG2 ))
      3.500     3.500     2.500 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.44991E-03 ppm1      3.392 ppm2      2.371 CV     1
 OR { 1394}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 44   and name HG2 ))
 ASSI { 1399}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HB1 ))
      4.000     2.000     2.000 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.71179E-03 ppm1      3.982 ppm2      2.332 CV     1
 OR { 1399}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1400}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 176  and name HG2 ))
      2.100     0.600     0.600 peak  1400 spectrum    1 weight  0.10000E+01 volume  0.10125E-01 ppm1      3.890 ppm2      2.304 CV     1
 OR { 1400}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HG2 ))
 OR { 1400}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HG1 ))
 ASSI { 1409}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 76   and name HG1 ))
      2.500     2.500     3.500 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.58507E-02 ppm1      1.939 ppm2      2.315 CV     1
 OR { 1409}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 76   and name HG2 ))
 OR { 1409}
   (( segid "    " and resid 48   and name HB2 ))
   (( segid "    " and resid 176  and name HG1 ))
 ASSI { 1410}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HB1 ))
      1.500     0.300     0.700 peak  1410 spectrum    1 weight  0.10000E+01 volume  0.28515E-01 ppm1      1.908 ppm2      2.301 CV     1
 OR { 1410}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 128  and name HB2 ))
 ASSI { 1413}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 176  and name HG1 ))
      2.900     2.900     3.100 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.40945E-02 ppm1      1.059 ppm2      2.305 CV     1
 OR { 1413}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1413}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 176  and name HG2 ))
 OR { 1413}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 76   and name HG2 ))
 ASSI { 1414}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 40   and name HB1 ))
      2.200     2.200     3.800 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.22503E-02 ppm1      0.737 ppm2      2.326 CV     1
 OR { 1414}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 140  and name HB1 ))
 OR { 1414}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1415}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 40   and name HB1 ))
      2.400     0.700     0.700 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.58113E-02 ppm1      0.717 ppm2      2.333 CV     1
 OR { 1415}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1417}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HB1 ))
      2.200     0.600     0.600 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.81268E-02 ppm1      4.432 ppm2      2.267 CV     1
 OR { 1417}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 1419}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG2 ))
      2.200     0.600     0.600 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.98504E-02 ppm1      4.241 ppm2      2.266 CV     1
 OR { 1419}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HG2 ))
 OR { 1419}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HG2 ))
 OR { 1419}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HG2 ))
 OR { 1419}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HG1 ))
 OR { 1419}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HG1 ))
 ASSI { 1420}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 166  and name HB2 ))
      1.800     0.400     0.400 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.25223E-01 ppm1      4.154 ppm2      2.265 CV     1
 OR { 1420}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1420}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1420}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI { 1421}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 176  and name HG1 ))
      5.100     3.300     0.900 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.12779E-03 ppm1      4.052 ppm2      2.287 CV     1
 OR { 1421}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1421}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 176  and name HG2 ))
 OR { 1421}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 76   and name HG2 ))
 OR { 1421}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 174  and name HG2 ))
 ASSI { 1422}
   (( segid "    " and resid 130  and name HB2 ))
   (( segid "    " and resid 128  and name HB2 ))
      5.100     3.200     0.900 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.39903E-04 ppm1      3.927 ppm2      2.264 CV     1
 OR { 1422}
   (( segid "    " and resid 130  and name HB1 ))
   (( segid "    " and resid 128  and name HB2 ))
 OR { 1422}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 28   and name HB1 ))
 OR { 1422}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 143  and name HG1 ))
 OR { 1422}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1422}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1422}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1422}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1423}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HG2 ))
      2.300     0.600     0.600 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.68710E-02 ppm1      3.895 ppm2      2.287 CV     1
 OR { 1423}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1423}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1423}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1424}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 176  and name HG1 ))
      4.800     2.800     1.200 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.12211E-03 ppm1      3.866 ppm2      2.268 CV     1
 OR { 1424}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1424}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 176  and name HG2 ))
 OR { 1424}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 76   and name HG2 ))
 ASSI { 1427}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      2.200     0.600     0.600 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.57996E-02 ppm1      3.518 ppm2      2.270 CV     1
 OR { 1427}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 166  and name HB2 ))
 OR { 1427}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1427}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI { 1429}
   (( segid "    " and resid 33   and name HE2 ))
   (( segid "    " and resid 143  and name HG1 ))
      3.700     1.700     1.700 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.92264E-04 ppm1      3.015 ppm2      2.281 CV     1
 OR { 1429}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1429}
   (( segid "    " and resid 33   and name HE1 ))
   (( segid "    " and resid 143  and name HG1 ))
 OR { 1429}
   (( segid "    " and resid 133  and name HE1 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1429}
   (( segid "    " and resid 33   and name HE2 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1429}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 43   and name HG2 ))
 ASSI { 1430}
   (( segid "    " and resid 165  and name HB1 ))
   (( segid "    " and resid 166  and name HB2 ))
      4.100     2.100     1.900 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.61240E-03 ppm1      2.988 ppm2      2.265 CV     1
 OR { 1430}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1430}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI { 1431}
   (( segid "    " and resid 135  and name HE2 ))
   (( segid "    " and resid 43   and name HG2 ))
      3.000     1.200     1.200 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.21533E-02 ppm1      2.789 ppm2      2.280 CV     1
 OR { 1431}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1431}
   (( segid "    " and resid 135  and name HE2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1431}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 143  and name HG1 ))
 OR { 1431}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1431}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1431}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI { 1434}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 143  and name HG1 ))
      1.700     0.300     0.500 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.43421E-01 ppm1      2.101 ppm2      2.281 CV     1
 OR { 1434}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1434}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1434}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 143  and name HG1 ))
 OR { 1434}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1434}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1434}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 143  and name HG2 ))
 ASSI { 1435}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HG2 ))
      1.600     0.300     0.600 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.68184E-01 ppm1      2.050 ppm2      2.271 CV     1
 OR { 1435}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HG2 ))
 OR { 1435}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HG1 ))
 OR { 1435}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 22   and name HG1 ))
 ASSI { 1439}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HG1 ))
      2.000     0.500     0.500 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.20641E-01 ppm1      1.951 ppm2      2.273 CV     1
 OR { 1439}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HG1 ))
 OR { 1439}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG1 ))
 OR { 1439}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HG1 ))
 OR { 1439}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 22   and name HG2 ))
 OR { 1439}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HG2 ))
 OR { 1439}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HG1 ))
 OR { 1439}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 117  and name HG1 ))
 OR { 1439}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HG2 ))
 OR { 1439}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI { 1441}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 156  and name HB1 ))
      1.600     0.300     0.600 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.11523E-01 ppm1      1.936 ppm2      2.268 CV     1
 OR { 1441}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 56   and name HB2 ))
 ASSI { 1444}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 76   and name HG2 ))
      2.400     2.400     3.600 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.50376E-02 ppm1      1.819 ppm2      2.293 CV     1
 OR { 1444}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HG2 ))
 OR { 1444}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1444}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HG1 ))
 ASSI { 1448}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 76   and name HG1 ))
      2.700     2.700     3.300 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.56249E-02 ppm1      1.685 ppm2      2.263 CV     1
 OR { 1448}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 176  and name HG1 ))
 OR { 1448}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 174  and name HG1 ))
 OR { 1448}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 74   and name HG1 ))
 OR { 1448}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 174  and name HG2 ))
 OR { 1448}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 74   and name HG2 ))
 ASSI { 1449}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 43   and name HG2 ))
      3.800     1.800     1.800 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.48303E-03 ppm1      1.539 ppm2      2.271 CV     1
 OR { 1449}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1449}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1449}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1450}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 43   and name HG2 ))
      3.500     1.500     1.500 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.25185E-02 ppm1      1.481 ppm2      2.276 CV     1
 OR { 1450}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1450}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1450}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1450}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1450}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1450}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1451}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 143  and name HG2 ))
      3.700     1.700     1.700 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.57872E-03 ppm1      1.432 ppm2      2.283 CV     1
 OR { 1451}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1451}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 43   and name HG1 ))
 OR { 1451}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 143  and name HG1 ))
 ASSI { 1452}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 143  and name HG2 ))
      2.800     2.800     3.200 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.12331E-02 ppm1      1.289 ppm2      2.284 CV     1
 OR { 1452}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 43   and name HG2 ))
 OR { 1452}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 76   and name HG1 ))
 OR { 1452}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 176  and name HG1 ))
 OR { 1452}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 176  and name HG2 ))
 OR { 1452}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 76   and name HG2 ))
 OR { 1452}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 153  and name HB1 ))
 ASSI { 1453}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 43   and name HG2 ))
      3.600     1.700     1.700 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.84580E-03 ppm1      1.206 ppm2      2.284 CV     1
 OR { 1453}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 143  and name HG2 ))
 OR { 1453}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 43   and name HG1 ))
 ASSI { 1454}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 66   and name HB1 ))
      3.200     1.200     1.200 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.19756E-02 ppm1      1.079 ppm2      2.261 CV     1
 OR { 1454}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1454}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1454}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 166  and name HB2 ))
 ASSI { 1456}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 166  and name HB1 ))
      3.500     1.500     1.500 peak  1456 spectrum    1 weight  0.10000E+01 volume  0.10318E-02 ppm1      0.565 ppm2      2.278 CV     1
 OR { 1456}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 166  and name HB2 ))
 OR { 1456}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 66   and name HB1 ))
 OR { 1456}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1457}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 153  and name HB1 ))
      3.400     1.400     1.400 peak  1457 spectrum    1 weight  0.10000E+01 volume  0.14152E-02 ppm1     -0.193 ppm2      2.264 CV     1
 OR { 1457}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1457}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 66   and name HB1 ))
 OR { 1457}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 53   and name HB1 ))
 OR { 1457}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 166  and name HB2 ))
 ASSI { 1459}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HB1 ))
      5.000     3.100     1.000 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.80754E-04 ppm1      4.170 ppm2      2.258 CV     1
 OR { 1459}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1459}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1459}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 166  and name HB2 ))
 ASSI { 1460}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HB  ))
      2.700     0.900     0.900 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.28702E-02 ppm1      4.143 ppm2      2.224 CV     1
 OR { 1460}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI { 1461}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      2.500     0.800     0.800 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.49266E-02 ppm1      3.980 ppm2      2.250 CV     1
 OR { 1461}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 153  and name HB1 ))
 ASSI { 1464}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 166  and name HB1 ))
      1.800     0.400     0.400 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.23111E-01 ppm1      2.574 ppm2      2.251 CV     1
 OR { 1464}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1464}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 166  and name HB2 ))
 OR { 1464}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 66   and name HB1 ))
 ASSI { 1468}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 66   and name HB1 ))
      6.000     4.800     0.000 peak  1468 spectrum    1 weight  0.10000E+01 volume  0.60591E-04 ppm1      2.024 ppm2      2.241 CV     1
 OR { 1468}
   (( segid "    " and resid 167  and name HG  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1468}
   (( segid "    " and resid 67   and name HG  ))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1468}
   (( segid "    " and resid 167  and name HG  ))
   (( segid "    " and resid 166  and name HB2 ))
 ASSI { 1469}
   (( segid "    " and resid 174  and name HB1 ))
   (( segid "    " and resid 174  and name HG2 ))
      6.000     5.000     0.000 peak  1469 spectrum    1 weight  0.10000E+01 volume  0.20366E-04 ppm1      1.871 ppm2      2.251 CV     1
 OR { 1469}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HG2 ))
 OR { 1469}
   (( segid "    " and resid 74   and name HB1 ))
   (( segid "    " and resid 74   and name HG1 ))
 OR { 1469}
   (( segid "    " and resid 174  and name HB1 ))
   (( segid "    " and resid 174  and name HG1 ))
 ASSI { 1471}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 153  and name HB1 ))
      4.100     2.100     1.900 peak  1471 spectrum    1 weight  0.10000E+01 volume  0.69470E-03 ppm1      1.536 ppm2      2.233 CV     1
 OR { 1471}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 1472}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 56   and name HB2 ))
      2.300     0.700     0.700 peak  1472 spectrum    1 weight  0.10000E+01 volume  0.66249E-02 ppm1      1.182 ppm2      2.255 CV     1
 OR { 1472}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 156  and name HB1 ))
 OR { 1472}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 53   and name HB1 ))
 ASSI { 1474}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 53   and name HB1 ))
      3.100     1.200     1.200 peak  1474 spectrum    1 weight  0.10000E+01 volume  0.22119E-02 ppm1      0.836 ppm2      2.252 CV     1
 OR { 1474}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 166  and name HB2 ))
 OR { 1474}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1474}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 153  and name HB1 ))
 ASSI { 1477}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 144  and name HB1 ))
      2.500     2.500     3.500 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.28283E-02 ppm1      3.170 ppm2      2.186 CV     1
 OR { 1477}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1477}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI { 1479}
   (( segid "    " and resid 45   and name HE1 ))
   (( segid "    " and resid 44   and name HB1 ))
      2.700     2.700     3.300 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.16434E-02 ppm1      2.878 ppm2      2.185 CV     1
 OR { 1479}
   (( segid "    " and resid 45   and name HE1 ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI { 1481}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 137  and name HB  ))
      2.800     0.900     0.900 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.18968E-02 ppm1      1.802 ppm2      2.207 CV     1
 OR { 1481}
   (( segid "    " and resid 139  and name HB  ))
   (( segid "    " and resid 37   and name HB  ))
 OR { 1481}
   (( segid "    " and resid 39   and name HB  ))
   (( segid "    " and resid 37   and name HB  ))
 ASSI { 1482}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 144  and name HB1 ))
      1.800     1.800     4.200 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.58783E-02 ppm1      1.511 ppm2      2.177 CV     1
 OR { 1482}
   (( segid "    " and resid 173  and name HG2 ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1482}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 144  and name HB2 ))
 ASSI { 1483}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 44   and name HB1 ))
      2.900     1.100     1.100 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.22409E-02 ppm1      1.431 ppm2      2.197 CV     1
 OR { 1483}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 144  and name HB1 ))
 OR { 1483}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 44   and name HB2 ))
 OR { 1483}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 144  and name HB2 ))
 OR { 1483}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 44   and name HB2 ))
 OR { 1483}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 144  and name HB2 ))
 OR { 1483}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 1489}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 148  and name HB2 ))
      6.000     6.000     0.000 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.19460E-04 ppm1      4.438 ppm2      2.159 CV     1
 OR { 1489}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1489}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI { 1490}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 144  and name HB1 ))
      6.000     5.000     0.000 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.19172E-04 ppm1      4.422 ppm2      2.165 CV     1
 OR { 1490}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 1492}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 144  and name HB1 ))
      1.800     0.400     0.400 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.27149E-01 ppm1      4.187 ppm2      2.172 CV     1
 OR { 1492}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1492}
   (( segid "    " and resid 144  and name HA  ))
   (( segid "    " and resid 144  and name HB2 ))
 OR { 1492}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
 ASSI { 1493}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 148  and name HB2 ))
      2.200     0.600     0.600 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.83969E-02 ppm1      3.969 ppm2      2.155 CV     1
 OR { 1493}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1493}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 144  and name HB1 ))
 OR { 1493}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI { 1495}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 44   and name HB2 ))
      2.800     1.000     1.000 peak  1495 spectrum    1 weight  0.10000E+01 volume  0.31271E-02 ppm1      2.842 ppm2      2.154 CV     1
 OR { 1495}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 144  and name HB2 ))
 OR { 1495}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 1496}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 44   and name HB2 ))
      3.000     1.100     1.100 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.32918E-02 ppm1      2.740 ppm2      2.171 CV     1
 OR { 1496}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 144  and name HB2 ))
 OR { 1496}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 1501}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 44   and name HB1 ))
      2.400     2.400     3.600 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.35584E-02 ppm1      1.836 ppm2      2.169 CV     1
 OR { 1501}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 144  and name HB1 ))
 OR { 1501}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 44   and name HB2 ))
 OR { 1501}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 44   and name HB1 ))
 OR { 1501}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI { 1504}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 55   and name HB2 ))
      3.800     1.800     1.800 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.85302E-03 ppm1      1.538 ppm2      2.136 CV     1
 OR { 1504}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 55   and name HB2 ))
 OR { 1504}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 48   and name HB1 ))
 OR { 1504}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 155  and name HB1 ))
 ASSI { 1509}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HB1 ))
      2.300     0.700     0.700 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.40687E-02 ppm1      3.267 ppm2      2.124 CV     1
 OR { 1509}
   (( segid "    " and resid 155  and name HD2 ))
   (( segid "    " and resid 155  and name HB1 ))
 OR { 1509}
   (( segid "    " and resid 55   and name HD2 ))
   (( segid "    " and resid 55   and name HB2 ))
 OR { 1509}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HB2 ))
 ASSI { 1510}
   (( segid "    " and resid 148  and name HG1 ))
   (( segid "    " and resid 148  and name HB2 ))
      2.200     0.600     0.600 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.40094E-02 ppm1      1.668 ppm2      2.123 CV     1
 OR { 1510}
   (( segid "    " and resid 48   and name HG2 ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI { 1511}
   (  segid "    " and resid 161  and name HG2%)
   (( segid "    " and resid 164  and name HB  ))
      5.300     3.500     0.700 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.10772E-03 ppm1      1.262 ppm2      2.115 CV     1
 OR { 1511}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 64   and name HB  ))
 ASSI { 1517}
   (  segid "    " and resid 24   and name HG1%)
   (( segid "    " and resid 24   and name HB  ))
      1.900     0.500     0.500 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.17667E-01 ppm1      0.973 ppm2      2.092 CV     1
 OR { 1517}
   (  segid "    " and resid 125  and name HG1%)
   (( segid "    " and resid 125  and name HB  ))
 OR { 1517}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name HB  ))
 OR { 1517}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
 OR { 1517}
   (  segid "    " and resid 125  and name HG2%)
   (( segid "    " and resid 125  and name HB  ))
 ASSI { 1518}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 64   and name HB  ))
      1.900     1.900     4.100 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.10900E-01 ppm1      0.954 ppm2      2.104 CV     1
 OR { 1518}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 164  and name HB  ))
 ASSI { 1521}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 64   and name HB  ))
      2.600     0.800     0.800 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.47746E-02 ppm1      0.473 ppm2      2.113 CV     1
 OR { 1521}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 164  and name HB  ))
 ASSI { 1523}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HB  ))
      2.400     0.700     0.700 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.52810E-02 ppm1      4.194 ppm2      2.076 CV     1
 OR { 1523}
   (( segid "    " and resid 125  and name HA  ))
   (( segid "    " and resid 125  and name HB  ))
 ASSI { 1528}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HB2 ))
      2.100     0.600     0.600 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.10805E-01 ppm1      3.888 ppm2      2.082 CV     1
 OR { 1528}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
 OR { 1528}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HB1 ))
 OR { 1528}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
 ASSI { 1529}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB1 ))
      2.300     0.700     0.700 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.65242E-02 ppm1      3.867 ppm2      2.058 CV     1
 OR { 1529}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HB1 ))
 ASSI { 1534}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.900     1.900     1.900 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.84457E-03 ppm1      1.479 ppm2      2.070 CV     1
 OR { 1534}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 143  and name HB2 ))
 OR { 1534}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 43   and name HB2 ))
 OR { 1534}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 143  and name HB2 ))
 OR { 1534}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 143  and name HB1 ))
 ASSI { 1535}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.500     1.500     1.500 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.11048E-02 ppm1      1.212 ppm2      2.067 CV     1
 OR { 1535}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 143  and name HB2 ))
 OR { 1535}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 143  and name HB1 ))
 ASSI { 1552}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HB  ))
      1.800     0.400     0.400 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.25603E-01 ppm1      0.951 ppm2      2.067 CV     1
 OR { 1552}
   (  segid "    " and resid 125  and name HG1%)
   (( segid "    " and resid 125  and name HB  ))
 OR { 1552}
   (  segid "    " and resid 25   and name HG1%)
   (( segid "    " and resid 25   and name HB  ))
 OR { 1552}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
 OR { 1552}
   (  segid "    " and resid 125  and name HG2%)
   (( segid "    " and resid 125  and name HB  ))
 ASSI { 1554}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 110  and name HB  ))
      1.800     0.400     0.400 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.26537E-01 ppm1      0.932 ppm2      2.075 CV     1
 OR { 1554}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 124  and name HB  ))
 OR { 1554}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 10   and name HB  ))
 OR { 1554}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 110  and name HB  ))
 OR { 1554}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 24   and name HB  ))
 ASSI { 1559}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HG2 ))
      4.600     2.700     1.400 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.74010E-03 ppm1      4.609 ppm2      2.033 CV     1
 OR { 1559}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HG2 ))
 OR { 1559}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HG1 ))
 OR { 1559}
   (( segid "    " and resid 127  and name HA  ))
   (( segid "    " and resid 128  and name HG1 ))
 ASSI { 1563}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB2 ))
      2.000     0.500     0.500 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.19175E-01 ppm1      3.890 ppm2      2.017 CV     1
 OR { 1563}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 176  and name HB2 ))
 OR { 1563}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 176  and name HB1 ))
 OR { 1563}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI { 1564}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HG  ))
      2.000     0.500     0.500 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.79089E-02 ppm1      3.883 ppm2      2.033 CV     1
 OR { 1564}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HG  ))
 ASSI { 1570}
   (( segid "    " and resid 111  and name HE2 ))
   (( segid "    " and resid 113  and name HB2 ))
      2.100     2.100     3.900 peak  1570 spectrum    1 weight  0.10000E+01 volume  0.27248E-02 ppm1      3.017 ppm2      2.009 CV     1
 OR { 1570}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 111  and name HE2 ))
   (( segid "    " and resid 113  and name HB1 ))
 OR { 1570}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 13   and name HB1 ))
 OR { 1570}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 113  and name HB1 ))
 OR { 1570}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 13   and name HB1 ))
 OR { 1570}
   (( segid "    " and resid 112  and name HE1 ))
   (( segid "    " and resid 113  and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 12   and name HE1 ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1570}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 113  and name HB1 ))
 ASSI { 1572}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 145  and name HB2 ))
      3.400     1.400     1.400 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.26793E-02 ppm1      2.840 ppm2      2.042 CV     1
 OR { 1572}
   (( segid "    " and resid 42   and name HB1 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 1572}
   (( segid "    " and resid 142  and name HB1 ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI { 1573}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 145  and name HB2 ))
      2.900     1.000     1.000 peak  1573 spectrum    1 weight  0.10000E+01 volume  0.27183E-02 ppm1      2.739 ppm2      2.023 CV     1
 OR { 1573}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 45   and name HB2 ))
 OR { 1573}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 1573}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 1579}
   (  segid "    " and resid 152  and name HB% )
   (( segid "    " and resid 72   and name HG  ))
      2.400     2.400     3.600 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.60559E-02 ppm1      1.820 ppm2      2.034 CV     1
 OR { 1579}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 172  and name HG  ))
 OR { 1579}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HB2 ))
 OR { 1579}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HB1 ))
 ASSI { 1580}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 45   and name HB2 ))
      2.200     0.600     0.600 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.59617E-02 ppm1      1.428 ppm2      2.015 CV     1
 OR { 1580}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HB2 ))
 OR { 1580}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 1580}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 45   and name HB1 ))
 OR { 1580}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 1580}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 145  and name HB2 ))
 OR { 1580}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 1581}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 172  and name HG  ))
      1.700     0.400     0.500 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.23761E-01 ppm1      1.059 ppm2      2.022 CV     1
 OR { 1581}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 72   and name HG  ))
 ASSI { 1585}
   (  segid "    " and resid 110  and name HG2%)
   (( segid "    " and resid 110  and name HB  ))
      2.000     0.500     0.500 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.15543E-01 ppm1      0.913 ppm2      2.048 CV     1
 OR { 1585}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HB  ))
 OR { 1585}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 10   and name HB  ))
 OR { 1585}
   (  segid "    " and resid 110  and name HG1%)
   (( segid "    " and resid 110  and name HB  ))
 ASSI { 1587}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 72   and name HG  ))
      1.800     0.400     0.400 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.18407E-01 ppm1      0.877 ppm2      2.028 CV     1
 OR { 1587}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 172  and name HG  ))
 OR { 1587}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 45   and name HB1 ))
 OR { 1587}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 145  and name HB1 ))
 ASSI { 1588}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 67   and name HG  ))
      2.700     2.700     3.300 peak  1588 spectrum    1 weight  0.10000E+01 volume  0.45270E-02 ppm1     -0.196 ppm2      2.018 CV     1
 OR { 1588}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 167  and name HG  ))
 ASSI { 1591}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB1 ))
      2.400     0.700     0.700 peak  1591 spectrum    1 weight  0.10000E+01 volume  0.54264E-02 ppm1      4.520 ppm2      1.985 CV     1
 OR { 1591}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB1 ))
 OR { 1591}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1591}
   (( segid "    " and resid 113  and name HA  ))
   (( segid "    " and resid 113  and name HB2 ))
 ASSI { 1592}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.300     2.300     3.700 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.67533E-02 ppm1      4.494 ppm2      1.994 CV     1
 OR { 1592}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 173  and name HB2 ))
 OR { 1592}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 1592}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 173  and name HB1 ))
 ASSI { 1595}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
      2.100     2.100     3.900 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.18206E-01 ppm1      4.246 ppm2      1.980 CV     1
 OR { 1595}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 173  and name HB1 ))
 OR { 1595}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 173  and name HB2 ))
 OR { 1595}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 1595}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 176  and name HB2 ))
 OR { 1595}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 76   and name HB2 ))
 ASSI { 1598}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 173  and name HB1 ))
      1.800     0.400     0.400 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.23028E-01 ppm1      4.047 ppm2      1.999 CV     1
 OR { 1598}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 1598}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 173  and name HB2 ))
 OR { 1598}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 1599}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      1.900     0.500     0.500 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.13467E-01 ppm1      3.968 ppm2      1.997 CV     1
 OR { 1599}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 1599}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 145  and name HB2 ))
 OR { 1599}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 1601}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 45   and name HB2 ))
      4.600     2.600     1.400 peak  1601 spectrum    1 weight  0.10000E+01 volume  0.44243E-03 ppm1      3.354 ppm2      1.999 CV     1
 OR { 1601}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 145  and name HB2 ))
 OR { 1601}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 145  and name HB1 ))
 OR { 1601}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI { 1605}
   (( segid "    " and resid 66   and name HG1 ))
   (( segid "    " and resid 67   and name HG  ))
      4.900     3.000     1.100 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.44927E-03 ppm1      2.569 ppm2      1.989 CV     1
 OR { 1605}
   (( segid "    " and resid 166  and name HG2 ))
   (( segid "    " and resid 167  and name HG  ))
 ASSI { 1613}
   (( segid "    " and resid 176  and name HG1 ))
   (( segid "    " and resid 176  and name HB2 ))
      1.900     0.500     0.500 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.18006E-01 ppm1      2.298 ppm2      1.999 CV     1
 OR { 1613}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HB2 ))
 OR { 1613}
   (( segid "    " and resid 176  and name HG1 ))
   (( segid "    " and resid 176  and name HB1 ))
 OR { 1613}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 76   and name HB1 ))
 OR { 1613}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HB2 ))
 OR { 1613}
   (( segid "    " and resid 176  and name HG2 ))
   (( segid "    " and resid 176  and name HB2 ))
 OR { 1613}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 76   and name HB1 ))
 ASSI { 1620}
   (( segid "    " and resid 163  and name HB  ))
   (( segid "    " and resid 167  and name HG  ))
      2.800     2.800     3.200 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.25246E-02 ppm1      1.662 ppm2      1.995 CV     1
 OR { 1620}
   (( segid "    " and resid 63   and name HB  ))
   (( segid "    " and resid 67   and name HG  ))
 ASSI { 1622}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 173  and name HB2 ))
      2.000     0.500     0.500 peak  1622 spectrum    1 weight  0.10000E+01 volume  0.13007E-01 ppm1      1.661 ppm2      1.991 CV     1
 OR { 1622}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 1622}
   (( segid "    " and resid 173  and name HG1 ))
   (( segid "    " and resid 173  and name HB1 ))
 OR { 1622}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI { 1624}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HB1 ))
      2.000     0.500     0.500 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.14943E-01 ppm1      1.501 ppm2      1.997 CV     1
 OR { 1624}
   (( segid "    " and resid 173  and name HG2 ))
   (( segid "    " and resid 173  and name HB1 ))
 OR { 1624}
   (( segid "    " and resid 73   and name HG2 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 1624}
   (( segid "    " and resid 173  and name HG2 ))
   (( segid "    " and resid 173  and name HB2 ))
 ASSI { 1627}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 167  and name HG  ))
      1.700     1.700     4.300 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.15137E-01 ppm1      0.567 ppm2      1.985 CV     1
 OR { 1627}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 67   and name HG  ))
 ASSI { 1628}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 148  and name HG2 ))
      3.800     1.800     1.800 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.68854E-03 ppm1      4.438 ppm2      1.949 CV     1
 OR { 1628}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HG1 ))
 OR { 1628}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HB2 ))
 OR { 1628}
   (( segid "    " and resid 147  and name HB  ))
   (( segid "    " and resid 148  and name HB1 ))
 ASSI { 1629}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB1 ))
      2.100     0.500     0.500 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.10658E-01 ppm1      4.432 ppm2      1.939 CV     1
 OR { 1629}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HB2 ))
 ASSI { 1631}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      1.800     0.400     0.400 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.37249E-01 ppm1      4.264 ppm2      1.949 CV     1
 OR { 1631}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 1631}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
 OR { 1631}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HB2 ))
 OR { 1631}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
 OR { 1631}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 1634}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 167  and name HB1 ))
      2.100     0.500     0.500 peak  1634 spectrum    1 weight  0.10000E+01 volume  0.70736E-02 ppm1      4.172 ppm2      1.941 CV     1
 OR { 1634}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR { 1634}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1634}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR { 1634}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 167  and name HB2 ))
 ASSI { 1635}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HG2 ))
      1.700     0.400     0.500 peak  1635 spectrum    1 weight  0.10000E+01 volume  0.33934E-01 ppm1      4.148 ppm2      1.950 CV     1
 OR { 1635}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HG2 ))
 OR { 1635}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1635}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HB1 ))
 OR { 1635}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
 OR { 1635}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 155  and name HB2 ))
 OR { 1635}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HG1 ))
 OR { 1635}
   (( segid "    " and resid 155  and name HA  ))
   (( segid "    " and resid 155  and name HG1 ))
 ASSI { 1637}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 148  and name HB1 ))
      1.900     0.500     0.500 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.15665E-01 ppm1      3.395 ppm2      1.940 CV     1
 OR { 1637}
   (( segid "    " and resid 55   and name HD1 ))
   (( segid "    " and resid 55   and name HG2 ))
 OR { 1637}
   (( segid "    " and resid 155  and name HD1 ))
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1637}
   (( segid "    " and resid 55   and name HD1 ))
   (( segid "    " and resid 55   and name HG1 ))
 OR { 1637}
   (( segid "    " and resid 155  and name HD1 ))
   (( segid "    " and resid 155  and name HG1 ))
 OR { 1637}
   (( segid "    " and resid 148  and name HD2 ))
   (( segid "    " and resid 148  and name HG2 ))
 OR { 1637}
   (( segid "    " and resid 48   and name HD1 ))
   (( segid "    " and resid 48   and name HG1 ))
 ASSI { 1638}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 167  and name HB2 ))
      3.300     1.300     1.300 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.39245E-02 ppm1      3.396 ppm2      1.943 CV     1
 OR { 1638}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR { 1638}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 167  and name HB1 ))
 OR { 1638}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR { 1638}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR { 1638}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1638}
   (( segid "    " and resid 164  and name HA  ))
   (( segid "    " and resid 68   and name HB  ))
 ASSI { 1639}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 167  and name HB1 ))
      2.200     0.600     0.600 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.41949E-02 ppm1      3.288 ppm2      1.929 CV     1
 OR { 1639}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR { 1639}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB  ))
 OR { 1639}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 168  and name HB  ))
 OR { 1639}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1639}
   (( segid "    " and resid 168  and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI { 1640}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HG2 ))
      2.000     0.500     0.500 peak  1640 spectrum    1 weight  0.10000E+01 volume  0.11312E-01 ppm1      3.268 ppm2      1.940 CV     1
 OR { 1640}
   (( segid "    " and resid 155  and name HD2 ))
   (( segid "    " and resid 155  and name HG1 ))
 OR { 1640}
   (( segid "    " and resid 55   and name HD2 ))
   (( segid "    " and resid 55   and name HG1 ))
 OR { 1640}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HG1 ))
 OR { 1640}
   (( segid "    " and resid 155  and name HD2 ))
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1640}
   (( segid "    " and resid 55   and name HD2 ))
   (( segid "    " and resid 55   and name HG2 ))
 OR { 1640}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HB1 ))
 OR { 1640}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HB2 ))
 ASSI { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
      6.000     6.000     0.000 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.19734E-04 ppm1      2.677 ppm2      1.946 CV     1
 OR { 1642}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 173  and name HB2 ))
 OR { 1642}
   (( segid "    " and resid 165  and name HB2 ))
   (( segid "    " and resid 168  and name HB  ))
 OR { 1642}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 68   and name HB  ))
 OR { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 68   and name HB  ))
 OR { 1642}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 168  and name HB  ))
 OR { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 1642}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 173  and name HB1 ))
 OR { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 67   and name HB2 ))
 OR { 1642}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 167  and name HB1 ))
 OR { 1642}
   (( segid "    " and resid 169  and name HB1 ))
   (( segid "    " and resid 67   and name HB1 ))
 OR { 1642}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI { 1644}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 156  and name HB2 ))
      1.800     0.400     0.400 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.13227E-01 ppm1      2.265 ppm2      1.923 CV     1
 OR { 1644}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HB1 ))
 OR { 1644}
   (( segid "    " and resid 117  and name HG1 ))
   (( segid "    " and resid 117  and name HB2 ))
 OR { 1644}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HB2 ))
 OR { 1644}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 1644}
   (( segid "    " and resid 117  and name HG1 ))
   (( segid "    " and resid 117  and name HB1 ))
 OR { 1644}
   (( segid "    " and resid 117  and name HG2 ))
   (( segid "    " and resid 117  and name HB2 ))
 OR { 1644}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 1646}
   (( segid "    " and resid 148  and name HB2 ))
   (( segid "    " and resid 148  and name HB1 ))
      1.500     0.300     0.700 peak  1646 spectrum    1 weight  0.10000E+01 volume  0.18102E-01 ppm1      2.108 ppm2      1.942 CV     1
 OR { 1646}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HB2 ))
 OR { 1646}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HG1 ))
 ASSI { 1653}
   (  segid "    " and resid 168  and name HG1%)
   (( segid "    " and resid 168  and name HB  ))
      1.900     0.500     0.500 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.14646E-01 ppm1      0.053 ppm2      1.929 CV     1
 OR { 1653}
   (  segid "    " and resid 68   and name HG1%)
   (( segid "    " and resid 68   and name HB  ))
 ASSI { 1657}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 156  and name HB2 ))
      6.000     5.200     0.000 peak  1657 spectrum    1 weight  0.10000E+01 volume  0.39398E-04 ppm1      4.246 ppm2      1.902 CV     1
 OR { 1657}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1657}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HG2 ))
 OR { 1657}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 155  and name HG1 ))
 OR { 1657}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HG1 ))
 ASSI { 1659}
   (( segid "    " and resid 165  and name HA  ))
   (( segid "    " and resid 168  and name HB  ))
      2.300     2.300     3.700 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.68995E-02 ppm1      3.915 ppm2      1.920 CV     1
 OR { 1659}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 68   and name HB  ))
 ASSI { 1666}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 155  and name HG1 ))
      2.900     1.000     1.000 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.25770E-02 ppm1      1.540 ppm2      1.907 CV     1
 OR { 1666}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 55   and name HG1 ))
 OR { 1666}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 155  and name HG1 ))
 OR { 1666}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 55   and name HG1 ))
 OR { 1666}
   (  segid "    " and resid 154  and name HB% )
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1666}
   (  segid "    " and resid 54   and name HB% )
   (( segid "    " and resid 55   and name HG2 ))
 OR { 1666}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 148  and name HB1 ))
 OR { 1666}
   (  segid "    " and resid 151  and name HB% )
   (( segid "    " and resid 155  and name HG2 ))
 OR { 1666}
   (  segid "    " and resid 51   and name HB% )
   (( segid "    " and resid 55   and name HG2 ))
 ASSI { 1668}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 168  and name HB  ))
      2.000     0.500     0.500 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.13163E-01 ppm1      0.614 ppm2      1.921 CV     1
 OR { 1668}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 68   and name HB  ))
 OR { 1668}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 167  and name HB1 ))
 ASSI { 1670}
   (( segid "    " and resid 153  and name HA  ))
   (  segid "    " and resid 152  and name HB% )
      2.600     2.600     3.400 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.59951E-02 ppm1      3.977 ppm2      1.854 CV     1
 OR { 1670}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 52   and name HB% )
 ASSI { 1685}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HB2 ))
      3.300     3.300     2.700 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.30950E-02 ppm1      0.955 ppm2      1.878 CV     1
 OR { 1685}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1685}
   (  segid "    " and resid 64   and name HG1%)
   (( segid "    " and resid 67   and name HB1 ))
 OR { 1685}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 167  and name HB2 ))
 OR { 1685}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 167  and name HB1 ))
 ASSI { 1690}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.300     0.700     0.700 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.50382E-02 ppm1      4.593 ppm2      1.827 CV     1
 OR { 1690}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB1 ))
 OR { 1690}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
 OR { 1690}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HB2 ))
 ASSI { 1691}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HB2 ))
      3.900     1.900     1.900 peak  1691 spectrum    1 weight  0.10000E+01 volume  0.77389E-03 ppm1      4.531 ppm2      1.815 CV     1
 OR { 1691}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
 OR { 1691}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR { 1691}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 136  and name HB1 ))
 ASSI { 1696}
   (( segid "    " and resid 152  and name HA  ))
   (  segid "    " and resid 152  and name HB% )
      1.800     0.400     0.400 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.20494E-01 ppm1      4.309 ppm2      1.834 CV     1
 OR { 1696}
   (( segid "    " and resid 52   and name HA  ))
   (  segid "    " and resid 52   and name HB% )
 ASSI { 1698}
   (( segid "    " and resid 171  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
      2.700     0.900     0.900 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.24512E-02 ppm1      4.196 ppm2      1.809 CV     1
 OR { 1698}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI { 1700}
   (( segid "    " and resid 76   and name HA  ))
   (  segid "    " and resid 152  and name HB% )
      2.400     2.400     3.600 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.91912E-02 ppm1      3.889 ppm2      1.817 CV     1
 OR { 1700}
   (( segid "    " and resid 176  and name HA  ))
   (  segid "    " and resid 52   and name HB% )
 ASSI { 1702}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HB2 ))
      2.000     0.500     0.500 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.14838E-01 ppm1      3.196 ppm2      1.811 CV     1
 OR { 1702}
   (( segid "    " and resid 19   and name HD1 ))
   (( segid "    " and resid 19   and name HB1 ))
 OR { 1702}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HB2 ))
 OR { 1702}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HB1 ))
 OR { 1702}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HB1 ))
 OR { 1702}
   (( segid "    " and resid 19   and name HD2 ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI { 1704}
   (( segid "    " and resid 36   and name HD2 ))
   (( segid "    " and resid 36   and name HB1 ))
      2.600     0.800     0.800 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.37592E-02 ppm1      3.094 ppm2      1.823 CV     1
 OR { 1704}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HB1 ))
 OR { 1704}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HB2 ))
 OR { 1704}
   (( segid "    " and resid 36   and name HD2 ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 1705}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD1 ))
      2.100     0.500     0.500 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.96754E-02 ppm1      2.880 ppm2      1.823 CV     1
 OR { 1705}
   (( segid "    " and resid 45   and name HE1 ))
   (( segid "    " and resid 45   and name HD1 ))
 OR { 1705}
   (( segid "    " and resid 145  and name HE2 ))
   (( segid "    " and resid 145  and name HD2 ))
 OR { 1705}
   (( segid "    " and resid 45   and name HE1 ))
   (( segid "    " and resid 45   and name HD2 ))
 ASSI { 1708}
   (( segid "    " and resid 137  and name HB  ))
   (( segid "    " and resid 39   and name HB  ))
      2.800     1.000     1.000 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.20521E-02 ppm1      2.220 ppm2      1.812 CV     1
 OR { 1708}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 139  and name HB  ))
 OR { 1708}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 36   and name HB2 ))
 OR { 1708}
   (( segid "    " and resid 37   and name HB  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1716}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 145  and name HD2 ))
      2.100     2.100     3.900 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.17165E-01 ppm1      1.059 ppm2      1.822 CV     1
 OR { 1716}
   (  segid "    " and resid 72   and name HD2%)
   (  segid "    " and resid 152  and name HB% )
 OR { 1716}
   (  segid "    " and resid 172  and name HD2%)
   (  segid "    " and resid 52   and name HB% )
 OR { 1716}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 145  and name HD1 ))
 ASSI { 1717}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 39   and name HB  ))
      3.100     1.200     1.200 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.37014E-02 ppm1      0.825 ppm2      1.814 CV     1
 OR { 1717}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 139  and name HB  ))
 OR { 1717}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 139  and name HB  ))
 OR { 1717}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1719}
   (  segid "    " and resid 139  and name HG1%)
   (( segid "    " and resid 139  and name HB  ))
      1.800     1.800     4.200 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.15457E-01 ppm1      0.774 ppm2      1.805 CV     1
 OR { 1719}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1720}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HB2 ))
      3.600     1.600     1.600 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.81133E-03 ppm1      0.658 ppm2      1.810 CV     1
 OR { 1720}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 39   and name HB  ))
 OR { 1720}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 139  and name HB  ))
 OR { 1720}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 36   and name HB1 ))
 OR { 1720}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 139  and name HB  ))
 OR { 1720}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1722}
   (  segid "    " and resid 139  and name HG2%)
   (( segid "    " and resid 139  and name HB  ))
      1.900     1.900     4.100 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.11985E-01 ppm1      0.474 ppm2      1.806 CV     1
 OR { 1722}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1728}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      1.800     0.400     0.400 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.33957E-01 ppm1      4.305 ppm2      1.779 CV     1
 OR { 1728}
   (( segid "    " and resid 123  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 1728}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
 OR { 1728}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB2 ))
 OR { 1728}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
 OR { 1728}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HB1 ))
 OR { 1728}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI { 1732}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.100     0.500     0.500 peak  1732 spectrum    1 weight  0.10000E+01 volume  0.17232E-01 ppm1      4.256 ppm2      1.793 CV     1
 OR { 1732}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
 OR { 1732}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
 ASSI { 1733}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 52   and name HB% )
      6.000     4.500     0.000 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.80851E-04 ppm1      4.236 ppm2      1.789 CV     1
 OR { 1733}
   (( segid "    " and resid 151  and name HA  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI { 1734}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 73   and name HD2 ))
      2.200     2.200     3.800 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.14731E-01 ppm1      4.167 ppm2      1.774 CV     1
 OR { 1734}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 173  and name HD2 ))
 OR { 1734}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 73   and name HD1 ))
 OR { 1734}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1734}
   (( segid "    " and resid 166  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
 OR { 1734}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 139  and name HB  ))
 OR { 1734}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 173  and name HD2 ))
 ASSI { 1739}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 139  and name HB  ))
      5.800     4.100     0.200 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.12899E-03 ppm1      3.838 ppm2      1.776 CV     1
 OR { 1739}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1740}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 73   and name HD2 ))
      2.000     2.000     4.000 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.18448E-01 ppm1      3.150 ppm2      1.763 CV     1
 OR { 1740}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 173  and name HD2 ))
 OR { 1740}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 173  and name HD1 ))
 ASSI { 1746}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 33   and name HB1 ))
      2.200     2.200     3.800 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.14106E-01 ppm1      2.305 ppm2      1.785 CV     1
 OR { 1746}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 133  and name HB1 ))
 OR { 1746}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 33   and name HB2 ))
 OR { 1746}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 33   and name HB1 ))
 OR { 1746}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR { 1746}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 133  and name HB1 ))
 OR { 1746}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 133  and name HB2 ))
 ASSI { 1752}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 33   and name HB2 ))
      3.600     1.600     1.600 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.88438E-03 ppm1      2.086 ppm2      1.791 CV     1
 OR { 1752}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 133  and name HB2 ))
 OR { 1752}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 33   and name HB2 ))
 OR { 1752}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 133  and name HB2 ))
 ASSI { 1753}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 12   and name HB1 ))
      3.200     1.200     1.200 peak  1753 spectrum    1 weight  0.10000E+01 volume  0.23582E-03 ppm1      2.001 ppm2      1.767 CV     1
 OR { 1753}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 1753}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 12   and name HB2 ))
 OR { 1753}
   (( segid "    " and resid 113  and name HB2 ))
   (( segid "    " and resid 112  and name HB2 ))
 OR { 1753}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 11   and name HB1 ))
 OR { 1753}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 12   and name HB1 ))
 OR { 1753}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 1753}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 12   and name HB2 ))
 OR { 1753}
   (( segid "    " and resid 113  and name HB1 ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 1755}
   (( segid "    " and resid 72   and name HG  ))
   (  segid "    " and resid 152  and name HB% )
      2.200     2.200     3.800 peak  1755 spectrum    1 weight  0.10000E+01 volume  0.15531E-01 ppm1      1.977 ppm2      1.786 CV     1
 OR { 1755}
   (( segid "    " and resid 172  and name HG  ))
   (  segid "    " and resid 52   and name HB% )
 OR { 1755}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 45   and name HD2 ))
 OR { 1755}
   (( segid "    " and resid 172  and name HG  ))
   (( segid "    " and resid 45   and name HD1 ))
 OR { 1755}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 145  and name HD2 ))
 OR { 1755}
   (( segid "    " and resid 72   and name HG  ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI { 1756}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HD1 ))
      2.700     0.900     0.900 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.25364E-02 ppm1      1.949 ppm2      1.773 CV     1
 OR { 1756}
   (( segid "    " and resid 173  and name HB2 ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1756}
   (( segid "    " and resid 173  and name HB1 ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1756}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HD1 ))
 OR { 1756}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HD2 ))
 OR { 1756}
   (( segid "    " and resid 173  and name HB2 ))
   (( segid "    " and resid 173  and name HD2 ))
 OR { 1756}
   (( segid "    " and resid 173  and name HB1 ))
   (( segid "    " and resid 173  and name HD2 ))
 ASSI { 1757}
   (( segid "    " and resid 148  and name HB1 ))
   (  segid "    " and resid 152  and name HB% )
      1.600     1.600     4.400 peak  1757 spectrum    1 weight  0.10000E+01 volume  0.75927E-01 ppm1      1.941 ppm2      1.795 CV     1
 OR { 1757}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 145  and name HD1 ))
 OR { 1757}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 45   and name HD1 ))
 OR { 1757}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 52   and name HB% )
 OR { 1757}
   (( segid "    " and resid 68   and name HB  ))
   (( segid "    " and resid 145  and name HD2 ))
 OR { 1757}
   (( segid "    " and resid 168  and name HB  ))
   (( segid "    " and resid 45   and name HD2 ))
 ASSI { 1763}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HB1 ))
      1.700     0.400     0.500 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.33972E-01 ppm1      1.413 ppm2      1.761 CV     1
 OR { 1763}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 112  and name HB1 ))
 OR { 1763}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HB1 ))
 OR { 1763}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HB2 ))
 OR { 1763}
   (( segid "    " and resid 112  and name HG2 ))
   (( segid "    " and resid 112  and name HB2 ))
 ASSI { 1766}
   (( segid "    " and resid 134  and name HG11))
   (( segid "    " and resid 134  and name HB  ))
      2.400     0.700     0.700 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.59484E-02 ppm1      1.213 ppm2      1.759 CV     1
 OR { 1766}
   (( segid "    " and resid 34   and name HG12))
   (( segid "    " and resid 34   and name HB  ))
 ASSI { 1768}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 174  and name HB2 ))
      2.400     2.400     3.600 peak  1768 spectrum    1 weight  0.10000E+01 volume  0.49774E-02 ppm1      4.494 ppm2      1.735 CV     1
 OR { 1768}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 74   and name HB2 ))
 OR { 1768}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HD1 ))
 OR { 1768}
   (( segid "    " and resid 170  and name HA  ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1768}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HD2 ))
 ASSI { 1769}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HG2 ))
      1.900     0.400     0.400 peak  1769 spectrum    1 weight  0.10000E+01 volume  0.22417E-01 ppm1      4.431 ppm2      1.731 CV     1
 OR { 1769}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG2 ))
 OR { 1769}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HG1 ))
 OR { 1769}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HG1 ))
 ASSI { 1773}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 111  and name HB2 ))
      6.000     5.700     0.000 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.20492E-04 ppm1      4.121 ppm2      1.736 CV     1
 OR { 1773}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
 OR { 1773}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 123  and name HB1 ))
 OR { 1773}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HB1 ))
 OR { 1773}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HD1 ))
 OR { 1773}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 111  and name HD1 ))
 OR { 1773}
   (( segid "    " and resid 110  and name HA  ))
   (( segid "    " and resid 111  and name HD2 ))
 OR { 1773}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 1779}
   (( segid "    " and resid 33   and name HE1 ))
   (( segid "    " and resid 33   and name HD2 ))
      1.600     0.300     0.600 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.56325E-01 ppm1      3.016 ppm2      1.721 CV     1
 OR { 1779}
   (( segid "    " and resid 133  and name HE1 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 111  and name HE2 ))
   (( segid "    " and resid 111  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 11   and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 111  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 11   and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 112  and name HE1 ))
   (( segid "    " and resid 112  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 12   and name HE1 ))
   (( segid "    " and resid 12   and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 112  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 112  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 12   and name HE2 ))
   (( segid "    " and resid 12   and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 12   and name HE1 ))
   (( segid "    " and resid 12   and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 112  and name HE1 ))
   (( segid "    " and resid 112  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 33   and name HE2 ))
   (( segid "    " and resid 33   and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 133  and name HE2 ))
   (( segid "    " and resid 133  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 33   and name HE1 ))
   (( segid "    " and resid 33   and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 133  and name HE1 ))
   (( segid "    " and resid 133  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 111  and name HE2 ))
   (( segid "    " and resid 111  and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 11   and name HD2 ))
 OR { 1779}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 111  and name HD1 ))
 OR { 1779}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 11   and name HD1 ))
 ASSI { 1780}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HG1 ))
      1.900     0.500     0.500 peak  1780 spectrum    1 weight  0.10000E+01 volume  0.14676E-01 ppm1      2.267 ppm2      1.716 CV     1
 OR { 1780}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 156  and name HG1 ))
 OR { 1780}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HG2 ))
 OR { 1780}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 156  and name HG2 ))
 ASSI { 1781}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 23   and name HB2 ))
      4.600     2.600     1.400 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.25860E-03 ppm1      2.049 ppm2      1.729 CV     1
 OR { 1781}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 123  and name HB2 ))
 OR { 1781}
   (( segid "    " and resid 22   and name HB1 ))
   (( segid "    " and resid 23   and name HB1 ))
 OR { 1781}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI { 1783}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 73   and name HD2 ))
      2.000     2.000     4.000 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.20881E-01 ppm1      1.998 ppm2      1.733 CV     1
 OR { 1783}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 173  and name HD2 ))
 OR { 1783}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 73   and name HD2 ))
 OR { 1783}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 173  and name HD2 ))
 OR { 1783}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 134  and name HB  ))
 OR { 1783}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1783}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 173  and name HD1 ))
 OR { 1783}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 134  and name HB  ))
 ASSI { 1784}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HB2 ))
      6.000     4.800     0.000 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.41694E-04 ppm1      1.945 ppm2      1.721 CV     1
 OR { 1784}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HB2 ))
 OR { 1784}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HB2 ))
 OR { 1784}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HB2 ))
 OR { 1784}
   (( segid "    " and resid 104  and name HB1 ))
   (( segid "    " and resid 105  and name HB1 ))
 OR { 1784}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HB1 ))
 OR { 1784}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HB1 ))
 OR { 1784}
   (( segid "    " and resid 104  and name HB2 ))
   (( segid "    " and resid 105  and name HB1 ))
 OR { 1784}
   (( segid "    " and resid 22   and name HB2 ))
   (( segid "    " and resid 23   and name HB2 ))
 OR { 1784}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 123  and name HB2 ))
 ASSI { 1788}
   (( segid "    " and resid 34   and name HG11))
   (( segid "    " and resid 34   and name HB  ))
      2.300     0.600     0.600 peak  1788 spectrum    1 weight  0.10000E+01 volume  0.72956E-02 ppm1      1.420 ppm2      1.749 CV     1
 OR { 1788}
   (( segid "    " and resid 134  and name HG12))
   (( segid "    " and resid 134  and name HB  ))
 ASSI { 1793}
   (  segid "    " and resid 158  and name HG2%)
   (( segid "    " and resid 156  and name HG1 ))
      2.800     2.800     3.200 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.52485E-02 ppm1      1.184 ppm2      1.723 CV     1
 OR { 1793}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 56   and name HG1 ))
 OR { 1793}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 56   and name HG2 ))
 ASSI { 1795}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HB  ))
      2.300     0.600     0.600 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.68933E-02 ppm1      0.736 ppm2      1.753 CV     1
 OR { 1795}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 134  and name HB  ))
 ASSI { 1797}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 134  and name HB  ))
      1.900     0.400     0.400 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.17561E-01 ppm1      0.716 ppm2      1.752 CV     1
 OR { 1797}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 34   and name HB  ))
 ASSI { 1800}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HG1 ))
      2.500     0.800     0.800 peak  1800 spectrum    1 weight  0.10000E+01 volume  0.70892E-02 ppm1      4.049 ppm2      1.690 CV     1
 OR { 1800}
   (( segid "    " and resid 173  and name HA  ))
   (( segid "    " and resid 173  and name HG1 ))
 ASSI { 1808}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 150  and name HB2 ))
      4.400     2.400     1.600 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.32245E-03 ppm1      2.976 ppm2      1.688 CV     1
 OR { 1808}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 50   and name HB2 ))
 OR { 1808}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 148  and name HG1 ))
 ASSI { 1825}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HG2 ))
      2.000     0.500     0.500 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.15910E-01 ppm1      4.147 ppm2      1.657 CV     1
 OR { 1825}
   (( segid "    " and resid 148  and name HA  ))
   (( segid "    " and resid 148  and name HG1 ))
 ASSI { 1826}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 60   and name HB  ))
      4.900     3.000     1.100 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.34092E-03 ppm1      4.085 ppm2      1.642 CV     1
 OR { 1826}
   (( segid "    " and resid 161  and name HB  ))
   (( segid "    " and resid 160  and name HB  ))
 OR { 1826}
   (( segid "    " and resid 161  and name HB  ))
   (( segid "    " and resid 163  and name HB  ))
 ASSI { 1827}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 163  and name HB  ))
      4.300     2.300     1.700 peak  1827 spectrum    1 weight  0.10000E+01 volume  0.42155E-03 ppm1      3.842 ppm2      1.638 CV     1
 OR { 1827}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
 OR { 1827}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name HB  ))
 OR { 1827}
   (( segid "    " and resid 161  and name HA  ))
   (( segid "    " and resid 160  and name HB  ))
 ASSI { 1828}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
      2.300     0.700     0.700 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.48979E-02 ppm1      3.653 ppm2      1.634 CV     1
 OR { 1828}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 150  and name HB2 ))
 ASSI { 1830}
   (( segid "    " and resid 163  and name HA  ))
   (( segid "    " and resid 163  and name HB  ))
      2.600     0.800     0.800 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.31500E-02 ppm1      3.520 ppm2      1.655 CV     1
 OR { 1830}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
 ASSI { 1831}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HB2 ))
      2.600     0.900     0.900 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.48336E-02 ppm1      3.449 ppm2      1.649 CV     1
 OR { 1831}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB2 ))
 ASSI { 1834}
   (( segid "    " and resid 48   and name HD2 ))
   (( segid "    " and resid 48   and name HG2 ))
      2.300     0.700     0.700 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.80983E-02 ppm1      3.264 ppm2      1.659 CV     1
 OR { 1834}
   (( segid "    " and resid 148  and name HD1 ))
   (( segid "    " and resid 148  and name HG1 ))
 ASSI { 1835}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB  ))
      2.300     0.600     0.600 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.53042E-02 ppm1      3.147 ppm2      1.642 CV     1
 OR { 1835}
   (( segid "    " and resid 160  and name HA  ))
   (( segid "    " and resid 160  and name HB  ))
 OR { 1835}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
 ASSI { 1836}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 156  and name HG2 ))
      2.200     2.200     3.800 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.79750E-02 ppm1      2.120 ppm2      1.658 CV     1
 OR { 1836}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HG2 ))
 OR { 1836}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 56   and name HG1 ))
 OR { 1836}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 156  and name HG1 ))
 OR { 1836}
   (( segid "    " and resid 164  and name HB  ))
   (( segid "    " and resid 163  and name HB  ))
 ASSI { 1839}
   (( segid "    " and resid 48   and name HG1 ))
   (( segid "    " and resid 48   and name HG2 ))
      1.500     0.300     0.700 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.22421E-01 ppm1      1.919 ppm2      1.657 CV     1
 OR { 1839}
   (( segid "    " and resid 148  and name HG2 ))
   (( segid "    " and resid 148  and name HG1 ))
 ASSI { 1847}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HB2 ))
      1.500     0.300     0.700 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.18381E-01 ppm1      1.398 ppm2      1.643 CV     1
 OR { 1847}
   (( segid "    " and resid 150  and name HB1 ))
   (( segid "    " and resid 150  and name HB2 ))
 ASSI { 1861}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HB  ))
      2.000     0.500     0.500 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.10823E-01 ppm1      0.837 ppm2      1.653 CV     1
 OR { 1861}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 163  and name HB  ))
 ASSI { 1863}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HB  ))
      2.300     0.700     0.700 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.46125E-02 ppm1      0.630 ppm2      1.638 CV     1
 OR { 1863}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 160  and name HB  ))
 ASSI { 1865}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 163  and name HB  ))
      2.100     0.600     0.600 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.76561E-02 ppm1     -0.196 ppm2      1.648 CV     1
 OR { 1865}
   (  segid "    " and resid 63   and name HG1%)
   (( segid "    " and resid 63   and name HB  ))
 ASSI { 1866}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HG2 ))
      2.200     0.600     0.600 peak  1866 spectrum    1 weight  0.10000E+01 volume  0.10599E-01 ppm1      4.593 ppm2      1.623 CV     1
 OR { 1866}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 1866}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 136  and name HG1 ))
 OR { 1866}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HG1 ))
 ASSI { 1867}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG1 ))
      2.100     0.600     0.600 peak  1867 spectrum    1 weight  0.10000E+01 volume  0.93544E-02 ppm1      4.339 ppm2      1.612 CV     1
 OR { 1867}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HG1 ))
 OR { 1867}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
 OR { 1867}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HG2 ))
 ASSI { 1868}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB1 ))
      1.800     0.400     0.400 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.28688E-01 ppm1      4.279 ppm2      1.626 CV     1
 OR { 1868}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB1 ))
 OR { 1868}
   (( segid "    " and resid 121  and name HA  ))
   (( segid "    " and resid 121  and name HB2 ))
 OR { 1868}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1869}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 63   and name HB  ))
      3.200     3.200     2.800 peak  1869 spectrum    1 weight  0.10000E+01 volume  0.49542E-02 ppm1      4.173 ppm2      1.604 CV     1
 OR { 1869}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 163  and name HB  ))
 OR { 1869}
   (( segid "    " and resid 167  and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1869}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1872}
   (( segid "    " and resid 19   and name HD2 ))
   (( segid "    " and resid 19   and name HG1 ))
      1.700     0.400     0.500 peak  1872 spectrum    1 weight  0.10000E+01 volume  0.30851E-01 ppm1      3.183 ppm2      1.608 CV     1
 OR { 1872}
   (( segid "    " and resid 119  and name HD2 ))
   (( segid "    " and resid 119  and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 23   and name HD1 ))
   (( segid "    " and resid 23   and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 136  and name HD1 ))
   (( segid "    " and resid 136  and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 36   and name HD1 ))
   (( segid "    " and resid 36   and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 23   and name HD2 ))
   (( segid "    " and resid 23   and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 123  and name HD2 ))
   (( segid "    " and resid 123  and name HG2 ))
 OR { 1872}
   (( segid "    " and resid 23   and name HD1 ))
   (( segid "    " and resid 23   and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 123  and name HD1 ))
   (( segid "    " and resid 123  and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 19   and name HD1 ))
   (( segid "    " and resid 19   and name HG1 ))
 OR { 1872}
   (( segid "    " and resid 119  and name HD1 ))
   (( segid "    " and resid 119  and name HG1 ))
 ASSI { 1875}
   (( segid "    " and resid 36   and name HD2 ))
   (( segid "    " and resid 36   and name HG1 ))
      2.000     0.500     0.500 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.15893E-01 ppm1      3.093 ppm2      1.613 CV     1
 OR { 1875}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HG1 ))
 OR { 1875}
   (( segid "    " and resid 136  and name HD2 ))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 1875}
   (( segid "    " and resid 36   and name HD2 ))
   (( segid "    " and resid 36   and name HG2 ))
 ASSI { 1877}
   (( segid "    " and resid 167  and name HB1 ))
   (( segid "    " and resid 72   and name HB2 ))
      3.000     3.000     3.000 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.57520E-02 ppm1      1.917 ppm2      1.597 CV     1
 OR { 1877}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 172  and name HB2 ))
 OR { 1877}
   (( segid "    " and resid 167  and name HB2 ))
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1877}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1879}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HG2 ))
      1.500     0.300     0.700 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.79536E-01 ppm1      1.836 ppm2      1.614 CV     1
 OR { 1879}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HG1 ))
 OR { 1879}
   (( segid "    " and resid 119  and name HB2 ))
   (( segid "    " and resid 119  and name HG2 ))
 OR { 1879}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HG1 ))
 ASSI { 1887}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 172  and name HB2 ))
      2.500     2.500     3.500 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.80977E-02 ppm1      1.079 ppm2      1.600 CV     1
 OR { 1887}
   (  segid "    " and resid 167  and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1888}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HB1 ))
      3.000     1.100     1.100 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.18143E-02 ppm1      0.920 ppm2      1.629 CV     1
 OR { 1888}
   (  segid "    " and resid 21   and name HD2%)
   (( segid "    " and resid 21   and name HB1 ))
 OR { 1888}
   (  segid "    " and resid 121  and name HD2%)
   (( segid "    " and resid 121  and name HB2 ))
 OR { 1888}
   (  segid "    " and resid 21   and name HD2%)
   (( segid "    " and resid 21   and name HB2 ))
 ASSI { 1890}
   (  segid "    " and resid 21   and name HD1%)
   (( segid "    " and resid 21   and name HB2 ))
      2.500     0.800     0.800 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.49366E-02 ppm1      0.864 ppm2      1.627 CV     1
 OR { 1890}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HB2 ))
 OR { 1890}
   (  segid "    " and resid 21   and name HD1%)
   (( segid "    " and resid 21   and name HB1 ))
 OR { 1890}
   (  segid "    " and resid 121  and name HD1%)
   (( segid "    " and resid 121  and name HB1 ))
 ASSI { 1891}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 163  and name HB  ))
      2.400     2.400     3.600 peak  1891 spectrum    1 weight  0.10000E+01 volume  0.68164E-02 ppm1      0.566 ppm2      1.607 CV     1
 OR { 1891}
   (  segid "    " and resid 167  and name HD2%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1891}
   (  segid "    " and resid 67   and name HD1%)
   (( segid "    " and resid 63   and name HB  ))
 ASSI { 1892}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 160  and name HB  ))
      1.900     1.900     4.100 peak  1892 spectrum    1 weight  0.10000E+01 volume  0.11914E-01 ppm1      0.514 ppm2      1.628 CV     1
 OR { 1892}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HB  ))
 ASSI { 1894}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.900     1.900     1.900 peak  1894 spectrum    1 weight  0.10000E+01 volume  0.41392E-03 ppm1      4.390 ppm2      1.582 CV     1
 OR { 1894}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1896}
   (( segid "    " and resid 154  and name HA  ))
   (  segid "    " and resid 154  and name HB% )
      1.600     0.300     0.600 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.69623E-01 ppm1      4.228 ppm2      1.550 CV     1
 OR { 1896}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HB% )
 OR { 1896}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 51   and name HB% )
 OR { 1896}
   (( segid "    " and resid 151  and name HA  ))
   (  segid "    " and resid 151  and name HB% )
 ASSI { 1898}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 151  and name HB% )
      2.100     2.100     3.900 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.12758E-01 ppm1      4.166 ppm2      1.563 CV     1
 OR { 1898}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 51   and name HB% )
 ASSI { 1899}
   (( segid "    " and resid 172  and name HA  ))
   (( segid "    " and resid 172  and name HB2 ))
      2.200     0.600     0.600 peak  1899 spectrum    1 weight  0.10000E+01 volume  0.53242E-02 ppm1      3.873 ppm2      1.579 CV     1
 OR { 1899}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1900}
   (( segid "    " and resid 150  and name HE1 ))
   (( segid "    " and resid 150  and name HD2 ))
      2.100     0.600     0.600 peak  1900 spectrum    1 weight  0.10000E+01 volume  0.87969E-02 ppm1      2.938 ppm2      1.548 CV     1
 OR { 1900}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR { 1900}
   (( segid "    " and resid 150  and name HE1 ))
   (( segid "    " and resid 150  and name HD1 ))
 OR { 1900}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HD1 ))
 ASSI { 1902}
   (( segid "    " and resid 50   and name HE2 ))
   (( segid "    " and resid 50   and name HD1 ))
      1.900     0.500     0.500 peak  1902 spectrum    1 weight  0.10000E+01 volume  0.17271E-01 ppm1      2.848 ppm2      1.546 CV     1
 OR { 1902}
   (( segid "    " and resid 150  and name HE2 ))
   (( segid "    " and resid 150  and name HD1 ))
 OR { 1902}
   (( segid "    " and resid 150  and name HE2 ))
   (( segid "    " and resid 150  and name HD2 ))
 OR { 1902}
   (( segid "    " and resid 50   and name HE2 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 1904}
   (( segid "    " and resid 76   and name HG2 ))
   (  segid "    " and resid 151  and name HB% )
      3.500     1.500     1.500 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.51771E-03 ppm1      2.299 ppm2      1.557 CV     1
 OR { 1904}
   (( segid "    " and resid 76   and name HG1 ))
   (  segid "    " and resid 151  and name HB% )
 OR { 1904}
   (( segid "    " and resid 76   and name HG1 ))
   (( segid "    " and resid 72   and name HB2 ))
 OR { 1904}
   (( segid "    " and resid 76   and name HG2 ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1905}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 72   and name HB2 ))
      1.600     0.300     0.600 peak  1905 spectrum    1 weight  0.10000E+01 volume  0.11829E-01 ppm1      2.087 ppm2      1.572 CV     1
 OR { 1905}
   (( segid "    " and resid 172  and name HB1 ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1911}
   (  segid "    " and resid 172  and name HD2%)
   (( segid "    " and resid 172  and name HB2 ))
      2.500     0.800     0.800 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.82037E-02 ppm1      1.058 ppm2      1.570 CV     1
 OR { 1911}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1912}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 123  and name HG2 ))
      4.700     2.700     1.300 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.21805E-04 ppm1      0.935 ppm2      1.577 CV     1
 OR { 1912}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 23   and name HG1 ))
 OR { 1912}
   (  segid "    " and resid 24   and name HG2%)
   (( segid "    " and resid 23   and name HG2 ))
 OR { 1912}
   (  segid "    " and resid 124  and name HG1%)
   (( segid "    " and resid 123  and name HG1 ))
 ASSI { 1914}
   (  segid "    " and resid 72   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
      1.900     1.900     4.100 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.91800E-02 ppm1      0.877 ppm2      1.561 CV     1
 OR { 1914}
   (  segid "    " and resid 172  and name HD1%)
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1915}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 150  and name HD2 ))
      3.200     3.200     2.800 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.13630E-02 ppm1      0.828 ppm2      1.547 CV     1
 OR { 1915}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 150  and name HD1 ))
 OR { 1915}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 35   and name HD1 ))
 OR { 1915}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 172  and name HB2 ))
 OR { 1915}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 1916}
   (  segid "    " and resid 68   and name HG2%)
   (( segid "    " and resid 72   and name HB2 ))
      3.700     1.700     1.700 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.33890E-03 ppm1      0.610 ppm2      1.584 CV     1
 OR { 1916}
   (  segid "    " and resid 168  and name HG2%)
   (( segid "    " and resid 172  and name HB2 ))
 ASSI { 1920}
   (( segid "    " and resid 146  and name HB2 ))
   (( segid "    " and resid 35   and name HD1 ))
      6.000     5.400     0.000 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.36946E-04 ppm1      2.965 ppm2      1.516 CV     1
 OR { 1920}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 135  and name HD2 ))
 ASSI { 1926}
   (  segid "    " and resid 47   and name HG2%)
   (  segid "    " and resid 51   and name HB% )
      3.500     1.600     1.600 peak  1926 spectrum    1 weight  0.10000E+01 volume  0.77351E-03 ppm1      1.292 ppm2      1.531 CV     1
 OR { 1926}
   (  segid "    " and resid 147  and name HG2%)
   (  segid "    " and resid 151  and name HB% )
 OR { 1926}
   (  segid "    " and resid 147  and name HG2%)
   (( segid "    " and resid 150  and name HD1 ))
 OR { 1926}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 50   and name HD1 ))
 ASSI { 1929}
   (( segid "    " and resid 169  and name HA  ))
   (( segid "    " and resid 173  and name HG2 ))
      6.000     6.000     0.000 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.20710E-04 ppm1      4.378 ppm2      1.483 CV     1
 OR { 1929}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI { 1930}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 73   and name HG2 ))
      4.800     2.900     1.200 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.19052E-04 ppm1      4.254 ppm2      1.474 CV     1
 OR { 1930}
   (( segid "    " and resid 174  and name HA  ))
   (( segid "    " and resid 173  and name HG2 ))
 ASSI { 1931}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 173  and name HG2 ))
      2.600     2.600     3.400 peak  1931 spectrum    1 weight  0.10000E+01 volume  0.64385E-02 ppm1      3.967 ppm2      1.485 CV     1
 OR { 1931}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1931}
   (( segid "    " and resid 145  and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1931}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1932}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.100     1.200     1.200 peak  1932 spectrum    1 weight  0.10000E+01 volume  0.39965E-02 ppm1      3.895 ppm2      1.482 CV     1
 OR { 1932}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1932}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1932}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1933}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 35   and name HB2 ))
      5.300     3.500     0.700 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.20612E-03 ppm1      3.366 ppm2      1.476 CV     1
 OR { 1933}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1933}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1933}
   (( segid "    " and resid 146  and name HB1 ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1934}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 135  and name HB2 ))
      3.000     1.100     1.100 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.10268E-02 ppm1      3.249 ppm2      1.480 CV     1
 OR { 1934}
   (( segid "    " and resid 141  and name HB1 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1934}
   (( segid "    " and resid 41   and name HB2 ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1935}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HG2 ))
      2.800     1.000     1.000 peak  1935 spectrum    1 weight  0.10000E+01 volume  0.24023E-02 ppm1      3.169 ppm2      1.468 CV     1
 OR { 1935}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR { 1935}
   (( segid "    " and resid 145  and name HE1 ))
   (( segid "    " and resid 145  and name HG1 ))
 OR { 1935}
   (( segid "    " and resid 45   and name HE2 ))
   (( segid "    " and resid 45   and name HG1 ))
 ASSI { 1936}
   (( segid "    " and resid 111  and name HE1 ))
   (( segid "    " and resid 111  and name HG1 ))
      2.200     0.600     0.600 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.12141E-01 ppm1      3.019 ppm2      1.475 CV     1
 OR { 1936}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1936}
   (( segid "    " and resid 112  and name HE1 ))
   (( segid "    " and resid 112  and name HG1 ))
 OR { 1936}
   (( segid "    " and resid 12   and name HE1 ))
   (( segid "    " and resid 12   and name HG1 ))
 OR { 1936}
   (( segid "    " and resid 111  and name HE2 ))
   (( segid "    " and resid 111  and name HG1 ))
 OR { 1936}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1936}
   (( segid "    " and resid 112  and name HE2 ))
   (( segid "    " and resid 112  and name HG1 ))
 ASSI { 1938}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 35   and name HB2 ))
      3.700     1.700     1.700 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.72918E-03 ppm1      2.812 ppm2      1.467 CV     1
 OR { 1938}
   (( segid "    " and resid 41   and name HB1 ))
   (( segid "    " and resid 45   and name HG1 ))
 OR { 1938}
   (( segid "    " and resid 41   and name HB1 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR { 1938}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 35   and name HB1 ))
 OR { 1938}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 145  and name HG1 ))
 OR { 1938}
   (( segid "    " and resid 141  and name HB2 ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI { 1939}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 35   and name HB1 ))
      2.000     0.500     0.500 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.18795E-01 ppm1      2.790 ppm2      1.487 CV     1
 OR { 1939}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1939}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 35   and name HB1 ))
 OR { 1939}
   (( segid "    " and resid 135  and name HE2 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1939}
   (( segid "    " and resid 135  and name HE1 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1939}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 1941}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 135  and name HB2 ))
      4.400     2.400     1.600 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.41524E-03 ppm1      2.735 ppm2      1.477 CV     1
 OR { 1941}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1941}
   (( segid "    " and resid 42   and name HB2 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1941}
   (( segid "    " and resid 142  and name HB2 ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1942}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 35   and name HD2 ))
      2.600     0.800     0.800 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.64770E-02 ppm1      2.283 ppm2      1.474 CV     1
 OR { 1942}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 135  and name HD1 ))
 OR { 1942}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 135  and name HD1 ))
 OR { 1942}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR { 1942}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1942}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1942}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1942}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1945}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 33   and name HG2 ))
      3.900     1.900     1.900 peak  1945 spectrum    1 weight  0.10000E+01 volume  0.70128E-03 ppm1      2.098 ppm2      1.472 CV     1
 OR { 1945}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1945}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 33   and name HG1 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 1945}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 33   and name HG2 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 135  and name HD1 ))
 OR { 1945}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 33   and name HG1 ))
 OR { 1945}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 135  and name HD1 ))
 OR { 1945}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR { 1945}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 135  and name HB2 ))
 ASSI { 1948}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 135  and name HB2 ))
      2.600     2.600     3.400 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.13727E-01 ppm1      1.999 ppm2      1.490 CV     1
 OR { 1948}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1948}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1948}
   (( segid "    " and resid 145  and name HB1 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1948}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1948}
   (( segid "    " and resid 145  and name HB2 ))
   (( segid "    " and resid 35   and name HB1 ))
 OR { 1948}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1950}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG1 ))
      1.900     0.500     0.500 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.13517E-01 ppm1      1.827 ppm2      1.473 CV     1
 OR { 1950}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HG1 ))
 OR { 1950}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG2 ))
 OR { 1950}
   (( segid "    " and resid 145  and name HD2 ))
   (( segid "    " and resid 145  and name HG2 ))
 OR { 1950}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HG1 ))
 OR { 1950}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HG1 ))
 OR { 1950}
   (( segid "    " and resid 145  and name HD1 ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI { 1953}
   (( segid "    " and resid 33   and name HD1 ))
   (( segid "    " and resid 33   and name HG2 ))
      1.900     0.400     0.400 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.19362E-01 ppm1      1.715 ppm2      1.461 CV     1
 OR { 1953}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1953}
   (( segid "    " and resid 112  and name HD2 ))
   (( segid "    " and resid 112  and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 12   and name HD2 ))
   (( segid "    " and resid 12   and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 111  and name HD2 ))
   (( segid "    " and resid 111  and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 11   and name HD2 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 133  and name HD2 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1953}
   (( segid "    " and resid 33   and name HD1 ))
   (( segid "    " and resid 33   and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 133  and name HD1 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 11   and name HD1 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 111  and name HD1 ))
   (( segid "    " and resid 111  and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 112  and name HD1 ))
   (( segid "    " and resid 112  and name HG1 ))
 OR { 1953}
   (( segid "    " and resid 12   and name HD1 ))
   (( segid "    " and resid 12   and name HG1 ))
 ASSI { 1961}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HB2 ))
      1.700     0.400     0.500 peak  1961 spectrum    1 weight  0.10000E+01 volume  0.16777E-01 ppm1      1.211 ppm2      1.476 CV     1
 OR { 1961}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1961}
   (( segid "    " and resid 35   and name HG1 ))
   (( segid "    " and resid 35   and name HB1 ))
 OR { 1961}
   (( segid "    " and resid 135  and name HG1 ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1966}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HD1 ))
      1.900     0.500     0.500 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.15930E-01 ppm1      0.950 ppm2      1.473 CV     1
 OR { 1966}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HD2 ))
 OR { 1966}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1966}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HB2 ))
 OR { 1966}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HB1 ))
 ASSI { 1968}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 135  and name HB2 ))
      3.800     1.800     1.800 peak  1968 spectrum    1 weight  0.10000E+01 volume  0.93380E-03 ppm1      0.828 ppm2      1.486 CV     1
 OR { 1968}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1968}
   (  segid "    " and resid 137  and name HG1%)
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1968}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1969}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 135  and name HB2 ))
      2.300     2.300     3.700 peak  1969 spectrum    1 weight  0.10000E+01 volume  0.60345E-02 ppm1      0.656 ppm2      1.480 CV     1
 OR { 1969}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1969}
   (  segid "    " and resid 137  and name HG2%)
   (( segid "    " and resid 135  and name HB1 ))
 OR { 1969}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 35   and name HB1 ))
 ASSI { 1970}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG11))
      2.500     0.800     0.800 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.43318E-02 ppm1      4.505 ppm2      1.449 CV     1
 OR { 1970}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HG12))
 OR { 1970}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR { 1970}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HB2 ))
 ASSI { 1973}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG1 ))
      2.500     0.800     0.800 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.44668E-02 ppm1      4.311 ppm2      1.433 CV     1
 OR { 1973}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1973}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 111  and name HG2 ))
 OR { 1973}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 1974}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HG1 ))
      3.800     1.800     1.800 peak  1974 spectrum    1 weight  0.10000E+01 volume  0.35208E-03 ppm1      4.277 ppm2      1.438 CV     1
 OR { 1974}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG1 ))
 OR { 1974}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG2 ))
 OR { 1974}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HG2 ))
 ASSI { 1976}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 33   and name HG1 ))
      6.000     5.200     0.000 peak  1976 spectrum    1 weight  0.10000E+01 volume  0.19319E-04 ppm1      3.971 ppm2      1.452 CV     1
 OR { 1976}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 1976}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1976}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 33   and name HG2 ))
 ASSI { 1977}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 33   and name HG1 ))
      4.100     2.100     1.900 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.31808E-03 ppm1      3.934 ppm2      1.439 CV     1
 OR { 1977}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 1977}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 33   and name HG2 ))
 OR { 1977}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1977}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 111  and name HG1 ))
 OR { 1977}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 34   and name HG11))
 OR { 1977}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 111  and name HG2 ))
 OR { 1977}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1977}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 1981}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HG2 ))
      1.900     0.500     0.500 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.18482E-01 ppm1      1.765 ppm2      1.429 CV     1
 OR { 1981}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HG1 ))
 OR { 1981}
   (( segid "    " and resid 133  and name HB1 ))
   (( segid "    " and resid 133  and name HG2 ))
 OR { 1981}
   (( segid "    " and resid 111  and name HB2 ))
   (( segid "    " and resid 111  and name HG2 ))
 OR { 1981}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HG1 ))
 OR { 1981}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HG1 ))
 OR { 1981}
   (( segid "    " and resid 133  and name HB1 ))
   (( segid "    " and resid 133  and name HG1 ))
 ASSI { 1991}
   (( segid "    " and resid 34   and name HG12))
   (( segid "    " and resid 34   and name HG11))
      1.400     0.200     0.800 peak  1991 spectrum    1 weight  0.10000E+01 volume  0.35907E-01 ppm1      1.212 ppm2      1.423 CV     1
 OR { 1991}
   (( segid "    " and resid 134  and name HG11))
   (( segid "    " and resid 134  and name HG12))
 ASSI { 1997}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 134  and name HG12))
      2.100     0.500     0.500 peak  1997 spectrum    1 weight  0.10000E+01 volume  0.11685E-01 ppm1      0.736 ppm2      1.427 CV     1
 OR { 1997}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HG11))
 ASSI { 1999}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 134  and name HG12))
      2.200     2.200     3.800 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.88336E-02 ppm1      0.716 ppm2      1.432 CV     1
 OR { 1999}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 34   and name HG11))
 ASSI { 2000}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 127  and name HB% )
      3.700     1.700     1.700 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.15166E-02 ppm1      4.323 ppm2      1.387 CV     1
 OR { 2000}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 27   and name HB% )
 ASSI { 2002}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HG1 ))
      1.900     0.500     0.500 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.15661E-01 ppm1      1.814 ppm2      1.409 CV     1
 OR { 2002}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG1 ))
 OR { 2002}
   (( segid "    " and resid 111  and name HB1 ))
   (( segid "    " and resid 111  and name HG2 ))
 OR { 2002}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HG2 ))
 OR { 2002}
   (( segid "    " and resid 133  and name HB2 ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI { 2023}
   (( segid "    " and resid 144  and name HA  ))
   (  segid "    " and resid 147  and name HG2%)
      3.100     3.100     2.900 peak  2023 spectrum    1 weight  0.10000E+01 volume  0.34662E-02 ppm1      4.187 ppm2      1.296 CV     1
 OR { 2023}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
 ASSI { 2024}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
      2.100     0.500     0.500 peak  2024 spectrum    1 weight  0.10000E+01 volume  0.14475E-01 ppm1      3.653 ppm2      1.294 CV     1
 OR { 2024}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 147  and name HG2%)
 ASSI { 2025}
   (  segid "    " and resid 51   and name HB% )
   (  segid "    " and resid 47   and name HG2%)
      2.100     2.100     3.900 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.30912E-02 ppm1      1.543 ppm2      1.310 CV     1
 OR { 2025}
   (  segid "    " and resid 151  and name HB% )
   (  segid "    " and resid 147  and name HG2%)
 ASSI { 2030}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
      3.300     3.300     2.700 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.13903E-02 ppm1      4.423 ppm2      1.262 CV     1
 OR { 2030}
   (( segid "    " and resid 162  and name HA  ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI { 2031}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 147  and name HG2%)
      2.800     1.000     1.000 peak  2031 spectrum    1 weight  0.10000E+01 volume  0.33047E-02 ppm1      4.173 ppm2      1.286 CV     1
 OR { 2031}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
 OR { 2031}
   (( segid "    " and resid 144  and name HA  ))
   (  segid "    " and resid 147  and name HG2%)
 OR { 2031}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
 ASSI { 2033}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 61   and name HG2%)
      6.000     4.500     0.000 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.81098E-04 ppm1      4.099 ppm2      1.271 CV     1
 OR { 2033}
   (( segid "    " and resid 159  and name HB1 ))
   (  segid "    " and resid 161  and name HG2%)
 OR { 2033}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
 OR { 2033}
   (( segid "    " and resid 159  and name HB2 ))
   (  segid "    " and resid 161  and name HG2%)
 OR { 2033}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HG12))
 ASSI { 2036}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
      3.300     1.400     1.400 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.64256E-03 ppm1      3.981 ppm2      1.271 CV     1
 OR { 2036}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI { 2038}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HG2 ))
      2.200     0.600     0.600 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.10497E-01 ppm1      3.442 ppm2      1.273 CV     1
 OR { 2038}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG2 ))
 OR { 2038}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 150  and name HG1 ))
 OR { 2038}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 2039}
   (( segid "    " and resid 160  and name HA  ))
   (( segid "    " and resid 160  and name HG12))
      2.800     1.000     1.000 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.50177E-02 ppm1      3.147 ppm2      1.264 CV     1
 OR { 2039}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI { 2040}
   (( segid "    " and resid 150  and name HE1 ))
   (( segid "    " and resid 150  and name HG2 ))
      2.500     0.800     0.800 peak  2040 spectrum    1 weight  0.10000E+01 volume  0.55964E-02 ppm1      2.938 ppm2      1.268 CV     1
 OR { 2040}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HG2 ))
 OR { 2040}
   (( segid "    " and resid 150  and name HE1 ))
   (( segid "    " and resid 150  and name HG1 ))
 OR { 2040}
   (( segid "    " and resid 50   and name HE1 ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 2043}
   (( segid "    " and resid 140  and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
      4.000     2.000     2.000 peak  2043 spectrum    1 weight  0.10000E+01 volume  0.43879E-03 ppm1      2.575 ppm2      1.271 CV     1
 OR { 2043}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI { 2044}
   (( segid "    " and resid 140  and name HB1 ))
   (  segid "    " and resid 61   and name HG2%)
      4.200     2.200     1.800 peak  2044 spectrum    1 weight  0.10000E+01 volume  0.52954E-03 ppm1      2.337 ppm2      1.265 CV     1
 OR { 2044}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI { 2045}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 160  and name HG12))
      2.500     0.800     0.800 peak  2045 spectrum    1 weight  0.10000E+01 volume  0.39330E-02 ppm1      1.636 ppm2      1.276 CV     1
 OR { 2045}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI { 2047}
   (( segid "    " and resid 150  and name HD2 ))
   (( segid "    " and resid 150  and name HG2 ))
      1.900     0.400     0.400 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.19023E-01 ppm1      1.561 ppm2      1.264 CV     1
 OR { 2047}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HG2 ))
 OR { 2047}
   (( segid "    " and resid 150  and name HD1 ))
   (( segid "    " and resid 150  and name HG1 ))
 OR { 2047}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HG1 ))
 OR { 2047}
   (( segid "    " and resid 150  and name HD2 ))
   (( segid "    " and resid 150  and name HG1 ))
 OR { 2047}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HG1 ))
 OR { 2047}
   (( segid "    " and resid 150  and name HD1 ))
   (( segid "    " and resid 150  and name HG2 ))
 ASSI { 2054}
   (( segid "    " and resid 160  and name HG11))
   (( segid "    " and resid 160  and name HG12))
      1.800     0.400     0.400 peak  2054 spectrum    1 weight  0.10000E+01 volume  0.44254E-02 ppm1     -0.252 ppm2      1.271 CV     1
 OR { 2054}
   (( segid "    " and resid 60   and name HG11))
   (( segid "    " and resid 60   and name HG12))
 ASSI { 2055}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HG1 ))
      3.500     1.500     1.500 peak  2055 spectrum    1 weight  0.10000E+01 volume  0.15494E-02 ppm1      4.532 ppm2      1.214 CV     1
 OR { 2055}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 135  and name HG1 ))
 ASSI { 2056}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HG11))
      2.700     0.900     0.900 peak  2056 spectrum    1 weight  0.10000E+01 volume  0.28765E-02 ppm1      4.510 ppm2      1.221 CV     1
 OR { 2056}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG12))
 OR { 2056}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI { 2059}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 135  and name HG1 ))
      3.100     1.200     1.200 peak  2059 spectrum    1 weight  0.10000E+01 volume  0.73455E-03 ppm1      3.891 ppm2      1.229 CV     1
 OR { 2059}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI { 2061}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 135  and name HG1 ))
      3.100     1.200     1.200 peak  2061 spectrum    1 weight  0.10000E+01 volume  0.23338E-02 ppm1      2.286 ppm2      1.220 CV     1
 OR { 2061}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 35   and name HG1 ))
 OR { 2061}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 135  and name HG1 ))
 OR { 2061}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI { 2062}
   (( segid "    " and resid 153  and name HB1 ))
   (  segid "    " and resid 158  and name HG2%)
      4.900     2.900     1.100 peak  2062 spectrum    1 weight  0.10000E+01 volume  0.24633E-03 ppm1      2.242 ppm2      1.214 CV     1
 OR { 2062}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 2065}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 135  and name HG1 ))
      6.000     5.200     0.000 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.40015E-04 ppm1      1.439 ppm2      1.220 CV     1
 OR { 2065}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 35   and name HG1 ))
 OR { 2065}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 135  and name HG1 ))
 OR { 2065}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI { 2067}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 135  and name HG1 ))
      6.000     6.000     0.000 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.22690E-04 ppm1      1.420 ppm2      1.224 CV     1
 OR { 2067}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 35   and name HG1 ))
 OR { 2067}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 135  and name HG1 ))
 OR { 2067}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 35   and name HG1 ))
 OR { 2067}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 134  and name HG11))
 ASSI { 2070}
   (( segid "    " and resid 35   and name HG2 ))
   (( segid "    " and resid 35   and name HG1 ))
      1.400     0.200     0.800 peak  2070 spectrum    1 weight  0.10000E+01 volume  0.20575E-01 ppm1      0.951 ppm2      1.222 CV     1
 OR { 2070}
   (( segid "    " and resid 135  and name HG2 ))
   (( segid "    " and resid 135  and name HG1 ))
 ASSI { 2075}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HG12))
      2.200     0.600     0.600 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.86515E-02 ppm1      0.737 ppm2      1.220 CV     1
 OR { 2075}
   (  segid "    " and resid 134  and name HD1%)
   (( segid "    " and resid 134  and name HG11))
 ASSI { 2077}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 34   and name HG12))
      2.300     0.700     0.700 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.66202E-02 ppm1      0.717 ppm2      1.209 CV     1
 OR { 2077}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 134  and name HG11))
 ASSI { 2079}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 161  and name HG2%)
      2.500     2.500     3.500 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.61255E-02 ppm1      0.473 ppm2      1.238 CV     1
 OR { 2079}
   (  segid "    " and resid 139  and name HG2%)
   (  segid "    " and resid 61   and name HG2%)
 ASSI { 2081}
   (( segid "    " and resid 156  and name HA  ))
   (  segid "    " and resid 158  and name HG2%)
      5.400     3.600     0.600 peak  2081 spectrum    1 weight  0.10000E+01 volume  0.15337E-03 ppm1      4.431 ppm2      1.192 CV     1
 OR { 2081}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 2086}
   (( segid "    " and resid 26   and name HB  ))
   (  segid "    " and resid 26   and name HG2%)
      2.200     0.600     0.600 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.96721E-02 ppm1      4.201 ppm2      1.205 CV     1
 OR { 2086}
   (( segid "    " and resid 126  and name HB  ))
   (  segid "    " and resid 126  and name HG2%)
 ASSI { 2089}
   (( segid "    " and resid 158  and name HB  ))
   (  segid "    " and resid 158  and name HG2%)
      2.000     0.500     0.500 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.13264E-01 ppm1      3.975 ppm2      1.185 CV     1
 OR { 2089}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 2090}
   (( segid "    " and resid 153  and name HA  ))
   (  segid "    " and resid 158  and name HG2%)
      2.200     0.600     0.600 peak  2090 spectrum    1 weight  0.10000E+01 volume  0.82258E-02 ppm1      3.978 ppm2      1.185 CV     1
 OR { 2090}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 2093}
   (( segid "    " and resid 56   and name HB2 ))
   (  segid "    " and resid 58   and name HG2%)
      2.600     2.600     3.400 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.25942E-02 ppm1      2.265 ppm2      1.180 CV     1
 OR { 2093}
   (( segid "    " and resid 156  and name HB1 ))
   (  segid "    " and resid 158  and name HG2%)
 ASSI { 2095}
   (( segid "    " and resid 156  and name HB2 ))
   (  segid "    " and resid 158  and name HG2%)
      2.500     0.800     0.800 peak  2095 spectrum    1 weight  0.10000E+01 volume  0.32533E-02 ppm1      1.928 ppm2      1.189 CV     1
 OR { 2095}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI { 2098}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HG1 ))
      2.400     0.700     0.700 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.36647E-02 ppm1      1.533 ppm2      1.193 CV     1
 OR { 2098}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HG1 ))
 ASSI { 2109}
   (  segid "    " and resid 63   and name HG2%)
   (  segid "    " and resid 58   and name HG2%)
      2.000     2.000     4.000 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.14518E-01 ppm1      0.837 ppm2      1.183 CV     1
 OR { 2109}
   (  segid "    " and resid 163  and name HG1%)
   (  segid "    " and resid 158  and name HG2%)
 ASSI { 2114}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      3.800     1.800     1.800 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.45508E-03 ppm1      3.522 ppm2      1.147 CV     1
 OR { 2114}
   (( segid "    " and resid 163  and name HA  ))
   (  segid "    " and resid 158  and name HG2%)
 OR { 2114}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 64   and name HG2%)
 ASSI { 2117}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 64   and name HG2%)
      3.600     1.600     1.600 peak  2117 spectrum    1 weight  0.10000E+01 volume  0.92884E-03 ppm1      1.646 ppm2      1.146 CV     1
 OR { 2117}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 58   and name HG2%)
 OR { 2117}
   (( segid "    " and resid 163  and name HB  ))
   (  segid "    " and resid 164  and name HG1%)
 ASSI { 2118}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 108  and name HG2%)
      4.000     2.000     2.000 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.41142E-03 ppm1      1.365 ppm2      1.134 CV     1
 OR { 2118}
   (  segid "    " and resid 6    and name HB% )
   (  segid "    " and resid 8    and name HG2%)
 ASSI { 2122}
   (  segid "    " and resid 164  and name HG2%)
   (  segid "    " and resid 164  and name HG1%)
      1.500     1.500     4.500 peak  2122 spectrum    1 weight  0.10000E+01 volume  0.48236E-01 ppm1      0.955 ppm2      1.145 CV     1
 OR { 2122}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 64   and name HG2%)
 ASSI { 2125}
   (  segid "    " and resid 60   and name HG2%)
   (  segid "    " and resid 64   and name HG2%)
      2.700     2.700     3.300 peak  2125 spectrum    1 weight  0.10000E+01 volume  0.52995E-02 ppm1      0.629 ppm2      1.156 CV     1
 OR { 2125}
   (  segid "    " and resid 160  and name HG2%)
   (  segid "    " and resid 164  and name HG1%)
 ASSI { 2127}
   (  segid "    " and resid 168  and name HG2%)
   (  segid "    " and resid 164  and name HG1%)
      2.300     2.300     3.700 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.91912E-02 ppm1      0.614 ppm2      1.134 CV     1
 OR { 2127}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 164  and name HG1%)
 ASSI { 2130}
   (( segid "    " and resid 168  and name HA  ))
   (  segid "    " and resid 67   and name HD2%)
      2.900     1.000     1.000 peak  2130 spectrum    1 weight  0.10000E+01 volume  0.90723E-03 ppm1      3.291 ppm2      1.101 CV     1
 OR { 2130}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI { 2131}
   (( segid "    " and resid 170  and name HB2 ))
   (  segid "    " and resid 67   and name HD2%)
      4.500     2.600     1.500 peak  2131 spectrum    1 weight  0.10000E+01 volume  0.40326E-03 ppm1      3.077 ppm2      1.091 CV     1
 OR { 2131}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 67   and name HD2%)
 OR { 2131}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 167  and name HD1%)
 OR { 2131}
   (( segid "    " and resid 170  and name HB1 ))
   (  segid "    " and resid 67   and name HD2%)
 OR { 2131}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 67   and name HD2%)
 ASSI { 2137}
   (( segid "    " and resid 167  and name HB2 ))
   (  segid "    " and resid 167  and name HD1%)
      2.500     0.800     0.800 peak  2137 spectrum    1 weight  0.10000E+01 volume  0.24325E-02 ppm1      1.924 ppm2      1.088 CV     1
 OR { 2137}
   (( segid "    " and resid 67   and name HB1 ))
   (  segid "    " and resid 67   and name HD2%)
 OR { 2137}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 167  and name HD1%)
 OR { 2137}
   (( segid "    " and resid 167  and name HB1 ))
   (  segid "    " and resid 167  and name HD1%)
 OR { 2137}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 67   and name HD2%)
 ASSI { 2138}
   (( segid "    " and resid 148  and name HB1 ))
   (  segid "    " and resid 72   and name HD2%)
      3.400     1.400     1.400 peak  2138 spectrum    1 weight  0.10000E+01 volume  0.58668E-03 ppm1      1.926 ppm2      1.094 CV     1
 OR { 2138}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 172  and name HD2%)
 OR { 2138}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI { 2141}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 67   and name HD2%)
      2.400     2.400     3.600 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.55524E-02 ppm1     -0.194 ppm2      1.113 CV     1
 OR { 2141}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 64   and name HG2%)
 ASSI { 2143}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HD2%)
      2.400     2.400     3.600 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.17042E-01 ppm1      4.172 ppm2      1.079 CV     1
 OR { 2143}
   (( segid "    " and resid 167  and name HA  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI { 2144}
   (( segid "    " and resid 148  and name HA  ))
   (  segid "    " and resid 72   and name HD2%)
      5.400     3.600     0.600 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.20531E-03 ppm1      4.165 ppm2      1.064 CV     1
 OR { 2144}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 172  and name HD2%)
 ASSI { 2148}
   (( segid "    " and resid 176  and name HG1 ))
   (  segid "    " and resid 172  and name HD2%)
      2.800     2.800     3.200 peak  2148 spectrum    1 weight  0.10000E+01 volume  0.33787E-02 ppm1      2.303 ppm2      1.060 CV     1
 OR { 2148}
   (( segid "    " and resid 76   and name HG1 ))
   (  segid "    " and resid 72   and name HD2%)
 OR { 2148}
   (( segid "    " and resid 76   and name HG2 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI { 2151}
   (( segid "    " and resid 172  and name HB1 ))
   (  segid "    " and resid 172  and name HD2%)
      2.300     0.700     0.700 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.32982E-02 ppm1      2.083 ppm2      1.068 CV     1
 OR { 2151}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI { 2154}
   (( segid "    " and resid 67   and name HG  ))
   (  segid "    " and resid 67   and name HD2%)
      2.000     0.500     0.500 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.66185E-02 ppm1      2.025 ppm2      1.083 CV     1
 OR { 2154}
   (( segid "    " and resid 167  and name HG  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI { 2157}
   (  segid "    " and resid 52   and name HB% )
   (  segid "    " and resid 172  and name HD2%)
      2.300     2.300     3.700 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.86459E-02 ppm1      1.820 ppm2      1.065 CV     1
 OR { 2157}
   (  segid "    " and resid 52   and name HB% )
   (  segid "    " and resid 67   and name HD2%)
 ASSI { 2163}
   (  segid "    " and resid 167  and name HD2%)
   (  segid "    " and resid 167  and name HD1%)
      1.800     1.800     4.200 peak  2163 spectrum    1 weight  0.10000E+01 volume  0.16123E-01 ppm1      0.567 ppm2      1.082 CV     1
 OR { 2163}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 67   and name HD2%)
 ASSI { 2164}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 167  and name HD1%)
      2.800     1.000     1.000 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.39327E-02 ppm1      0.049 ppm2      1.065 CV     1
 OR { 2164}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 67   and name HD2%)
 OR { 2164}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 172  and name HD2%)
 ASSI { 2169}
   (( segid "    " and resid 128  and name HA  ))
   (  segid "    " and resid 129  and name HG2%)
      3.900     1.900     1.900 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.98601E-03 ppm1      4.475 ppm2      0.971 CV     1
 OR { 2169}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2169}
   (( segid "    " and resid 128  and name HA  ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2169}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 29   and name HG1%)
 ASSI { 2170}
   (( segid "    " and resid 30   and name HB2 ))
   (  segid "    " and resid 29   and name HG1%)
      2.800     2.800     3.200 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.48676E-03 ppm1      3.929 ppm2      0.973 CV     1
 OR { 2170}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2170}
   (( segid "    " and resid 130  and name HB1 ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2170}
   (( segid "    " and resid 30   and name HB1 ))
   (  segid "    " and resid 29   and name HG1%)
 OR { 2170}
   (( segid "    " and resid 30   and name HB2 ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2170}
   (( segid "    " and resid 130  and name HB2 ))
   (  segid "    " and resid 129  and name HG2%)
 OR { 2170}
   (( segid "    " and resid 30   and name HB1 ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2170}
   (( segid "    " and resid 130  and name HB1 ))
   (  segid "    " and resid 129  and name HG2%)
 OR { 2170}
   (( segid "    " and resid 131  and name HB2 ))
   (  segid "    " and resid 129  and name HG1%)
 ASSI { 2177}
   (  segid "    " and resid 126  and name HG2%)
   (  segid "    " and resid 124  and name HG1%)
      2.400     2.400     3.600 peak  2177 spectrum    1 weight  0.10000E+01 volume  0.12131E-02 ppm1      1.208 ppm2      0.970 CV     1
 OR { 2177}
   (  segid "    " and resid 26   and name HG2%)
   (  segid "    " and resid 24   and name HG1%)
 OR { 2177}
   (  segid "    " and resid 126  and name HG2%)
   (  segid "    " and resid 125  and name HG1%)
 OR { 2177}
   (  segid "    " and resid 26   and name HG2%)
   (  segid "    " and resid 25   and name HG1%)
 OR { 2177}
   (  segid "    " and resid 26   and name HG2%)
   (  segid "    " and resid 25   and name HG2%)
 OR { 2177}
   (  segid "    " and resid 126  and name HG2%)
   (  segid "    " and resid 125  and name HG2%)
 ASSI { 2184}
   (  segid "    " and resid 139  and name HG1%)
   (  segid "    " and resid 64   and name HG1%)
      2.300     2.300     3.700 peak  2184 spectrum    1 weight  0.10000E+01 volume  0.56014E-02 ppm1      0.773 ppm2      0.985 CV     1
 OR { 2184}
   (  segid "    " and resid 39   and name HG1%)
   (  segid "    " and resid 164  and name HG2%)
 ASSI { 2190}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 129  and name HG2%)
      3.400     3.400     2.600 peak  2190 spectrum    1 weight  0.10000E+01 volume  0.55386E-03 ppm1      4.610 ppm2      0.933 CV     1
 OR { 2190}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2190}
   (( segid "    " and resid 127  and name HA  ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2190}
   (( segid "    " and resid 27   and name HA  ))
   (  segid "    " and resid 29   and name HG1%)
 ASSI { 2192}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 125  and name HG1%)
      2.700     2.700     3.300 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.72536E-03 ppm1      4.322 ppm2      0.927 CV     1
 OR { 2192}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 25   and name HG1%)
 OR { 2192}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 125  and name HG2%)
 OR { 2192}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 2192}
   (( segid "    " and resid 26   and name HA  ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2192}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 129  and name HG2%)
 ASSI { 2193}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HG1%)
      2.200     0.600     0.600 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.10666E-01 ppm1      4.191 ppm2      0.937 CV     1
 OR { 2193}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 125  and name HG1%)
 OR { 2193}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 2193}
   (( segid "    " and resid 125  and name HA  ))
   (  segid "    " and resid 125  and name HG2%)
 ASSI { 2196}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 10   and name HG1%)
      2.000     0.500     0.500 peak  2196 spectrum    1 weight  0.10000E+01 volume  0.21005E-01 ppm1      4.119 ppm2      0.941 CV     1
 OR { 2196}
   (( segid "    " and resid 110  and name HA  ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2196}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 124  and name HG2%)
 OR { 2196}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 24   and name HG2%)
 OR { 2196}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2196}
   (( segid "    " and resid 129  and name HA  ))
   (  segid "    " and resid 129  and name HG2%)
 OR { 2196}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 29   and name HG1%)
 OR { 2196}
   (( segid "    " and resid 129  and name HA  ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2196}
   (( segid "    " and resid 24   and name HA  ))
   (  segid "    " and resid 24   and name HG1%)
 OR { 2196}
   (( segid "    " and resid 124  and name HA  ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 2197}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 64   and name HG1%)
      3.200     1.300     1.300 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.15781E-02 ppm1      3.921 ppm2      0.940 CV     1
 OR { 2197}
   (( segid "    " and resid 165  and name HA  ))
   (  segid "    " and resid 164  and name HG2%)
 ASSI { 2198}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 135  and name HG2 ))
      3.000     1.100     1.100 peak  2198 spectrum    1 weight  0.10000E+01 volume  0.11043E-02 ppm1      3.886 ppm2      0.927 CV     1
 OR { 2198}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2200}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 64   and name HG1%)
      5.400     3.700     0.600 peak  2200 spectrum    1 weight  0.10000E+01 volume  0.80558E-04 ppm1      3.285 ppm2      0.948 CV     1
 OR { 2200}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 164  and name HG2%)
 ASSI { 2201}
   (( segid "    " and resid 23   and name HD1 ))
   (  segid "    " and resid 25   and name HG2%)
      2.700     2.700     3.300 peak  2201 spectrum    1 weight  0.10000E+01 volume  0.59822E-03 ppm1      3.199 ppm2      0.944 CV     1
 OR { 2201}
   (( segid "    " and resid 123  and name HD1 ))
   (  segid "    " and resid 125  and name HG2%)
 OR { 2201}
   (( segid "    " and resid 123  and name HD2 ))
   (  segid "    " and resid 125  and name HG2%)
 OR { 2201}
   (( segid "    " and resid 23   and name HD2 ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 2201}
   (( segid "    " and resid 119  and name HD2 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2201}
   (( segid "    " and resid 19   and name HD2 ))
   (  segid "    " and resid 21   and name HD2%)
 OR { 2201}
   (( segid "    " and resid 23   and name HD2 ))
   (  segid "    " and resid 21   and name HD2%)
 OR { 2201}
   (( segid "    " and resid 123  and name HD2 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2201}
   (( segid "    " and resid 123  and name HD1 ))
   (  segid "    " and resid 125  and name HG1%)
 OR { 2201}
   (( segid "    " and resid 23   and name HD1 ))
   (  segid "    " and resid 25   and name HG1%)
 OR { 2201}
   (( segid "    " and resid 123  and name HD1 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2201}
   (( segid "    " and resid 23   and name HD1 ))
   (  segid "    " and resid 21   and name HD2%)
 OR { 2201}
   (( segid "    " and resid 119  and name HD1 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2201}
   (( segid "    " and resid 19   and name HD1 ))
   (  segid "    " and resid 21   and name HD2%)
 OR { 2201}
   (( segid "    " and resid 123  and name HD2 ))
   (  segid "    " and resid 125  and name HG1%)
 OR { 2201}
   (( segid "    " and resid 23   and name HD2 ))
   (  segid "    " and resid 25   and name HG1%)
 ASSI { 2202}
   (( segid "    " and resid 112  and name HE2 ))
   (  segid "    " and resid 110  and name HG1%)
      4.300     2.300     1.700 peak  2202 spectrum    1 weight  0.10000E+01 volume  0.39087E-04 ppm1      3.019 ppm2      0.926 CV     1
 OR { 2202}
   (( segid "    " and resid 12   and name HE2 ))
   (  segid "    " and resid 10   and name HG1%)
 OR { 2202}
   (( segid "    " and resid 112  and name HE1 ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2202}
   (( segid "    " and resid 12   and name HE1 ))
   (  segid "    " and resid 10   and name HG1%)
 OR { 2202}
   (( segid "    " and resid 112  and name HE1 ))
   (  segid "    " and resid 110  and name HG2%)
 OR { 2202}
   (( segid "    " and resid 12   and name HE1 ))
   (  segid "    " and resid 10   and name HG2%)
 OR { 2202}
   (( segid "    " and resid 112  and name HE2 ))
   (  segid "    " and resid 110  and name HG2%)
 OR { 2202}
   (( segid "    " and resid 12   and name HE2 ))
   (  segid "    " and resid 10   and name HG2%)
 OR { 2202}
   (( segid "    " and resid 11   and name HE1 ))
   (  segid "    " and resid 10   and name HG2%)
 OR { 2202}
   (( segid "    " and resid 111  and name HE1 ))
   (  segid "    " and resid 110  and name HG2%)
 OR { 2202}
   (( segid "    " and resid 111  and name HE1 ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2202}
   (( segid "    " and resid 11   and name HE1 ))
   (  segid "    " and resid 10   and name HG1%)
 OR { 2202}
   (( segid "    " and resid 11   and name HE2 ))
   (  segid "    " and resid 10   and name HG2%)
 OR { 2202}
   (( segid "    " and resid 111  and name HE2 ))
   (  segid "    " and resid 110  and name HG2%)
 ASSI { 2204}
   (( segid "    " and resid 143  and name HG2 ))
   (( segid "    " and resid 35   and name HG2 ))
      3.200     1.300     1.300 peak  2204 spectrum    1 weight  0.10000E+01 volume  0.16288E-02 ppm1      2.282 ppm2      0.940 CV     1
 OR { 2204}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2204}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2204}
   (( segid "    " and resid 143  and name HG1 ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2205}
   (( segid "    " and resid 22   and name HG2 ))
   (  segid "    " and resid 24   and name HG2%)
      5.100     3.200     0.900 peak  2205 spectrum    1 weight  0.10000E+01 volume  0.75754E-04 ppm1      2.251 ppm2      0.943 CV     1
 OR { 2205}
   (( segid "    " and resid 122  and name HG2 ))
   (  segid "    " and resid 124  and name HG2%)
 OR { 2205}
   (( segid "    " and resid 22   and name HG2 ))
   (  segid "    " and resid 24   and name HG1%)
 OR { 2205}
   (( segid "    " and resid 122  and name HG2 ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI { 2210}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 135  and name HG2 ))
      3.600     1.600     1.600 peak  2210 spectrum    1 weight  0.10000E+01 volume  0.82672E-03 ppm1      2.090 ppm2      0.949 CV     1
 OR { 2210}
   (( segid "    " and resid 143  and name HB2 ))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 2210}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2210}
   (( segid "    " and resid 143  and name HB1 ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2211}
   (( segid "    " and resid 124  and name HB  ))
   (  segid "    " and resid 124  and name HG1%)
      1.600     0.300     0.600 peak  2211 spectrum    1 weight  0.10000E+01 volume  0.60929E-01 ppm1      2.079 ppm2      0.951 CV     1
 OR { 2211}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG1%)
 OR { 2211}
   (( segid "    " and resid 10   and name HB  ))
   (  segid "    " and resid 10   and name HG1%)
 OR { 2211}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 29   and name HG1%)
 OR { 2211}
   (( segid "    " and resid 129  and name HB  ))
   (  segid "    " and resid 129  and name HG1%)
 OR { 2211}
   (( segid "    " and resid 110  and name HB  ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2211}
   (( segid "    " and resid 125  and name HB  ))
   (  segid "    " and resid 125  and name HG1%)
 OR { 2211}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 25   and name HG1%)
 OR { 2211}
   (( segid "    " and resid 24   and name HB  ))
   (  segid "    " and resid 24   and name HG2%)
 OR { 2211}
   (( segid "    " and resid 29   and name HB  ))
   (  segid "    " and resid 29   and name HG2%)
 OR { 2211}
   (( segid "    " and resid 129  and name HB  ))
   (  segid "    " and resid 129  and name HG2%)
 OR { 2211}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 2211}
   (( segid "    " and resid 125  and name HB  ))
   (  segid "    " and resid 125  and name HG2%)
 ASSI { 2213}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 124  and name HG2%)
      2.900     2.900     3.100 peak  2213 spectrum    1 weight  0.10000E+01 volume  0.17650E-02 ppm1      2.046 ppm2      0.951 CV     1
 OR { 2213}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 24   and name HG2%)
 OR { 2213}
   (( segid "    " and resid 122  and name HB1 ))
   (  segid "    " and resid 124  and name HG1%)
 OR { 2213}
   (( segid "    " and resid 22   and name HB1 ))
   (  segid "    " and resid 24   and name HG1%)
 ASSI { 2224}
   (( segid "    " and resid 35   and name HD1 ))
   (( segid "    " and resid 35   and name HG2 ))
      2.600     0.800     0.800 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.24817E-02 ppm1      1.537 ppm2      0.940 CV     1
 OR { 2224}
   (( segid "    " and resid 135  and name HD2 ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI { 2226}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HG2 ))
      2.200     0.600     0.600 peak  2226 spectrum    1 weight  0.10000E+01 volume  0.90649E-02 ppm1      1.481 ppm2      0.950 CV     1
 OR { 2226}
   (( segid "    " and resid 135  and name HB2 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2226}
   (( segid "    " and resid 35   and name HB1 ))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 2226}
   (( segid "    " and resid 135  and name HB1 ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI { 2228}
   (( segid "    " and resid 135  and name HD1 ))
   (( segid "    " and resid 135  and name HG2 ))
      2.400     0.700     0.700 peak  2228 spectrum    1 weight  0.10000E+01 volume  0.33840E-02 ppm1      1.432 ppm2      0.935 CV     1
 OR { 2228}
   (( segid "    " and resid 35   and name HD2 ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2229}
   (( segid "    " and resid 33   and name HG2 ))
   (( segid "    " and resid 35   and name HG2 ))
      4.800     2.900     1.200 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.86280E-04 ppm1      1.427 ppm2      0.927 CV     1
 OR { 2229}
   (( segid "    " and resid 133  and name HG2 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 33   and name HG1 ))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 133  and name HG1 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 145  and name HG1 ))
   (( segid "    " and resid 35   and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 45   and name HG2 ))
   (( segid "    " and resid 135  and name HG2 ))
 OR { 2229}
   (( segid "    " and resid 145  and name HG2 ))
   (( segid "    " and resid 35   and name HG2 ))
 ASSI { 2232}
   (  segid "    " and resid 161  and name HG2%)
   (  segid "    " and resid 164  and name HG2%)
      4.300     2.300     1.700 peak  2232 spectrum    1 weight  0.10000E+01 volume  0.60028E-03 ppm1      1.273 ppm2      0.927 CV     1
 OR { 2232}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 64   and name HG1%)
 ASSI { 2246}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 35   and name HG2 ))
      5.500     3.800     0.500 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.14001E-03 ppm1      0.715 ppm2      0.948 CV     1
 OR { 2246}
   (  segid "    " and resid 134  and name HG2%)
   (( segid "    " and resid 135  and name HG2 ))
 ASSI { 2249}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 64   and name HG1%)
      2.100     2.100     3.900 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.11902E-01 ppm1      0.614 ppm2      0.949 CV     1
 OR { 2249}
   (  segid "    " and resid 68   and name HG2%)
   (  segid "    " and resid 164  and name HG2%)
 ASSI { 2256}
   (  segid "    " and resid 139  and name HG2%)
   (  segid "    " and resid 64   and name HG1%)
      1.900     1.900     4.100 peak  2256 spectrum    1 weight  0.10000E+01 volume  0.13638E-01 ppm1      0.472 ppm2      0.950 CV     1
 OR { 2256}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 164  and name HG2%)
 ASSI { 2269}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 21   and name HD2%)
      3.900     3.900     2.100 peak  2269 spectrum    1 weight  0.10000E+01 volume  0.72498E-03 ppm1      4.337 ppm2      0.913 CV     1
 OR { 2269}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 121  and name HD2%)
 ASSI { 2270}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 10   and name HG2%)
      3.100     1.200     1.200 peak  2270 spectrum    1 weight  0.10000E+01 volume  0.28686E-03 ppm1      4.310 ppm2      0.907 CV     1
 OR { 2270}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 110  and name HG2%)
 OR { 2270}
   (( segid "    " and resid 111  and name HA  ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2270}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 10   and name HG1%)
 ASSI { 2271}
   (( segid "    " and resid 21   and name HA  ))
   (  segid "    " and resid 21   and name HD1%)
      2.500     0.800     0.800 peak  2271 spectrum    1 weight  0.10000E+01 volume  0.68184E-02 ppm1      4.281 ppm2      0.876 CV     1
 OR { 2271}
   (( segid "    " and resid 121  and name HA  ))
   (  segid "    " and resid 121  and name HD1%)
 ASSI { 2273}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 172  and name HD1%)
      3.800     1.800     1.800 peak  2273 spectrum    1 weight  0.10000E+01 volume  0.20272E-03 ppm1      3.966 ppm2      0.890 CV     1
 OR { 2273}
   (( segid "    " and resid 145  and name HA  ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI { 2277}
   (( segid "    " and resid 149  and name HB1 ))
   (  segid "    " and resid 72   and name HD1%)
      6.000     4.800     0.000 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.11844E-03 ppm1      3.247 ppm2      0.884 CV     1
 OR { 2277}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 172  and name HD1%)
 ASSI { 2278}
   (( segid "    " and resid 145  and name HE1 ))
   (  segid "    " and resid 72   and name HD1%)
      3.700     1.700     1.700 peak  2278 spectrum    1 weight  0.10000E+01 volume  0.32175E-03 ppm1      3.169 ppm2      0.881 CV     1
 OR { 2278}
   (( segid "    " and resid 45   and name HE2 ))
   (  segid "    " and resid 172  and name HD1%)
 ASSI { 2288}
   (( segid "    " and resid 48   and name HB2 ))
   (  segid "    " and resid 172  and name HD1%)
      2.900     1.000     1.000 peak  2288 spectrum    1 weight  0.10000E+01 volume  0.11788E-02 ppm1      1.917 ppm2      0.905 CV     1
 OR { 2288}
   (( segid "    " and resid 148  and name HB1 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI { 2291}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 172  and name HD1%)
      3.300     3.300     2.700 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.17011E-02 ppm1      1.814 ppm2      0.883 CV     1
 OR { 2291}
   (( segid "    " and resid 145  and name HD1 ))
   (  segid "    " and resid 72   and name HD1%)
 OR { 2291}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 172  and name HD1%)
 OR { 2291}
   (( segid "    " and resid 145  and name HD2 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI { 2294}
   (( segid "    " and resid 119  and name HG2 ))
   (  segid "    " and resid 121  and name HD1%)
      2.900     1.000     1.000 peak  2294 spectrum    1 weight  0.10000E+01 volume  0.21271E-02 ppm1      1.605 ppm2      0.898 CV     1
 OR { 2294}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 21   and name HD1%)
 OR { 2294}
   (( segid "    " and resid 119  and name HG1 ))
   (  segid "    " and resid 121  and name HD1%)
 OR { 2294}
   (( segid "    " and resid 19   and name HG1 ))
   (  segid "    " and resid 21   and name HD1%)
 OR { 2294}
   (( segid "    " and resid 119  and name HG2 ))
   (  segid "    " and resid 121  and name HD2%)
 OR { 2294}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 21   and name HD2%)
 ASSI { 2301}
   (( segid "    " and resid 12   and name HG2 ))
   (  segid "    " and resid 10   and name HG1%)
      4.000     2.000     2.000 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.56014E-04 ppm1      1.401 ppm2      0.897 CV     1
 OR { 2301}
   (( segid "    " and resid 112  and name HG2 ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2301}
   (( segid "    " and resid 11   and name HG2 ))
   (  segid "    " and resid 10   and name HG1%)
 OR { 2301}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 110  and name HG1%)
 OR { 2301}
   (( segid "    " and resid 11   and name HG2 ))
   (  segid "    " and resid 10   and name HG2%)
 OR { 2301}
   (( segid "    " and resid 111  and name HG2 ))
   (  segid "    " and resid 110  and name HG2%)
 ASSI { 2332}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 72   and name HD1%)
      2.200     2.200     3.800 peak  2332 spectrum    1 weight  0.10000E+01 volume  0.92038E-02 ppm1      0.052 ppm2      0.885 CV     1
 OR { 2332}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 172  and name HD1%)
 ASSI { 2344}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 72   and name HD1%)
      6.000     6.000     0.000 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.19404E-04 ppm1      3.292 ppm2      0.859 CV     1
 OR { 2344}
   (( segid "    " and resid 168  and name HA  ))
   (  segid "    " and resid 172  and name HD1%)
 OR { 2344}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 2347}
   (( segid "    " and resid 166  and name HB2 ))
   (  segid "    " and resid 163  and name HG1%)
      6.000     6.000     0.000 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.19551E-04 ppm1      2.259 ppm2      0.838 CV     1
 OR { 2347}
   (( segid "    " and resid 166  and name HB1 ))
   (  segid "    " and resid 163  and name HG1%)
 OR { 2347}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2351}
   (( segid "    " and resid 172  and name HB1 ))
   (  segid "    " and resid 172  and name HD1%)
      2.600     0.800     0.800 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.49551E-02 ppm1      2.085 ppm2      0.868 CV     1
 OR { 2351}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI { 2352}
   (( segid "    " and resid 72   and name HG  ))
   (  segid "    " and resid 72   and name HD1%)
      2.100     0.500     0.500 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.68863E-02 ppm1      2.000 ppm2      0.870 CV     1
 OR { 2352}
   (( segid "    " and resid 172  and name HG  ))
   (  segid "    " and resid 172  and name HD1%)
 ASSI { 2353}
   (  segid "    " and resid 152  and name HB% )
   (  segid "    " and resid 163  and name HG1%)
      2.900     2.900     3.100 peak  2353 spectrum    1 weight  0.10000E+01 volume  0.28767E-02 ppm1      1.822 ppm2      0.852 CV     1
 OR { 2353}
   (  segid "    " and resid 52   and name HB% )
   (  segid "    " and resid 172  and name HD1%)
 ASSI { 2365}
   (  segid "    " and resid 67   and name HD2%)
   (  segid "    " and resid 63   and name HG2%)
      3.600     1.700     1.700 peak  2365 spectrum    1 weight  0.10000E+01 volume  0.92203E-03 ppm1      1.083 ppm2      0.852 CV     1
 OR { 2365}
   (  segid "    " and resid 67   and name HD2%)
   (  segid "    " and resid 172  and name HD1%)
 OR { 2365}
   (  segid "    " and resid 167  and name HD1%)
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 2369}
   (  segid "    " and resid 137  and name HG2%)
   (  segid "    " and resid 137  and name HG1%)
      1.600     1.600     4.400 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.52347E-01 ppm1      0.656 ppm2      0.832 CV     1
 OR { 2369}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 2373}
   (  segid "    " and resid 160  and name HG2%)
   (  segid "    " and resid 37   and name HG1%)
      2.300     2.300     3.700 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.91800E-02 ppm1      0.630 ppm2      0.835 CV     1
 OR { 2373}
   (  segid "    " and resid 60   and name HG2%)
   (  segid "    " and resid 137  and name HG1%)
 ASSI { 2376}
   (  segid "    " and resid 60   and name HD1%)
   (  segid "    " and resid 137  and name HG1%)
      2.700     2.700     3.300 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.61813E-02 ppm1      0.513 ppm2      0.836 CV     1
 OR { 2376}
   (  segid "    " and resid 160  and name HD1%)
   (  segid "    " and resid 37   and name HG1%)
 ASSI { 2382}
   (  segid "    " and resid 163  and name HG2%)
   (  segid "    " and resid 163  and name HG1%)
      2.000     2.000     4.000 peak  2382 spectrum    1 weight  0.10000E+01 volume  0.12974E-01 ppm1     -0.196 ppm2      0.838 CV     1
 OR { 2382}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 63   and name HG2%)
 ASSI { 2383}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
      5.600     4.000     0.400 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.12115E-03 ppm1      4.434 ppm2      0.829 CV     1
 OR { 2383}
   (( segid "    " and resid 162  and name HA  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 2386}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 63   and name HG2%)
      4.200     2.200     1.800 peak  2386 spectrum    1 weight  0.10000E+01 volume  0.54358E-03 ppm1      3.967 ppm2      0.825 CV     1
 OR { 2386}
   (( segid "    " and resid 158  and name HB  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 2387}
   (( segid "    " and resid 76   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
      4.900     3.000     1.100 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.19502E-04 ppm1      3.886 ppm2      0.805 CV     1
 OR { 2387}
   (( segid "    " and resid 176  and name HA  ))
   (( segid "    " and resid 175  and name HB1 ))
 OR { 2387}
   (( segid "    " and resid 76   and name HA  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 2392}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 37   and name HG1%)
      1.900     0.400     0.400 peak  2392 spectrum    1 weight  0.10000E+01 volume  0.16369E-01 ppm1      2.213 ppm2      0.814 CV     1
 OR { 2392}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 137  and name HG1%)
 ASSI { 2400}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 139  and name HG1%)
      4.700     2.700     1.300 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.41679E-03 ppm1      4.074 ppm2      0.781 CV     1
 OR { 2400}
   (( segid "    " and resid 161  and name HB  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI { 2403}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 139  and name HG1%)
      2.800     1.000     1.000 peak  2403 spectrum    1 weight  0.10000E+01 volume  0.32789E-02 ppm1      3.845 ppm2      0.778 CV     1
 OR { 2403}
   (( segid "    " and resid 161  and name HA  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI { 2406}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HB1 ))
      1.600     0.300     0.600 peak  2406 spectrum    1 weight  0.10000E+01 volume  0.15701E-01 ppm1      1.696 ppm2      0.780 CV     1
 OR { 2406}
   (( segid "    " and resid 175  and name HB2 ))
   (( segid "    " and resid 175  and name HB1 ))
 ASSI { 2414}
   (  segid "    " and resid 139  and name HG2%)
   (  segid "    " and resid 139  and name HG1%)
      1.700     1.700     4.300 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.27679E-01 ppm1      0.473 ppm2      0.776 CV     1
 OR { 2414}
   (  segid "    " and resid 39   and name HG2%)
   (  segid "    " and resid 39   and name HG1%)
 ASSI { 2415}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 34   and name HG2%)
      3.300     1.300     1.300 peak  2415 spectrum    1 weight  0.10000E+01 volume  0.17530E-02 ppm1      4.529 ppm2      0.715 CV     1
 OR { 2415}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI { 2419}
   (( segid "    " and resid 36   and name HD1 ))
   (  segid "    " and resid 34   and name HG2%)
      2.700     2.700     3.300 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.61968E-03 ppm1      3.186 ppm2      0.723 CV     1
 OR { 2419}
   (( segid "    " and resid 136  and name HD1 ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI { 2421}
   (( segid "    " and resid 36   and name HD2 ))
   (  segid "    " and resid 34   and name HG2%)
      4.200     2.200     1.800 peak  2421 spectrum    1 weight  0.10000E+01 volume  0.41166E-04 ppm1      3.096 ppm2      0.727 CV     1
 OR { 2421}
   (( segid "    " and resid 136  and name HD2 ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI { 2427}
   (( segid "    " and resid 134  and name HB  ))
   (  segid "    " and resid 134  and name HG2%)
      1.900     0.400     0.400 peak  2427 spectrum    1 weight  0.10000E+01 volume  0.20981E-01 ppm1      1.753 ppm2      0.722 CV     1
 OR { 2427}
   (( segid "    " and resid 34   and name HB  ))
   (  segid "    " and resid 34   and name HG2%)
 OR { 2427}
   (( segid "    " and resid 34   and name HB  ))
   (  segid "    " and resid 34   and name HD1%)
 OR { 2427}
   (( segid "    " and resid 134  and name HB  ))
   (  segid "    " and resid 134  and name HD1%)
 ASSI { 2432}
   (( segid "    " and resid 134  and name HG12))
   (  segid "    " and resid 134  and name HD1%)
      2.000     0.500     0.500 peak  2432 spectrum    1 weight  0.10000E+01 volume  0.15476E-01 ppm1      1.420 ppm2      0.726 CV     1
 OR { 2432}
   (( segid "    " and resid 34   and name HG11))
   (  segid "    " and resid 34   and name HD1%)
 OR { 2432}
   (( segid "    " and resid 134  and name HG12))
   (  segid "    " and resid 134  and name HG2%)
 ASSI { 2434}
   (( segid "    " and resid 34   and name HG12))
   (  segid "    " and resid 34   and name HD1%)
      2.000     0.500     0.500 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.14581E-01 ppm1      1.212 ppm2      0.728 CV     1
 OR { 2434}
   (( segid "    " and resid 134  and name HG11))
   (  segid "    " and resid 134  and name HD1%)
 OR { 2434}
   (( segid "    " and resid 34   and name HG12))
   (  segid "    " and resid 34   and name HG2%)
 ASSI { 2443}
   (( segid "    " and resid 41   and name HB2 ))
   (  segid "    " and resid 137  and name HG2%)
      3.800     1.800     1.800 peak  2443 spectrum    1 weight  0.10000E+01 volume  0.72970E-03 ppm1      3.241 ppm2      0.678 CV     1
 OR { 2443}
   (( segid "    " and resid 141  and name HB1 ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 2444}
   (( segid "    " and resid 141  and name HB2 ))
   (  segid "    " and resid 37   and name HG2%)
      3.400     3.400     2.600 peak  2444 spectrum    1 weight  0.10000E+01 volume  0.15907E-02 ppm1      2.818 ppm2      0.674 CV     1
 OR { 2444}
   (( segid "    " and resid 41   and name HB1 ))
   (  segid "    " and resid 137  and name HG2%)
 ASSI { 2448}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 137  and name HG2%)
      2.800     2.800     3.200 peak  2448 spectrum    1 weight  0.10000E+01 volume  0.28299E-02 ppm1      1.268 ppm2      0.693 CV     1
 OR { 2448}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 34   and name HG2%)
 OR { 2448}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 2455}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 137  and name HG2%)
      1.900     0.400     0.400 peak  2455 spectrum    1 weight  0.10000E+01 volume  0.16159E-01 ppm1      2.213 ppm2      0.660 CV     1
 OR { 2455}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI { 2467}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 167  and name HD2%)
      4.300     2.300     1.700 peak  2467 spectrum    1 weight  0.10000E+01 volume  0.89824E-03 ppm1      4.196 ppm2      0.590 CV     1
 OR { 2467}
   (( segid "    " and resid 171  and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI { 2468}
   (( segid "    " and resid 165  and name HA  ))
   (  segid "    " and resid 168  and name HG2%)
      2.800     1.000     1.000 peak  2468 spectrum    1 weight  0.10000E+01 volume  0.28501E-02 ppm1      3.914 ppm2      0.608 CV     1
 OR { 2468}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2469}
   (( segid "    " and resid 163  and name HA  ))
   (  segid "    " and resid 167  and name HD2%)
      5.100     3.300     0.900 peak  2469 spectrum    1 weight  0.10000E+01 volume  0.76415E-04 ppm1      3.519 ppm2      0.588 CV     1
 OR { 2469}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI { 2470}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
      2.000     2.000     4.000 peak  2470 spectrum    1 weight  0.10000E+01 volume  0.81973E-02 ppm1      3.399 ppm2      0.582 CV     1
 OR { 2470}
   (( segid "    " and resid 164  and name HA  ))
   (  segid "    " and resid 167  and name HD2%)
 OR { 2470}
   (( segid "    " and resid 164  and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2471}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 167  and name HD2%)
      1.900     0.400     0.400 peak  2471 spectrum    1 weight  0.10000E+01 volume  0.13136E-01 ppm1      3.285 ppm2      0.597 CV     1
 OR { 2471}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
 OR { 2471}
   (( segid "    " and resid 168  and name HA  ))
   (  segid "    " and resid 168  and name HG2%)
 OR { 2471}
   (( segid "    " and resid 168  and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI { 2473}
   (( segid "    " and resid 168  and name HB  ))
   (  segid "    " and resid 168  and name HG2%)
      2.000     0.500     0.500 peak  2473 spectrum    1 weight  0.10000E+01 volume  0.11581E-01 ppm1      1.925 ppm2      0.611 CV     1
 OR { 2473}
   (( segid "    " and resid 68   and name HB  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2475}
   (( segid "    " and resid 163  and name HB  ))
   (  segid "    " and resid 68   and name HG2%)
      5.400     3.600     0.600 peak  2475 spectrum    1 weight  0.10000E+01 volume  0.10673E-03 ppm1      1.639 ppm2      0.608 CV     1
 OR { 2475}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 168  and name HG2%)
 OR { 2475}
   (( segid "    " and resid 63   and name HB  ))
   (  segid "    " and resid 60   and name HG2%)
 ASSI { 2483}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 67   and name HD1%)
      1.900     1.900     4.100 peak  2483 spectrum    1 weight  0.10000E+01 volume  0.19775E-01 ppm1      0.954 ppm2      0.590 CV     1
 OR { 2483}
   (  segid "    " and resid 164  and name HG2%)
   (  segid "    " and resid 167  and name HD2%)
 OR { 2483}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 168  and name HG2%)
 ASSI { 2486}
   (  segid "    " and resid 168  and name HG1%)
   (  segid "    " and resid 168  and name HG2%)
      1.900     1.900     4.100 peak  2486 spectrum    1 weight  0.10000E+01 volume  0.18904E-01 ppm1      0.053 ppm2      0.609 CV     1
 OR { 2486}
   (  segid "    " and resid 68   and name HG1%)
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2487}
   (( segid "    " and resid 167  and name HA  ))
   (  segid "    " and resid 167  and name HD2%)
      3.000     1.100     1.100 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.44572E-02 ppm1      4.171 ppm2      0.575 CV     1
 OR { 2487}
   (( segid "    " and resid 67   and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
 OR { 2487}
   (( segid "    " and resid 167  and name HA  ))
   (  segid "    " and resid 67   and name HD1%)
 OR { 2487}
   (( segid "    " and resid 167  and name HA  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI { 2491}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 67   and name HD1%)
      2.200     0.600     0.600 peak  2491 spectrum    1 weight  0.10000E+01 volume  0.56522E-02 ppm1      1.909 ppm2      0.575 CV     1
 OR { 2491}
   (( segid "    " and resid 167  and name HB1 ))
   (  segid "    " and resid 167  and name HD2%)
 OR { 2491}
   (( segid "    " and resid 167  and name HB2 ))
   (  segid "    " and resid 67   and name HD1%)
 OR { 2491}
   (( segid "    " and resid 67   and name HB1 ))
   (  segid "    " and resid 67   and name HD1%)
 OR { 2491}
   (( segid "    " and resid 167  and name HB2 ))
   (  segid "    " and resid 167  and name HD2%)
 OR { 2491}
   (( segid "    " and resid 167  and name HB1 ))
   (  segid "    " and resid 68   and name HG2%)
 OR { 2491}
   (( segid "    " and resid 167  and name HB1 ))
   (  segid "    " and resid 67   and name HD1%)
 OR { 2491}
   (( segid "    " and resid 67   and name HB2 ))
   (  segid "    " and resid 167  and name HD2%)
 ASSI { 2493}
   (  segid "    " and resid 167  and name HD1%)
   (  segid "    " and resid 167  and name HD2%)
      1.700     1.700     4.300 peak  2493 spectrum    1 weight  0.10000E+01 volume  0.22543E-01 ppm1      1.080 ppm2      0.571 CV     1
 OR { 2493}
   (  segid "    " and resid 67   and name HD2%)
   (  segid "    " and resid 67   and name HD1%)
 OR { 2493}
   (  segid "    " and resid 167  and name HD1%)
   (  segid "    " and resid 68   and name HG2%)
 OR { 2493}
   (  segid "    " and resid 67   and name HD2%)
   (  segid "    " and resid 168  and name HG2%)
 ASSI { 2495}
   (  segid "    " and resid 163  and name HG2%)
   (  segid "    " and resid 167  and name HD2%)
      2.600     2.600     3.400 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.10151E-01 ppm1     -0.196 ppm2      0.578 CV     1
 OR { 2495}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 67   and name HD1%)
 OR { 2495}
   (  segid "    " and resid 63   and name HG1%)
   (  segid "    " and resid 168  and name HG2%)
 ASSI { 2498}
   (( segid "    " and resid 150  and name HB2 ))
   (  segid "    " and resid 160  and name HD1%)
      4.000     2.000     2.000 peak  2498 spectrum    1 weight  0.10000E+01 volume  0.67022E-03 ppm1      1.667 ppm2      0.509 CV     1
 OR { 2498}
   (( segid "    " and resid 50   and name HB2 ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 2500}
   (( segid "    " and resid 50   and name HD2 ))
   (  segid "    " and resid 60   and name HD1%)
      3.700     1.700     1.700 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.38552E-03 ppm1      1.556 ppm2      0.512 CV     1
 OR { 2500}
   (( segid "    " and resid 150  and name HD2 ))
   (  segid "    " and resid 160  and name HD1%)
 OR { 2500}
   (( segid "    " and resid 50   and name HD1 ))
   (  segid "    " and resid 60   and name HD1%)
 OR { 2500}
   (( segid "    " and resid 150  and name HD1 ))
   (  segid "    " and resid 160  and name HD1%)
 ASSI { 2502}
   (( segid "    " and resid 150  and name HB1 ))
   (  segid "    " and resid 160  and name HD1%)
      3.000     3.000     3.000 peak  2502 spectrum    1 weight  0.10000E+01 volume  0.29233E-02 ppm1      1.399 ppm2      0.520 CV     1
 OR { 2502}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 2504}
   (( segid "    " and resid 160  and name HG12))
   (  segid "    " and resid 160  and name HD1%)
      2.100     0.500     0.500 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.76485E-02 ppm1      1.273 ppm2      0.530 CV     1
 OR { 2504}
   (( segid "    " and resid 60   and name HG12))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 2505}
   (( segid "    " and resid 150  and name HG2 ))
   (  segid "    " and resid 160  and name HD1%)
      2.500     2.500     3.500 peak  2505 spectrum    1 weight  0.10000E+01 volume  0.42275E-02 ppm1      1.260 ppm2      0.518 CV     1
 OR { 2505}
   (( segid "    " and resid 50   and name HG2 ))
   (  segid "    " and resid 60   and name HD1%)
 OR { 2505}
   (( segid "    " and resid 150  and name HG1 ))
   (  segid "    " and resid 160  and name HD1%)
 OR { 2505}
   (( segid "    " and resid 50   and name HG1 ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 2509}
   (( segid "    " and resid 161  and name HB  ))
   (  segid "    " and resid 39   and name HG2%)
      4.300     2.300     1.700 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.68860E-03 ppm1      4.083 ppm2      0.483 CV     1
 OR { 2509}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 139  and name HG2%)
 ASSI { 2511}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 139  and name HG2%)
      2.300     2.300     3.700 peak  2511 spectrum    1 weight  0.10000E+01 volume  0.86283E-02 ppm1      3.845 ppm2      0.479 CV     1
 OR { 2511}
   (( segid "    " and resid 161  and name HA  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI { 2512}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 39   and name HG2%)
      4.200     2.200     1.800 peak  2512 spectrum    1 weight  0.10000E+01 volume  0.29562E-03 ppm1      2.207 ppm2      0.475 CV     1
 OR { 2512}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 139  and name HG2%)
 OR { 2512}
   (( segid "    " and resid 37   and name HB  ))
   (  segid "    " and resid 160  and name HD1%)
 OR { 2512}
   (( segid "    " and resid 137  and name HB  ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI { 2521}
   (  segid "    " and resid 37   and name HG2%)
   (  segid "    " and resid 39   and name HG2%)
      3.700     1.700     1.700 peak  2521 spectrum    1 weight  0.10000E+01 volume  0.18018E-02 ppm1      0.657 ppm2      0.442 CV     1
 OR { 2521}
   (  segid "    " and resid 137  and name HG2%)
   (  segid "    " and resid 139  and name HG2%)
 ASSI { 2531}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 68   and name HG1%)
      2.300     2.300     3.700 peak  2531 spectrum    1 weight  0.10000E+01 volume  0.59302E-02 ppm1      3.287 ppm2      0.054 CV     1
 OR { 2531}
   (( segid "    " and resid 168  and name HA  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI { 2532}
   (( segid "    " and resid 45   and name HE2 ))
   (  segid "    " and resid 168  and name HG1%)
      3.100     1.200     1.200 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.87839E-03 ppm1      3.166 ppm2      0.051 CV     1
 OR { 2532}
   (( segid "    " and resid 145  and name HE1 ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2534}
   (( segid "    " and resid 72   and name HG  ))
   (  segid "    " and resid 68   and name HG1%)
      3.400     3.400     2.600 peak  2534 spectrum    1 weight  0.10000E+01 volume  0.14997E-02 ppm1      2.004 ppm2      0.062 CV     1
 OR { 2534}
   (( segid "    " and resid 172  and name HG  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI { 2536}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 168  and name HG1%)
      3.000     1.100     1.100 peak  2536 spectrum    1 weight  0.10000E+01 volume  0.19994E-02 ppm1      1.839 ppm2      0.053 CV     1
 OR { 2536}
   (( segid "    " and resid 145  and name HD1 ))
   (  segid "    " and resid 68   and name HG1%)
 OR { 2536}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 168  and name HG1%)
 OR { 2536}
   (( segid "    " and resid 145  and name HD2 ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2539}
   (( segid "    " and resid 45   and name HG2 ))
   (  segid "    " and resid 168  and name HG1%)
      6.000     4.800     0.000 peak  2539 spectrum    1 weight  0.10000E+01 volume  0.58745E-04 ppm1      1.425 ppm2      0.050 CV     1
 OR { 2539}
   (( segid "    " and resid 145  and name HG2 ))
   (  segid "    " and resid 68   and name HG1%)
 OR { 2539}
   (( segid "    " and resid 45   and name HG1 ))
   (  segid "    " and resid 168  and name HG1%)
 OR { 2539}
   (( segid "    " and resid 145  and name HG1 ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2540}
   (  segid "    " and resid 164  and name HG1%)
   (  segid "    " and resid 168  and name HG1%)
      4.100     2.100     1.900 peak  2540 spectrum    1 weight  0.10000E+01 volume  0.51850E-03 ppm1      1.144 ppm2      0.052 CV     1
 OR { 2540}
   (  segid "    " and resid 164  and name HG1%)
   (  segid "    " and resid 68   and name HG1%)
 OR { 2540}
   (  segid "    " and resid 64   and name HG2%)
   (  segid "    " and resid 168  and name HG1%)
 ASSI { 2542}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 68   and name HG1%)
      3.900     1.900     1.900 peak  2542 spectrum    1 weight  0.10000E+01 volume  0.65034E-03 ppm1      0.950 ppm2      0.049 CV     1
 OR { 2542}
   (  segid "    " and resid 64   and name HG1%)
   (  segid "    " and resid 168  and name HG1%)
 OR { 2542}
   (  segid "    " and resid 164  and name HG2%)
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2545}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 168  and name HG1%)
      3.500     1.500     1.500 peak  2545 spectrum    1 weight  0.10000E+01 volume  0.99672E-03 ppm1      0.564 ppm2      0.058 CV     1
 OR { 2545}
   (  segid "    " and resid 167  and name HD2%)
   (  segid "    " and resid 68   and name HG1%)
 ASSI { 2550}
   (( segid "    " and resid 150  and name HA  ))
   (  segid "    " and resid 163  and name HG2%)
      6.000     5.400     0.000 peak  2550 spectrum    1 weight  0.10000E+01 volume  0.19277E-04 ppm1      3.440 ppm2     -0.215 CV     1
 OR { 2550}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 160  and name HG11))
 OR { 2550}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 60   and name HG11))
 ASSI { 2551}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 63   and name HG1%)
      3.600     1.700     1.700 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.90922E-03 ppm1      3.395 ppm2     -0.211 CV     1
 OR { 2551}
   (( segid "    " and resid 164  and name HA  ))
   (  segid "    " and resid 163  and name HG2%)
 ASSI { 2557}
   (  segid "    " and resid 158  and name HG2%)
   (  segid "    " and resid 163  and name HG2%)
      3.300     1.300     1.300 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.86333E-03 ppm1      1.183 ppm2     -0.208 CV     1
 OR { 2557}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2567}
   (( segid "    " and resid 160  and name HA  ))
   (  segid "    " and resid 163  and name HG2%)
      2.000     0.500     0.500 peak  2567 spectrum    1 weight  0.10000E+01 volume  0.62330E-02 ppm1      3.144 ppm2     -0.238 CV     1
 OR { 2567}
   (( segid "    " and resid 160  and name HA  ))
   (( segid "    " and resid 160  and name HG11))
 OR { 2567}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG11))
 ASSI { 2568}
   (( segid "    " and resid 160  and name HB  ))
   (( segid "    " and resid 160  and name HG11))
      2.700     0.900     0.900 peak  2568 spectrum    1 weight  0.10000E+01 volume  0.18419E-02 ppm1      1.630 ppm2     -0.247 CV     1
 OR { 2568}
   (( segid "    " and resid 60   and name HB  ))
   (( segid "    " and resid 60   and name HG11))
 ASSI { 2570}
   (  segid "    " and resid 60   and name HG2%)
   (( segid "    " and resid 60   and name HG11))
      3.200     1.300     1.300 peak  2570 spectrum    1 weight  0.10000E+01 volume  0.25039E-02 ppm1      0.630 ppm2     -0.235 CV     1
 OR { 2570}
   (  segid "    " and resid 160  and name HG2%)
   (( segid "    " and resid 160  and name HG11))
 ASSI { 2572}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HG11))
      2.100     0.500     0.500 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.77389E-02 ppm1      0.515 ppm2     -0.243 CV     1
 OR { 2572}
   (  segid "    " and resid 160  and name HD1%)
   (( segid "    " and resid 160  and name HG11))
 ASSI {    4}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HD1 ))
      2.200     0.600     0.600 peak     4 spectrum    1 weight  0.11000E+01 volume  0.14916E-01 ppm1     10.497 ppm2      7.380 CV     1
 OR {    4}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {    7}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HA  ))
      6.000     4.800     0.000 peak     7 spectrum    1 weight  0.11000E+01 volume  0.96122E-04 ppm1     10.496 ppm2      4.179 CV     1
 OR {    7}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HA  ))
 ASSI {    9}
   (( segid "    " and resid 171  and name HE1 ))
   (  segid "    " and resid 67   and name HD2%)
      3.300     3.300     2.700 peak     9 spectrum    1 weight  0.11000E+01 volume  0.22955E-02 ppm1     10.497 ppm2      1.070 CV     1
 OR {    9}
   (( segid "    " and resid 71   and name HE1 ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {   36}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.200     2.200     3.800 peak    36 spectrum    1 weight  0.11000E+01 volume  0.24856E-02 ppm1      8.343 ppm2      4.144 CV     1
 OR {   36}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {   37}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 127  and name HB% )
      2.300     0.600     0.600 peak    37 spectrum    1 weight  0.11000E+01 volume  0.14576E-01 ppm1      8.344 ppm2      1.361 CV     1
 OR {   37}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 27   and name HB% )
 ASSI {   39}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 125  and name HG1%)
      3.100     3.100     2.900 peak    39 spectrum    1 weight  0.11000E+01 volume  0.32242E-03 ppm1      8.345 ppm2      0.927 CV     1
 OR {   39}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 25   and name HG1%)
 OR {   39}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI {   46}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      2.400     0.700     0.700 peak    46 spectrum    1 weight  0.11000E+01 volume  0.82563E-02 ppm1      9.420 ppm2      1.462 CV     1
 OR {   46}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR {   46}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
 OR {   46}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 OR {   46}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HG12))
 OR {   46}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG11))
 ASSI {   80}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HB1 ))
      2.900     1.000     1.000 peak    80 spectrum    1 weight  0.11000E+01 volume  0.44340E-02 ppm1      8.587 ppm2      1.805 CV     1
 OR {   80}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR {   80}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HB2 ))
 OR {   80}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI {   81}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HG2 ))
      3.100     1.200     1.200 peak    81 spectrum    1 weight  0.11000E+01 volume  0.60139E-02 ppm1      8.586 ppm2      1.610 CV     1
 OR {   81}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HG2 ))
 OR {   81}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HG1 ))
 OR {   81}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HG1 ))
 ASSI {   82}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 137  and name HG1%)
      3.100     1.200     1.200 peak    82 spectrum    1 weight  0.11000E+01 volume  0.59220E-02 ppm1      8.585 ppm2      0.797 CV     1
 OR {   82}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
 ASSI {  107}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HN  ))
      2.000     0.500     0.500 peak   107 spectrum    1 weight  0.11000E+01 volume  0.14074E-01 ppm1      7.954 ppm2      7.488 CV     1
 OR {  107}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
 ASSI {  108}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 174  and name HN  ))
      2.700     0.900     0.900 peak   108 spectrum    1 weight  0.11000E+01 volume  0.46084E-02 ppm1      7.953 ppm2      7.090 CV     1
 OR {  108}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  111}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.600     0.800     0.800 peak   111 spectrum    1 weight  0.11000E+01 volume  0.67010E-02 ppm1      7.954 ppm2      4.555 CV     1
 OR {  111}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI {  114}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.200     0.600     0.600 peak   114 spectrum    1 weight  0.11000E+01 volume  0.13064E-01 ppm1      7.954 ppm2      3.880 CV     1
 OR {  114}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI {  115}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HG2 ))
      3.400     1.400     1.400 peak   115 spectrum    1 weight  0.11000E+01 volume  0.68317E-02 ppm1      7.954 ppm2      2.295 CV     1
 OR {  115}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 176  and name HG2 ))
 OR {  115}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 176  and name HG1 ))
 OR {  115}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HG1 ))
 ASSI {  116}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 176  and name HB2 ))
      1.800     0.400     0.400 peak   116 spectrum    1 weight  0.11000E+01 volume  0.33414E-01 ppm1      7.954 ppm2      1.999 CV     1
 OR {  116}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
 OR {  116}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
 OR {  116}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 176  and name HB1 ))
 ASSI {  117}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      3.300     1.300     1.300 peak   117 spectrum    1 weight  0.11000E+01 volume  0.59238E-02 ppm1      7.955 ppm2      1.707 CV     1
 OR {  117}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI {  118}
   (( segid "    " and resid 176  and name HN  ))
   (  segid "    " and resid 172  and name HD2%)
      3.900     3.900     2.100 peak   118 spectrum    1 weight  0.11000E+01 volume  0.12450E-02 ppm1      7.956 ppm2      1.051 CV     1
 OR {  118}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  119}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HB1 ))
      2.900     1.100     1.100 peak   119 spectrum    1 weight  0.11000E+01 volume  0.37272E-02 ppm1      7.954 ppm2      0.781 CV     1
 OR {  119}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI {  124}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      2.500     0.800     0.800 peak   124 spectrum    1 weight  0.11000E+01 volume  0.48553E-02 ppm1      8.819 ppm2      3.885 CV     1
 OR {  124}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
      4.400     2.400     1.600 peak   128 spectrum    1 weight  0.11000E+01 volume  0.10547E-02 ppm1      8.818 ppm2      1.458 CV     1
 OR {  128}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
 OR {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 133  and name HG2 ))
 OR {  128}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 33   and name HG2 ))
 OR {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 135  and name HD1 ))
 OR {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
 OR {  128}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 33   and name HG1 ))
 OR {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 133  and name HG1 ))
 OR {  128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HG2 ))
 OR {  128}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI {  131}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      2.100     0.500     0.500 peak   131 spectrum    1 weight  0.11000E+01 volume  0.10829E-01 ppm1      8.818 ppm2      4.803 CV     1
 OR {  131}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  137}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB2 ))
      2.400     0.700     0.700 peak   137 spectrum    1 weight  0.11000E+01 volume  0.92126E-02 ppm1      8.401 ppm2      1.748 CV     1
 OR {  137}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  138}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HG2 ))
      4.200     2.200     1.800 peak   138 spectrum    1 weight  0.11000E+01 volume  0.93814E-03 ppm1      8.401 ppm2      1.421 CV     1
 OR {  138}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HG2 ))
 ASSI {  146}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.700     0.900     0.900 peak   146 spectrum    1 weight  0.11000E+01 volume  0.45852E-02 ppm1      8.458 ppm2      1.812 CV     1
 OR {  146}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HB2 ))
 OR {  146}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR {  146}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HB1 ))
 ASSI {  158}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      1.800     0.400     0.400 peak   158 spectrum    1 weight  0.11000E+01 volume  0.35149E-01 ppm1      8.392 ppm2      4.109 CV     1
 OR {  158}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
 ASSI {  159}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB  ))
      2.600     0.800     0.800 peak   159 spectrum    1 weight  0.11000E+01 volume  0.88432E-02 ppm1      8.391 ppm2      2.061 CV     1
 OR {  159}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
 OR {  159}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HB  ))
 OR {  159}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB  ))
 ASSI {  160}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
      2.800     1.000     1.000 peak   160 spectrum    1 weight  0.11000E+01 volume  0.11677E-01 ppm1      8.391 ppm2      0.927 CV     1
 OR {  160}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
 ASSI {  173}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
      3.200     1.300     1.300 peak   173 spectrum    1 weight  0.11000E+01 volume  0.70533E-02 ppm1      9.191 ppm2      2.463 CV     1
 OR {  173}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  173}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
 OR {  173}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  182}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      2.400     0.700     0.700 peak   182 spectrum    1 weight  0.11000E+01 volume  0.84974E-02 ppm1      8.335 ppm2      4.267 CV     1
 OR {  182}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI {  203}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
      2.400     0.700     0.700 peak   203 spectrum    1 weight  0.11000E+01 volume  0.62902E-02 ppm1      7.652 ppm2      4.419 CV     1
 OR {  203}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  204}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.400     0.700     0.700 peak   204 spectrum    1 weight  0.11000E+01 volume  0.42722E-02 ppm1      7.652 ppm2      4.075 CV     1
 OR {  204}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 161  and name HB  ))
 ASSI {  207}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 162  and name HB1 ))
      2.900     1.100     1.100 peak   207 spectrum    1 weight  0.11000E+01 volume  0.68460E-02 ppm1      7.651 ppm2      2.583 CV     1
 OR {  207}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  208}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 160  and name HB  ))
      4.700     2.800     1.300 peak   208 spectrum    1 weight  0.11000E+01 volume  0.79812E-03 ppm1      7.654 ppm2      1.633 CV     1
 OR {  208}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
 ASSI {  209}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.300     1.300     1.300 peak   209 spectrum    1 weight  0.11000E+01 volume  0.53045E-02 ppm1      7.651 ppm2      1.255 CV     1
 OR {  209}
   (( segid "    " and resid 162  and name HN  ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI {  215}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HB2 ))
      2.200     0.600     0.600 peak   215 spectrum    1 weight  0.11000E+01 volume  0.14381E-01 ppm1      8.465 ppm2      2.459 CV     1
 OR {  215}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
 OR {  215}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HB1 ))
 OR {  215}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  225}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.000     0.500     0.500 peak   225 spectrum    1 weight  0.11000E+01 volume  0.26625E-01 ppm1      8.395 ppm2      4.298 CV     1
 OR {  225}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
 ASSI {  227}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
      3.200     1.300     1.300 peak   227 spectrum    1 weight  0.11000E+01 volume  0.29482E-02 ppm1      8.395 ppm2      1.420 CV     1
 OR {  227}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HG2 ))
 OR {  227}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HG1 ))
 ASSI {  232}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
      1.900     0.400     0.400 peak   232 spectrum    1 weight  0.11000E+01 volume  0.15699E-01 ppm1      8.513 ppm2      3.321 CV     1
 OR {  232}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 171  and name HB2 ))
 OR {  232}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
 OR {  232}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 ASSI {  238}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.400     0.700     0.700 peak   238 spectrum    1 weight  0.11000E+01 volume  0.58172E-02 ppm1      7.714 ppm2      2.577 CV     1
 OR {  238}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI {  239}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      2.800     1.000     1.000 peak   239 spectrum    1 weight  0.11000E+01 volume  0.54496E-02 ppm1      7.716 ppm2      2.323 CV     1
 OR {  239}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI {  241}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.200     1.200     1.200 peak   241 spectrum    1 weight  0.11000E+01 volume  0.35722E-02 ppm1      7.715 ppm2      1.256 CV     1
 OR {  241}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI {  242}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 139  and name HG1%)
      2.200     0.600     0.600 peak   242 spectrum    1 weight  0.11000E+01 volume  0.64062E-02 ppm1      7.714 ppm2      0.751 CV     1
 OR {  242}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 39   and name HG1%)
 ASSI {  245}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      2.500     0.800     0.800 peak   245 spectrum    1 weight  0.11000E+01 volume  0.35337E-02 ppm1      8.513 ppm2      9.437 CV     1
 OR {  245}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  247}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      3.000     1.100     1.100 peak   247 spectrum    1 weight  0.11000E+01 volume  0.34354E-02 ppm1      8.514 ppm2      4.483 CV     1
 OR {  247}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI {  248}
   (( segid "    " and resid 171  and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
      3.600     1.600     1.600 peak   248 spectrum    1 weight  0.11000E+01 volume  0.33229E-02 ppm1      8.513 ppm2      1.063 CV     1
 OR {  248}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  249}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
      3.600     1.600     1.600 peak   249 spectrum    1 weight  0.11000E+01 volume  0.35431E-02 ppm1      8.513 ppm2      0.566 CV     1
 OR {  249}
   (( segid "    " and resid 171  and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI {  258}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      4.900     3.000     1.100 peak   258 spectrum    1 weight  0.11000E+01 volume  0.15353E-03 ppm1      8.578 ppm2      8.441 CV     1
 OR {  258}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 5    and name HN  ))
 ASSI {  271}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 3    and name HB2 ))
      2.800     1.000     1.000 peak   271 spectrum    1 weight  0.11000E+01 volume  0.43174E-02 ppm1      8.728 ppm2      1.630 CV     1
 OR {  271}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HB1 ))
 ASSI {  289}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.800     1.000     1.000 peak   289 spectrum    1 weight  0.11000E+01 volume  0.34903E-02 ppm1      8.501 ppm2      4.532 CV     1
 OR {  289}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
 ASSI {  290}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.000     0.500     0.500 peak   290 spectrum    1 weight  0.11000E+01 volume  0.18665E-01 ppm1      8.502 ppm2      4.293 CV     1
 OR {  290}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
 ASSI {  291}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
      2.400     0.700     0.700 peak   291 spectrum    1 weight  0.11000E+01 volume  0.94408E-02 ppm1      8.502 ppm2      1.977 CV     1
 OR {  291}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB2 ))
 OR {  291}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
 OR {  291}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
 ASSI {  292}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.300     1.400     1.400 peak   292 spectrum    1 weight  0.11000E+01 volume  0.31000E-02 ppm1      8.503 ppm2      1.778 CV     1
 OR {  292}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
 OR {  292}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR {  292}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  294}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HG1 ))
      4.300     2.300     1.700 peak   294 spectrum    1 weight  0.11000E+01 volume  0.59799E-03 ppm1      8.499 ppm2      2.506 CV     1
 OR {  294}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
 OR {  294}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HG2 ))
 OR {  294}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG2 ))
 ASSI {  310}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      2.500     0.800     0.800 peak   310 spectrum    1 weight  0.11000E+01 volume  0.43027E-02 ppm1      9.214 ppm2      4.803 CV     1
 OR {  310}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  311}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HB1 ))
      2.800     1.000     1.000 peak   311 spectrum    1 weight  0.11000E+01 volume  0.35886E-02 ppm1      9.214 ppm2      3.229 CV     1
 OR {  311}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {  312}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
      2.600     0.800     0.800 peak   312 spectrum    1 weight  0.11000E+01 volume  0.11906E-01 ppm1      9.214 ppm2      2.822 CV     1
 OR {  312}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 142  and name HB1 ))
 OR {  312}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {  337}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
      2.800     2.800     3.200 peak   337 spectrum    1 weight  0.11000E+01 volume  0.47842E-02 ppm1      9.072 ppm2      0.700 CV     1
 OR {  337}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
 OR {  337}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 34   and name HG2%)
 OR {  337}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI {  348}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HB  ))
      2.100     0.500     0.500 peak   348 spectrum    1 weight  0.11000E+01 volume  0.20452E-01 ppm1      8.231 ppm2      1.746 CV     1
 OR {  348}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HB  ))
 OR {  348}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
 ASSI {  352}
   (( segid "    " and resid 134  and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
      3.200     1.200     1.200 peak   352 spectrum    1 weight  0.11000E+01 volume  0.89560E-02 ppm1      8.230 ppm2      0.715 CV     1
 OR {  352}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 34   and name HG2%)
 ASSI {  357}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 155  and name HG1 ))
      3.400     1.400     1.400 peak   357 spectrum    1 weight  0.11000E+01 volume  0.47657E-02 ppm1      7.894 ppm2      1.881 CV     1
 OR {  357}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HG1 ))
 OR {  357}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HG2 ))
 OR {  357}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 155  and name HG2 ))
 ASSI {  360}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      2.200     0.600     0.600 peak   360 spectrum    1 weight  0.11000E+01 volume  0.78752E-02 ppm1      9.064 ppm2      3.231 CV     1
 OR {  360}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 141  and name HB1 ))
 ASSI {  362}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HB2 ))
      3.100     1.200     1.200 peak   362 spectrum    1 weight  0.11000E+01 volume  0.34888E-02 ppm1      7.893 ppm2      2.792 CV     1
 OR {  362}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
 ASSI {  363}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      2.500     0.800     0.800 peak   363 spectrum    1 weight  0.11000E+01 volume  0.51795E-02 ppm1      7.894 ppm2      2.231 CV     1
 OR {  363}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
 ASSI {  364}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      3.200     1.200     1.200 peak   364 spectrum    1 weight  0.11000E+01 volume  0.34515E-02 ppm1      9.062 ppm2      6.951 CV     1
 OR {  364}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  374}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
      2.600     0.800     0.800 peak   374 spectrum    1 weight  0.11000E+01 volume  0.51651E-02 ppm1      8.397 ppm2      1.737 CV     1
 OR {  374}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HB1 ))
 ASSI {  376}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      2.400     0.700     0.700 peak   376 spectrum    1 weight  0.11000E+01 volume  0.10153E-01 ppm1      8.396 ppm2      4.688 CV     1
 OR {  376}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI {  400}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
      2.100     0.600     0.600 peak   400 spectrum    1 weight  0.11000E+01 volume  0.15242E-01 ppm1      8.089 ppm2      1.632 CV     1
 OR {  400}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
 OR {  400}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
 OR {  400}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI {  401}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      2.800     1.000     1.000 peak   401 spectrum    1 weight  0.11000E+01 volume  0.31491E-02 ppm1      8.088 ppm2      8.385 CV     1
 OR {  401}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
 ASSI {  406}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 151  and name HN  ))
      2.400     0.700     0.700 peak   406 spectrum    1 weight  0.11000E+01 volume  0.53418E-02 ppm1      8.268 ppm2      7.807 CV     1
 OR {  406}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI {  407}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      6.000     6.000     0.000 peak   407 spectrum    1 weight  0.11000E+01 volume  0.54775E-04 ppm1      8.266 ppm2      6.965 CV     1
 OR {  407}
   (( segid "    " and resid 152  and name HN  ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  408}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 152  and name HA  ))
      2.400     0.700     0.700 peak   408 spectrum    1 weight  0.11000E+01 volume  0.68704E-02 ppm1      8.268 ppm2      4.284 CV     1
 OR {  408}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  410}
   (( segid "    " and resid 152  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
      2.300     0.700     0.700 peak   410 spectrum    1 weight  0.11000E+01 volume  0.10296E-01 ppm1      8.268 ppm2      1.547 CV     1
 OR {  410}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
 ASSI {  414}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
      2.300     0.700     0.700 peak   414 spectrum    1 weight  0.11000E+01 volume  0.47772E-02 ppm1      7.914 ppm2      8.840 CV     1
 OR {  414}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI {  427}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      3.000     1.100     1.100 peak   427 spectrum    1 weight  0.11000E+01 volume  0.26478E-02 ppm1      8.182 ppm2      4.149 CV     1
 OR {  427}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {  439}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HB2 ))
      2.200     0.600     0.600 peak   439 spectrum    1 weight  0.11000E+01 volume  0.14582E-01 ppm1      8.344 ppm2      1.772 CV     1
 OR {  439}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
 ASSI {  440}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HG1 ))
      2.800     1.000     1.000 peak   440 spectrum    1 weight  0.11000E+01 volume  0.76664E-02 ppm1      8.344 ppm2      1.450 CV     1
 OR {  440}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HG1 ))
 OR {  440}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HG2 ))
 OR {  440}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI {  447}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HD2 ))
      6.000     6.000     0.000 peak   447 spectrum    1 weight  0.11000E+01 volume  0.17460E-04 ppm1      8.027 ppm2      3.370 CV     1
 OR {  447}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI {  471}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      2.100     0.600     0.600 peak   471 spectrum    1 weight  0.11000E+01 volume  0.83153E-02 ppm1      9.064 ppm2      9.064 CV     1
 OR {  471}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  488}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
      2.200     0.600     0.600 peak   488 spectrum    1 weight  0.11000E+01 volume  0.11331E-01 ppm1      7.803 ppm2      1.547 CV     1
 OR {  488}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 ASSI {  491}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
      2.400     0.700     0.700 peak   491 spectrum    1 weight  0.11000E+01 volume  0.53853E-02 ppm1      8.667 ppm2      1.914 CV     1
 OR {  491}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  491}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  491}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  491}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
 OR {  491}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  491}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
 ASSI {  513}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.300     0.600     0.600 peak   513 spectrum    1 weight  0.11000E+01 volume  0.11552E-01 ppm1      8.256 ppm2      4.263 CV     1
 OR {  513}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI {  532}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
      2.900     1.000     1.000 peak   532 spectrum    1 weight  0.11000E+01 volume  0.34635E-02 ppm1      8.580 ppm2      2.776 CV     1
 OR {  532}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI {  553}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      2.600     0.800     0.800 peak   553 spectrum    1 weight  0.11000E+01 volume  0.52467E-02 ppm1      8.463 ppm2      4.537 CV     1
 OR {  553}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
 ASSI {  568}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HG1 ))
      3.200     1.200     1.200 peak   568 spectrum    1 weight  0.11000E+01 volume  0.50928E-02 ppm1      8.711 ppm2      2.393 CV     1
 OR {  568}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HG2 ))
 ASSI {  569}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      1.900     0.400     0.400 peak   569 spectrum    1 weight  0.11000E+01 volume  0.22028E-01 ppm1      8.711 ppm2      2.162 CV     1
 OR {  569}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
 OR {  569}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR {  569}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
 ASSI {  571}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.300     0.600     0.600 peak   571 spectrum    1 weight  0.11000E+01 volume  0.58513E-02 ppm1      8.575 ppm2      4.157 CV     1
 OR {  571}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  585}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      5.400     3.700     0.600 peak   585 spectrum    1 weight  0.11000E+01 volume  0.20655E-03 ppm1      8.260 ppm2      8.420 CV     1
 OR {  585}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI {  597}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      2.000     0.500     0.500 peak   597 spectrum    1 weight  0.11000E+01 volume  0.22967E-01 ppm1      8.631 ppm2      4.534 CV     1
 OR {  597}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
 OR {  597}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  598}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.400     0.700     0.700 peak   598 spectrum    1 weight  0.11000E+01 volume  0.11748E-01 ppm1      8.631 ppm2      3.929 CV     1
 OR {  598}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
 OR {  598}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB1 ))
 ASSI {  599}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 129  and name HG1%)
      5.000     3.200     1.000 peak   599 spectrum    1 weight  0.11000E+01 volume  0.17997E-04 ppm1      8.632 ppm2      0.963 CV     1
 OR {  599}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 29   and name HG1%)
 OR {  599}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 129  and name HG2%)
 ASSI {  606}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      2.300     0.700     0.700 peak   606 spectrum    1 weight  0.11000E+01 volume  0.88755E-02 ppm1      8.001 ppm2      4.145 CV     1
 OR {  606}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI {  609}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HB2 ))
      2.200     0.600     0.600 peak   609 spectrum    1 weight  0.11000E+01 volume  0.11888E-01 ppm1      8.001 ppm2      1.931 CV     1
 OR {  609}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HG1 ))
 OR {  609}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HG1 ))
 OR {  609}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 OR {  609}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HG2 ))
 ASSI {  611}
   (( segid "    " and resid 155  and name HN  ))
   (  segid "    " and resid 154  and name HB% )
      2.600     0.800     0.800 peak   611 spectrum    1 weight  0.11000E+01 volume  0.88127E-02 ppm1      8.001 ppm2      1.532 CV     1
 OR {  611}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 54   and name HB% )
 ASSI {  613}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 147  and name HN  ))
      2.600     0.800     0.800 peak   613 spectrum    1 weight  0.11000E+01 volume  0.34653E-02 ppm1      8.842 ppm2      8.713 CV     1
 OR {  613}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
 ASSI {  615}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.300     0.600     0.600 peak   615 spectrum    1 weight  0.11000E+01 volume  0.68678E-02 ppm1      8.842 ppm2      3.869 CV     1
 OR {  615}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
 ASSI {  617}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 141  and name HB1 ))
      3.800     1.800     1.800 peak   617 spectrum    1 weight  0.11000E+01 volume  0.74797E-03 ppm1      8.843 ppm2      3.238 CV     1
 OR {  617}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
 ASSI {  619}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
      3.500     1.500     1.500 peak   619 spectrum    1 weight  0.11000E+01 volume  0.11784E-02 ppm1      8.844 ppm2      2.810 CV     1
 OR {  619}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 141  and name HB2 ))
 ASSI {  620}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.000     1.100     1.100 peak   620 spectrum    1 weight  0.11000E+01 volume  0.26956E-02 ppm1      8.843 ppm2      2.167 CV     1
 OR {  620}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
 ASSI {  622}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
      4.700     2.800     1.300 peak   622 spectrum    1 weight  0.11000E+01 volume  0.38778E-03 ppm1      8.841 ppm2      1.474 CV     1
 OR {  622}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
 OR {  622}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG2 ))
 OR {  622}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
 ASSI {  625}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.800     1.000     1.000 peak   625 spectrum    1 weight  0.11000E+01 volume  0.32187E-02 ppm1      8.581 ppm2      4.257 CV     1
 OR {  625}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  641}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      2.300     0.600     0.600 peak   641 spectrum    1 weight  0.11000E+01 volume  0.58844E-02 ppm1      7.710 ppm2      8.516 CV     1
 OR {  641}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 171  and name HN  ))
 ASSI {  645}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.500     0.800     0.800 peak   645 spectrum    1 weight  0.11000E+01 volume  0.50514E-02 ppm1      7.709 ppm2      4.161 CV     1
 OR {  645}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {  646}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.700     2.700     3.300 peak   646 spectrum    1 weight  0.11000E+01 volume  0.35604E-02 ppm1      7.709 ppm2      3.315 CV     1
 OR {  646}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 168  and name HA  ))
 ASSI {  647}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
      2.100     0.500     0.500 peak   647 spectrum    1 weight  0.11000E+01 volume  0.19465E-01 ppm1      7.710 ppm2      2.977 CV     1
 OR {  647}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  649}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
      3.800     1.800     1.800 peak   649 spectrum    1 weight  0.11000E+01 volume  0.11013E-02 ppm1      7.711 ppm2      1.979 CV     1
 OR {  649}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
 OR {  649}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
 ASSI {  651}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
      5.000     3.100     1.000 peak   651 spectrum    1 weight  0.11000E+01 volume  0.35308E-03 ppm1      7.710 ppm2      0.569 CV     1
 OR {  651}
   (( segid "    " and resid 170  and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 OR {  651}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI {  656}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 171  and name HA  ))
      3.900     1.900     1.900 peak   656 spectrum    1 weight  0.11000E+01 volume  0.58962E-03 ppm1      7.457 ppm2      4.213 CV     1
 OR {  656}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI {  659}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HG1 ))
      5.800     4.200     0.200 peak   659 spectrum    1 weight  0.11000E+01 volume  0.28897E-03 ppm1      7.457 ppm2      2.303 CV     1
 OR {  659}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HG1 ))
 OR {  659}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
 OR {  659}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HG2 ))
 ASSI {  661}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      2.300     0.700     0.700 peak   661 spectrum    1 weight  0.11000E+01 volume  0.47340E-02 ppm1      7.456 ppm2      9.437 CV     1
 OR {  661}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  665}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      2.900     1.000     1.000 peak   665 spectrum    1 weight  0.11000E+01 volume  0.30945E-02 ppm1      7.456 ppm2      4.485 CV     1
 OR {  665}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI {  669}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 173  and name HG2 ))
      3.000     1.100     1.100 peak   669 spectrum    1 weight  0.11000E+01 volume  0.51847E-02 ppm1      7.456 ppm2      1.516 CV     1
 OR {  669}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 ASSI {  674}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      2.400     0.700     0.700 peak   674 spectrum    1 weight  0.11000E+01 volume  0.31053E-02 ppm1      8.928 ppm2      8.241 CV     1
 OR {  674}
   (( segid "    " and resid 164  and name HN  ))
   (( segid "    " and resid 163  and name HN  ))
 ASSI {  682}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      2.000     0.500     0.500 peak   682 spectrum    1 weight  0.11000E+01 volume  0.91513E-02 ppm1      8.930 ppm2      1.130 CV     1
 OR {  682}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 164  and name HG1%)
 ASSI {  687}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 163  and name HG2%)
      2.900     1.000     1.000 peak   687 spectrum    1 weight  0.11000E+01 volume  0.33822E-02 ppm1      8.929 ppm2     -0.211 CV     1
 OR {  687}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI {  694}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.400     0.700     0.700 peak   694 spectrum    1 weight  0.11000E+01 volume  0.53318E-02 ppm1      8.866 ppm2      4.955 CV     1
 OR {  694}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 158  and name HA  ))
 ASSI {  697}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
      3.200     1.300     1.300 peak   697 spectrum    1 weight  0.11000E+01 volume  0.35208E-02 ppm1      8.867 ppm2      3.968 CV     1
 OR {  697}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 158  and name HB  ))
 ASSI {  698}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 162  and name HB2 ))
      2.300     0.700     0.700 peak   698 spectrum    1 weight  0.11000E+01 volume  0.51595E-02 ppm1      8.868 ppm2      2.707 CV     1
 OR {  698}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  699}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 162  and name HB1 ))
      3.100     1.200     1.200 peak   699 spectrum    1 weight  0.11000E+01 volume  0.37340E-02 ppm1      8.866 ppm2      2.584 CV     1
 OR {  699}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  700}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      2.800     1.000     1.000 peak   700 spectrum    1 weight  0.11000E+01 volume  0.74383E-02 ppm1      8.867 ppm2      1.173 CV     1
 OR {  700}
   (( segid "    " and resid 159  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
 ASSI {  701}
   (( segid "    " and resid 59   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      3.300     3.300     2.700 peak   701 spectrum    1 weight  0.11000E+01 volume  0.31902E-02 ppm1      8.866 ppm2      0.824 CV     1
 OR {  701}
   (( segid "    " and resid 159  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {  707}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      5.800     4.300     0.200 peak   707 spectrum    1 weight  0.11000E+01 volume  0.55750E-04 ppm1      8.714 ppm2      9.065 CV     1
 OR {  707}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  710}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      2.400     0.800     0.800 peak   710 spectrum    1 weight  0.11000E+01 volume  0.46101E-02 ppm1      8.713 ppm2      8.029 CV     1
 OR {  710}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  713}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.800     1.000     1.000 peak   713 spectrum    1 weight  0.11000E+01 volume  0.35645E-02 ppm1      8.712 ppm2      4.176 CV     1
 OR {  713}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  714}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      2.900     1.000     1.000 peak   714 spectrum    1 weight  0.11000E+01 volume  0.32307E-02 ppm1      8.713 ppm2      3.873 CV     1
 OR {  714}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  716}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HB1 ))
      2.400     0.700     0.700 peak   716 spectrum    1 weight  0.11000E+01 volume  0.36779E-02 ppm1      8.712 ppm2      3.366 CV     1
 OR {  716}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI {  723}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      2.400     0.700     0.700 peak   723 spectrum    1 weight  0.11000E+01 volume  0.35073E-02 ppm1      7.910 ppm2      8.931 CV     1
 OR {  723}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 164  and name HN  ))
 ASSI {  726}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HD21))
      3.500     1.500     1.500 peak   726 spectrum    1 weight  0.11000E+01 volume  0.31156E-02 ppm1      7.909 ppm2      7.423 CV     1
 OR {  726}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 165  and name HD22))
 ASSI {  727}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      3.100     3.100     2.900 peak   727 spectrum    1 weight  0.11000E+01 volume  0.32310E-02 ppm1      7.911 ppm2      6.949 CV     1
 OR {  727}
   (( segid "    " and resid 165  and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 ASSI {  732}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 165  and name HB2 ))
      2.100     0.600     0.600 peak   732 spectrum    1 weight  0.11000E+01 volume  0.58836E-02 ppm1      7.911 ppm2      2.651 CV     1
 OR {  732}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
 ASSI {  733}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
      2.300     0.700     0.700 peak   733 spectrum    1 weight  0.11000E+01 volume  0.30087E-02 ppm1      7.910 ppm2      2.092 CV     1
 OR {  733}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 164  and name HB  ))
 ASSI {  741}
   (( segid "    " and resid 175  and name HD22))
   (( segid "    " and resid 175  and name HD21))
      1.800     0.400     0.400 peak   741 spectrum    1 weight  0.11000E+01 volume  0.73335E-02 ppm1      6.049 ppm2      6.712 CV     1
 OR {  741}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 75   and name HD21))
 ASSI {  748}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
      2.500     0.800     0.800 peak   748 spectrum    1 weight  0.11000E+01 volume  0.42422E-02 ppm1      8.440 ppm2      2.241 CV     1
 OR {  748}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 ASSI {  749}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 157  and name HN  ))
      2.000     0.500     0.500 peak   749 spectrum    1 weight  0.11000E+01 volume  0.99329E-02 ppm1      7.532 ppm2      7.905 CV     1
 OR {  749}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  754}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HG2 ))
      2.100     0.500     0.500 peak   754 spectrum    1 weight  0.11000E+01 volume  0.14892E-01 ppm1      7.531 ppm2      1.695 CV     1
 OR {  754}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
 OR {  754}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
 OR {  754}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 ASSI {  760}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.600     1.600     1.600 peak   760 spectrum    1 weight  0.11000E+01 volume  0.13194E-02 ppm1      8.439 ppm2      4.258 CV     1
 OR {  760}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  764}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 150  and name HD2 ))
      2.700     2.700     3.300 peak   764 spectrum    1 weight  0.11000E+01 volume  0.38746E-02 ppm1      8.440 ppm2      1.540 CV     1
 OR {  764}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI {  767}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      2.100     0.500     0.500 peak   767 spectrum    1 weight  0.11000E+01 volume  0.17391E-01 ppm1      8.233 ppm2      4.819 CV     1
 OR {  767}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI {  768}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      2.100     0.600     0.600 peak   768 spectrum    1 weight  0.11000E+01 volume  0.81849E-02 ppm1      7.532 ppm2      8.006 CV     1
 OR {  768}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  769}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      2.100     0.600     0.600 peak   769 spectrum    1 weight  0.11000E+01 volume  0.10884E-01 ppm1      7.532 ppm2      1.925 CV     1
 OR {  769}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI {  771}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      2.700     0.900     0.900 peak   771 spectrum    1 weight  0.11000E+01 volume  0.46269E-02 ppm1      7.530 ppm2      4.136 CV     1
 OR {  771}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI {  772}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
      2.500     0.800     0.800 peak   772 spectrum    1 weight  0.11000E+01 volume  0.46674E-02 ppm1      7.530 ppm2      3.974 CV     1
 OR {  772}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  773}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 54   and name HB% )
      3.800     1.800     1.800 peak   773 spectrum    1 weight  0.11000E+01 volume  0.99807E-04 ppm1      7.529 ppm2      1.529 CV     1
 OR {  773}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 154  and name HB% )
 ASSI {  775}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.300     2.300     1.700 peak   775 spectrum    1 weight  0.11000E+01 volume  0.77075E-03 ppm1      8.135 ppm2      8.421 CV     1
 OR {  775}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  796}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
      3.600     1.600     1.600 peak   796 spectrum    1 weight  0.11000E+01 volume  0.19581E-02 ppm1      7.497 ppm2      3.871 CV     1
 OR {  796}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
 ASSI {  800}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 173  and name HB2 ))
      1.800     1.800     4.200 peak   800 spectrum    1 weight  0.11000E+01 volume  0.95330E-02 ppm1      7.485 ppm2      1.973 CV     1
 OR {  800}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 OR {  800}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  807}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.700     1.800     1.800 peak   807 spectrum    1 weight  0.11000E+01 volume  0.11820E-02 ppm1      7.484 ppm2      3.871 CV     1
 OR {  807}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
 ASSI {  818}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 157  and name HN  ))
      2.500     0.800     0.800 peak   818 spectrum    1 weight  0.11000E+01 volume  0.88453E-02 ppm1      8.042 ppm2      7.894 CV     1
 OR {  818}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  819}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HA  ))
      2.600     0.800     0.800 peak   819 spectrum    1 weight  0.11000E+01 volume  0.49534E-02 ppm1      8.042 ppm2      4.955 CV     1
 OR {  819}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI {  821}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 57   and name HA1 ))
      2.600     0.800     0.800 peak   821 spectrum    1 weight  0.11000E+01 volume  0.14331E-01 ppm1      8.042 ppm2      3.975 CV     1
 OR {  821}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 157  and name HA1 ))
 OR {  821}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HB  ))
 OR {  821}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB  ))
 ASSI {  835}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      3.100     1.200     1.200 peak   835 spectrum    1 weight  0.11000E+01 volume  0.68584E-02 ppm1      8.273 ppm2      1.258 CV     1
 OR {  835}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI {  842}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
      3.100     1.200     1.200 peak   842 spectrum    1 weight  0.11000E+01 volume  0.48832E-02 ppm1      7.092 ppm2      2.301 CV     1
 OR {  842}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 174  and name HG2 ))
 OR {  842}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HG1 ))
 OR {  842}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 174  and name HG1 ))
 ASSI {  844}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      2.000     0.500     0.500 peak   844 spectrum    1 weight  0.11000E+01 volume  0.13623E-01 ppm1      7.090 ppm2      7.474 CV     1
 OR {  844}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  844}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HN  ))
 OR {  844}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
 ASSI {  847}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
      2.000     0.500     0.500 peak   847 spectrum    1 weight  0.11000E+01 volume  0.11633E-01 ppm1      7.091 ppm2      1.774 CV     1
 OR {  847}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 174  and name HB2 ))
 ASSI {  876}
   (( segid "    " and resid 118  and name HD21))
   (( segid "    " and resid 118  and name HD22))
      2.000     0.500     0.500 peak   876 spectrum    1 weight  0.11000E+01 volume  0.92229E-02 ppm1      6.987 ppm2      7.671 CV     1
 OR {  876}
   (( segid "    " and resid 18   and name HD21))
   (( segid "    " and resid 18   and name HD22))
 ASSI {  897}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HA  ))
      6.000     6.000     0.000 peak   897 spectrum    1 weight  0.11000E+01 volume  0.57385E-04 ppm1      7.465 ppm2      4.140 CV     1
 OR {  897}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  898}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HD2 ))
      2.400     0.700     0.700 peak   898 spectrum    1 weight  0.11000E+01 volume  0.47311E-02 ppm1      7.464 ppm2      3.380 CV     1
 OR {  898}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI {  899}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HD2 ))
      2.300     0.600     0.600 peak   899 spectrum    1 weight  0.11000E+01 volume  0.67888E-02 ppm1      7.464 ppm2      3.258 CV     1
 OR {  899}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HD1 ))
 ASSI {  900}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HB2 ))
      3.300     1.400     1.400 peak   900 spectrum    1 weight  0.11000E+01 volume  0.38925E-02 ppm1      7.465 ppm2      2.112 CV     1
 OR {  900}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI {  924}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HG1 ))
      2.500     0.800     0.800 peak   924 spectrum    1 weight  0.11000E+01 volume  0.64840E-02 ppm1      7.464 ppm2      1.935 CV     1
 OR {  924}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HG2 ))
 OR {  924}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HB1 ))
 ASSI {  925}
   (( segid "    " and resid 148  and name HE  ))
   (( segid "    " and resid 148  and name HG1 ))
      2.600     0.900     0.900 peak   925 spectrum    1 weight  0.11000E+01 volume  0.33975E-02 ppm1      7.464 ppm2      1.659 CV     1
 OR {  925}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HG2 ))
 ASSI {  934}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 38   and name HD21))
      1.600     0.300     0.600 peak   934 spectrum    1 weight  0.11000E+01 volume  0.24010E-01 ppm1      6.619 ppm2      7.288 CV     1
 OR {  934}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 138  and name HD22))
 ASSI {  944}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 138  and name HB1 ))
      2.600     0.800     0.800 peak   944 spectrum    1 weight  0.11000E+01 volume  0.80340E-02 ppm1      6.620 ppm2      2.446 CV     1
 OR {  944}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 138  and name HB2 ))
 OR {  944}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 38   and name HB1 ))
 OR {  944}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 38   and name HB2 ))
 ASSI {  945}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 136  and name HG2 ))
      3.200     1.200     1.200 peak   945 spectrum    1 weight  0.11000E+01 volume  0.28483E-02 ppm1      6.619 ppm2      1.610 CV     1
 OR {  945}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 136  and name HG1 ))
 OR {  945}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 36   and name HG2 ))
 OR {  945}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 36   and name HG1 ))
 ASSI {  957}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 170  and name HD21))
      1.400     0.200     0.800 peak   957 spectrum    1 weight  0.11000E+01 volume  0.43277E-01 ppm1      7.091 ppm2      7.797 CV     1
 OR {  957}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 70   and name HD21))
 ASSI {  959}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 71   and name HA  ))
      2.800     2.800     3.200 peak   959 spectrum    1 weight  0.11000E+01 volume  0.57784E-03 ppm1      7.091 ppm2      4.167 CV     1
 OR {  959}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 171  and name HA  ))
 ASSI {  961}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 169  and name HB2 ))
      3.500     1.500     1.500 peak   961 spectrum    1 weight  0.11000E+01 volume  0.39985E-02 ppm1      7.091 ppm2      2.982 CV     1
 OR {  961}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  963}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 73   and name HN  ))
      3.700     3.700     2.300 peak   963 spectrum    1 weight  0.11000E+01 volume  0.19130E-03 ppm1      7.093 ppm2      7.448 CV     1
 OR {  963}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 173  and name HN  ))
 OR {  963}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 173  and name HN  ))
 ASSI {  978}
   (( segid "    " and resid 40   and name HD21))
   (  segid "    " and resid 134  and name HG2%)
      3.000     3.000     3.000 peak   978 spectrum    1 weight  0.11000E+01 volume  0.36987E-03 ppm1      6.699 ppm2      0.715 CV     1
 OR {  978}
   (( segid "    " and resid 140  and name HD21))
   (  segid "    " and resid 34   and name HG2%)
 ASSI {  991}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HE21))
      1.300     0.200     0.900 peak   991 spectrum    1 weight  0.11000E+01 volume  0.84386E-01 ppm1      6.919 ppm2      7.432 CV     1
 OR {  991}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HE22))
 ASSI {  994}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HG1 ))
      3.000     1.200     1.200 peak   994 spectrum    1 weight  0.11000E+01 volume  0.33167E-02 ppm1      6.919 ppm2      2.567 CV     1
 OR {  994}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HG2 ))
 ASSI {  999}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      2.500     0.800     0.800 peak   999 spectrum    1 weight  0.11000E+01 volume  0.73132E-02 ppm1      8.559 ppm2      8.340 CV     1
 OR {  999}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI { 1001}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      2.200     0.600     0.600 peak  1001 spectrum    1 weight  0.11000E+01 volume  0.12616E-01 ppm1      8.559 ppm2      4.497 CV     1
 OR { 1001}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI { 1002}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HA1 ))
      2.000     0.500     0.500 peak  1002 spectrum    1 weight  0.11000E+01 volume  0.30962E-01 ppm1      8.559 ppm2      4.016 CV     1
 OR { 1002}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA1 ))
 OR { 1002}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA2 ))
 OR { 1002}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HA2 ))
 ASSI { 1006}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      1.300     0.200     0.900 peak  1006 spectrum    1 weight  0.11000E+01 volume  0.96924E-01 ppm1      8.415 ppm2      8.415 CV     1
 OR { 1006}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 1008}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      2.600     0.800     0.800 peak  1008 spectrum    1 weight  0.11000E+01 volume  0.89216E-02 ppm1      8.415 ppm2      4.642 CV     1
 OR { 1008}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 1009}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HA2 ))
      2.200     0.600     0.600 peak  1009 spectrum    1 weight  0.11000E+01 volume  0.11640E-01 ppm1      8.416 ppm2      3.912 CV     1
 OR { 1009}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA1 ))
 ASSI { 1010}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      4.800     2.800     1.200 peak  1010 spectrum    1 weight  0.11000E+01 volume  0.47889E-03 ppm1      8.415 ppm2      3.178 CV     1
 OR { 1010}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HB1 ))
 ASSI { 1020}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HA2 ))
      2.100     0.500     0.500 peak  1020 spectrum    1 weight  0.11000E+01 volume  0.15754E-01 ppm1      7.897 ppm2      3.986 CV     1
 OR { 1020}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA2 ))
 OR { 1020}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA1 ))
 OR { 1020}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HA1 ))
 ASSI {    2}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HZ2 ))
      2.500     0.800     0.800 peak     2 spectrum    1 weight  0.10000E+01 volume  0.55911E-02 ppm1     10.501 ppm2      7.303 CV     1
 OR {    2}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HZ2 ))
 ASSI {    3}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HH2 ))
      4.600     2.600     1.400 peak     3 spectrum    1 weight  0.10000E+01 volume  0.69177E-03 ppm1     10.501 ppm2      6.791 CV     1
 OR {    3}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HH2 ))
 ASSI {    4}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 175  and name HD21))
      3.500     1.500     1.500 peak     4 spectrum    1 weight  0.10000E+01 volume  0.14480E-02 ppm1     10.502 ppm2      6.714 CV     1
 OR {    4}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 75   and name HD21))
 ASSI {    5}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 175  and name HD22))
      4.000     2.000     2.000 peak     5 spectrum    1 weight  0.10000E+01 volume  0.85584E-03 ppm1     10.501 ppm2      6.054 CV     1
 OR {    5}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 75   and name HD22))
 ASSI {    6}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HA  ))
      4.400     2.400     1.600 peak     6 spectrum    1 weight  0.10000E+01 volume  0.56651E-03 ppm1     10.501 ppm2      4.185 CV     1
 OR {    6}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HA  ))
 OR {    6}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 167  and name HA  ))
 OR {    6}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {    7}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.300     2.300     1.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.65072E-03 ppm1     10.502 ppm2      3.339 CV     1
 OR {    7}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 171  and name HB2 ))
 OR {    7}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 71   and name HB1 ))
 ASSI {    9}
   (( segid "    " and resid 171  and name HE1 ))
   (( segid "    " and resid 175  and name HB1 ))
      3.300     1.400     1.400 peak     9 spectrum    1 weight  0.10000E+01 volume  0.15000E-02 ppm1     10.501 ppm2      0.828 CV     1
 OR {    9}
   (( segid "    " and resid 71   and name HE1 ))
   (( segid "    " and resid 75   and name HB1 ))
 OR {    9}
   (( segid "    " and resid 71   and name HE1 ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {   14}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 126  and name HN  ))
      4.800     2.900     1.200 peak    14 spectrum    1 weight  0.10000E+01 volume  0.30143E-03 ppm1      8.345 ppm2      8.245 CV     1
 OR {   14}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
 ASSI {   16}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
      2.600     0.800     0.800 peak    16 spectrum    1 weight  0.10000E+01 volume  0.43752E-02 ppm1      8.345 ppm2      4.601 CV     1
 OR {   16}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
 ASSI {   18}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.500     2.500     3.500 peak    18 spectrum    1 weight  0.10000E+01 volume  0.29283E-02 ppm1      8.345 ppm2      4.156 CV     1
 OR {   18}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 OR {   18}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
 ASSI {   19}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 128  and name HD1 ))
      5.200     3.400     0.800 peak    19 spectrum    1 weight  0.10000E+01 volume  0.26364E-03 ppm1      8.345 ppm2      3.813 CV     1
 OR {   19}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HD2 ))
 ASSI {   20}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HD1 ))
      5.300     3.500     0.700 peak    20 spectrum    1 weight  0.10000E+01 volume  0.25575E-03 ppm1      8.344 ppm2      3.652 CV     1
 OR {   20}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 128  and name HD2 ))
 ASSI {   23}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 125  and name HG1%)
      3.000     3.000     3.000 peak    23 spectrum    1 weight  0.10000E+01 volume  0.13896E-02 ppm1      8.345 ppm2      0.933 CV     1
 OR {   23}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
 OR {   23}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 129  and name HG2%)
 OR {   23}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 29   and name HG1%)
 OR {   23}
   (( segid "    " and resid 127  and name HN  ))
   (  segid "    " and resid 129  and name HG1%)
 ASSI {   26}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      4.000     2.000     2.000 peak    26 spectrum    1 weight  0.10000E+01 volume  0.10535E-02 ppm1      9.424 ppm2      8.825 CV     1
 OR {   26}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
 OR {   26}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {   27}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.300     2.300     1.700 peak    27 spectrum    1 weight  0.10000E+01 volume  0.64438E-03 ppm1      9.423 ppm2      8.465 CV     1
 OR {   27}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI {   29}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      4.500     2.500     1.500 peak    29 spectrum    1 weight  0.10000E+01 volume  0.35725E-03 ppm1      9.424 ppm2      5.170 CV     1
 OR {   29}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
 ASSI {   30}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.200     1.300     1.300 peak    30 spectrum    1 weight  0.10000E+01 volume  0.15993E-02 ppm1      9.424 ppm2      4.812 CV     1
 OR {   30}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {   31}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      1.900     0.400     0.400 peak    31 spectrum    1 weight  0.10000E+01 volume  0.15232E-01 ppm1      9.424 ppm2      4.509 CV     1
 OR {   31}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
 OR {   31}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
 ASSI {   32}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      6.000     5.200     0.000 peak    32 spectrum    1 weight  0.10000E+01 volume  0.49616E-04 ppm1      9.427 ppm2      3.892 CV     1
 OR {   32}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 OR {   32}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
 ASSI {   33}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HE1 ))
      5.500     3.700     0.500 peak    33 spectrum    1 weight  0.10000E+01 volume  0.14759E-03 ppm1      9.426 ppm2      2.815 CV     1
 OR {   33}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HE1 ))
 OR {   33}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HE2 ))
 OR {   33}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HE2 ))
 OR {   33}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 142  and name HB1 ))
 ASSI {   36}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HG1 ))
      3.800     1.800     1.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.13320E-02 ppm1      9.424 ppm2      1.206 CV     1
 OR {   36}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HG1 ))
 OR {   36}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HG12))
 OR {   36}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 134  and name HG11))
 ASSI {   37}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HG2 ))
      3.100     1.200     1.200 peak    37 spectrum    1 weight  0.10000E+01 volume  0.54672E-03 ppm1      9.424 ppm2      0.951 CV     1
 OR {   37}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HG2 ))
 ASSI {   39}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      2.700     0.900     0.900 peak    39 spectrum    1 weight  0.10000E+01 volume  0.32750E-02 ppm1      8.598 ppm2      9.200 CV     1
 OR {   39}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
 OR {   39}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
 ASSI {   40}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.600     2.600     1.400 peak    40 spectrum    1 weight  0.10000E+01 volume  0.55999E-03 ppm1      8.599 ppm2      9.078 CV     1
 OR {   40}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
 ASSI {   42}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      3.400     1.400     1.400 peak    42 spectrum    1 weight  0.10000E+01 volume  0.27624E-02 ppm1      8.598 ppm2      8.468 CV     1
 OR {   42}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
 OR {   42}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
 OR {   42}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI {   43}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 138  and name HD22))
      4.100     2.100     1.900 peak    43 spectrum    1 weight  0.10000E+01 volume  0.61334E-03 ppm1      8.599 ppm2      7.312 CV     1
 OR {   43}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 38   and name HD21))
 OR {   43}
   (( segid "    " and resid 137  and name HN  ))
   (  segid "    " and resid 41   and name HD% )
 OR {   43}
   (( segid "    " and resid 37   and name HN  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {   44}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.000     1.100     1.100 peak    44 spectrum    1 weight  0.10000E+01 volume  0.24693E-02 ppm1      8.599 ppm2      5.176 CV     1
 OR {   44}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
 ASSI {   45}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      3.200     1.300     1.300 peak    45 spectrum    1 weight  0.10000E+01 volume  0.20616E-02 ppm1      8.598 ppm2      5.091 CV     1
 OR {   45}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
 OR {   45}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 38   and name HA  ))
 OR {   45}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
 ASSI {   47}
   (( segid "    " and resid 137  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      2.700     0.900     0.900 peak    47 spectrum    1 weight  0.10000E+01 volume  0.28896E-02 ppm1      8.598 ppm2      4.144 CV     1
 OR {   47}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {   59}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HD21))
      3.500     1.600     1.600 peak    59 spectrum    1 weight  0.10000E+01 volume  0.50740E-03 ppm1      7.958 ppm2      6.714 CV     1
 OR {   59}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HD21))
 ASSI {   60}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HD22))
      3.900     1.900     1.900 peak    60 spectrum    1 weight  0.10000E+01 volume  0.10938E-02 ppm1      7.957 ppm2      6.056 CV     1
 OR {   60}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 175  and name HD22))
 ASSI {   62}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 174  and name HA  ))
      3.300     1.400     1.400 peak    62 spectrum    1 weight  0.10000E+01 volume  0.11396E-02 ppm1      7.958 ppm2      4.256 CV     1
 OR {   62}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {   63}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 173  and name HA  ))
      3.600     1.700     1.700 peak    63 spectrum    1 weight  0.10000E+01 volume  0.73687E-03 ppm1      7.958 ppm2      4.045 CV     1
 OR {   63}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {   67}
   (( segid "    " and resid 176  and name HN  ))
   (( segid "    " and resid 174  and name HB2 ))
      3.600     1.600     1.600 peak    67 spectrum    1 weight  0.10000E+01 volume  0.23815E-02 ppm1      7.957 ppm2      1.802 CV     1
 OR {   67}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
 OR {   67}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {   69}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.200     2.200     1.800 peak    69 spectrum    1 weight  0.10000E+01 volume  0.50570E-03 ppm1      7.958 ppm2      1.565 CV     1
 OR {   69}
   (( segid "    " and resid 76   and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 ASSI {   72}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      3.800     1.800     1.800 peak    72 spectrum    1 weight  0.10000E+01 volume  0.12422E-02 ppm1      8.823 ppm2      9.425 CV     1
 OR {   72}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {   73}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      4.700     2.800     1.300 peak    73 spectrum    1 weight  0.10000E+01 volume  0.71963E-03 ppm1      8.823 ppm2      9.220 CV     1
 OR {   73}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {   81}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HD2 ))
      6.000     6.000     0.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.95785E-04 ppm1      8.823 ppm2      1.857 CV     1
 OR {   81}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 145  and name HD2 ))
 OR {   81}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HD1 ))
 OR {   81}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI {   82}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      3.500     1.600     1.600 peak    82 spectrum    1 weight  0.10000E+01 volume  0.87343E-03 ppm1      8.823 ppm2      1.764 CV     1
 OR {   82}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 133  and name HB1 ))
 ASSI {   84}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 135  and name HG1 ))
      4.600     2.700     1.400 peak    84 spectrum    1 weight  0.10000E+01 volume  0.23464E-03 ppm1      8.823 ppm2      1.205 CV     1
 OR {   84}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 35   and name HG1 ))
 OR {   84}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 134  and name HG11))
 ASSI {   88}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      4.500     2.500     1.500 peak    88 spectrum    1 weight  0.10000E+01 volume  0.53615E-03 ppm1      8.463 ppm2      8.599 CV     1
 OR {   88}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {   91}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HD2 ))
      4.600     2.600     1.400 peak    91 spectrum    1 weight  0.10000E+01 volume  0.41562E-03 ppm1      8.462 ppm2      3.095 CV     1
 OR {   91}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HD2 ))
 ASSI {   94}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
      2.300     0.700     0.700 peak    94 spectrum    1 weight  0.10000E+01 volume  0.75807E-02 ppm1      8.462 ppm2      1.474 CV     1
 OR {   94}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 OR {   94}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
 OR {   94}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
 ASSI {   98}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      4.800     2.800     1.200 peak    98 spectrum    1 weight  0.10000E+01 volume  0.72788E-04 ppm1      8.408 ppm2      4.537 CV     1
 OR {   98}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
 OR {   98}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI {  100}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      6.000     6.000     0.000 peak   100 spectrum    1 weight  0.10000E+01 volume  0.26397E-04 ppm1      8.403 ppm2      8.239 CV     1
 OR {  100}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
 ASSI {  102}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.800     1.000     1.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.27064E-02 ppm1      8.403 ppm2      4.323 CV     1
 OR {  102}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI {  103}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      1.800     0.400     0.400 peak   103 spectrum    1 weight  0.10000E+01 volume  0.28809E-01 ppm1      8.403 ppm2      4.129 CV     1
 OR {  103}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
 ASSI {  106}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HG1 ))
      3.700     1.700     1.700 peak   106 spectrum    1 weight  0.10000E+01 volume  0.14998E-02 ppm1      8.404 ppm2      1.431 CV     1
 OR {  106}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HG1 ))
 OR {  106}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HG2 ))
 OR {  106}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HG2 ))
 ASSI {  107}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 125  and name HG2%)
      3.100     1.200     1.200 peak   107 spectrum    1 weight  0.10000E+01 volume  0.36978E-02 ppm1      8.404 ppm2      0.941 CV     1
 OR {  107}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
 OR {  107}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 125  and name HG1%)
 OR {  107}
   (( segid "    " and resid 11   and name HN  ))
   (  segid "    " and resid 10   and name HG1%)
 OR {  107}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 110  and name HG1%)
 OR {  107}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 OR {  107}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
 OR {  107}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
 OR {  107}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  109}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      3.700     1.700     1.700 peak   109 spectrum    1 weight  0.10000E+01 volume  0.16148E-02 ppm1      9.198 ppm2      8.471 CV     1
 OR {  109}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI {  112}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      2.800     1.000     1.000 peak   112 spectrum    1 weight  0.10000E+01 volume  0.25551E-02 ppm1      9.198 ppm2      8.599 CV     1
 OR {  112}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  114}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HD21))
      4.700     2.700     1.300 peak   114 spectrum    1 weight  0.10000E+01 volume  0.22042E-03 ppm1      9.197 ppm2      7.302 CV     1
 OR {  114}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HD22))
 ASSI {  116}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      4.300     2.300     1.700 peak   116 spectrum    1 weight  0.10000E+01 volume  0.50282E-03 ppm1      9.197 ppm2      4.598 CV     1
 OR {  116}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  117}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
      3.700     1.700     1.700 peak   117 spectrum    1 weight  0.10000E+01 volume  0.59863E-03 ppm1      9.197 ppm2      4.142 CV     1
 OR {  117}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 37   and name HA  ))
 ASSI {  119}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 137  and name HB  ))
      3.800     1.800     1.800 peak   119 spectrum    1 weight  0.10000E+01 volume  0.65568E-03 ppm1      9.196 ppm2      2.206 CV     1
 OR {  119}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 37   and name HB  ))
 OR {  119}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 37   and name HB  ))
 OR {  119}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI {  122}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
      4.000     2.000     2.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.97056E-03 ppm1      9.196 ppm2      0.654 CV     1
 OR {  122}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
 OR {  122}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI {  123}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
      2.700     0.900     0.900 peak   123 spectrum    1 weight  0.10000E+01 volume  0.18893E-02 ppm1      9.196 ppm2      0.472 CV     1
 OR {  123}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 139  and name HG2%)
 ASSI {  125}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
      3.800     1.900     1.900 peak   125 spectrum    1 weight  0.10000E+01 volume  0.15285E-02 ppm1      8.389 ppm2      8.217 CV     1
 OR {  125}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
 ASSI {  128}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 125  and name HG2%)
      2.400     0.700     0.700 peak   128 spectrum    1 weight  0.10000E+01 volume  0.12786E-01 ppm1      8.390 ppm2      0.936 CV     1
 OR {  128}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
 OR {  128}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 OR {  128}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
 OR {  128}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
 OR {  128}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
 ASSI {  129}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
      5.000     3.100     1.000 peak   129 spectrum    1 weight  0.10000E+01 volume  0.10557E-03 ppm1      8.387 ppm2      4.332 CV     1
 OR {  129}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
 ASSI {  131}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.400     0.700     0.700 peak   131 spectrum    1 weight  0.10000E+01 volume  0.81999E-02 ppm1      8.338 ppm2      4.273 CV     1
 OR {  131}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
 OR {  131}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
 OR {  131}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI {  132}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HD2 ))
      2.700     2.700     3.300 peak   132 spectrum    1 weight  0.10000E+01 volume  0.63545E-03 ppm1      8.338 ppm2      1.821 CV     1
 OR {  132}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HD2 ))
 OR {  132}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HD1 ))
 OR {  132}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  133}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
      4.600     2.700     1.400 peak   133 spectrum    1 weight  0.10000E+01 volume  0.24592E-03 ppm1      8.338 ppm2      1.731 CV     1
 OR {  133}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
 OR {  133}
   (( segid "    " and resid 6    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 OR {  133}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
 ASSI {  134}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      2.800     1.000     1.000 peak   134 spectrum    1 weight  0.10000E+01 volume  0.45270E-02 ppm1      8.338 ppm2      1.359 CV     1
 OR {  134}
   (( segid "    " and resid 6    and name HN  ))
   (  segid "    " and resid 6    and name HB% )
 ASSI {  136}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 159  and name HN  ))
      3.600     1.600     1.600 peak   136 spectrum    1 weight  0.10000E+01 volume  0.14571E-02 ppm1      7.658 ppm2      8.882 CV     1
 OR {  136}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
 ASSI {  137}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 161  and name HN  ))
      2.100     0.500     0.500 peak   137 spectrum    1 weight  0.10000E+01 volume  0.81521E-02 ppm1      7.658 ppm2      8.254 CV     1
 OR {  137}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
 OR {  137}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  140}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.500     0.800     0.800 peak   140 spectrum    1 weight  0.10000E+01 volume  0.36585E-02 ppm1      7.658 ppm2      4.084 CV     1
 OR {  140}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 161  and name HB  ))
 OR {  140}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
 OR {  140}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 OR {  140}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 159  and name HB2 ))
 ASSI {  141}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      3.000     1.100     1.100 peak   141 spectrum    1 weight  0.10000E+01 volume  0.22062E-02 ppm1      7.658 ppm2      3.841 CV     1
 OR {  141}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 161  and name HA  ))
 ASSI {  142}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      5.600     3.900     0.400 peak   142 spectrum    1 weight  0.10000E+01 volume  0.17869E-03 ppm1      7.658 ppm2      3.515 CV     1
 OR {  142}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 163  and name HA  ))
 ASSI {  145}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HB  ))
      4.200     2.200     1.800 peak   145 spectrum    1 weight  0.10000E+01 volume  0.14232E-02 ppm1      7.657 ppm2      1.642 CV     1
 OR {  145}
   (( segid "    " and resid 162  and name HN  ))
   (( segid "    " and resid 163  and name HB  ))
 OR {  145}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
 ASSI {  147}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 64   and name HG2%)
      6.000     6.000     0.000 peak   147 spectrum    1 weight  0.10000E+01 volume  0.25211E-04 ppm1      7.658 ppm2      1.161 CV     1
 OR {  147}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
 OR {  147}
   (( segid "    " and resid 162  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
 ASSI {  148}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      3.800     1.800     1.800 peak   148 spectrum    1 weight  0.10000E+01 volume  0.15888E-02 ppm1      7.658 ppm2      0.831 CV     1
 OR {  148}
   (( segid "    " and resid 162  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI {  150}
   (( segid "    " and resid 162  and name HN  ))
   (  segid "    " and resid 163  and name HG2%)
      6.000     4.400     0.000 peak   150 spectrum    1 weight  0.10000E+01 volume  0.99578E-04 ppm1      7.657 ppm2     -0.205 CV     1
 OR {  150}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI {  152}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 137  and name HN  ))
      4.000     2.000     2.000 peak   152 spectrum    1 weight  0.10000E+01 volume  0.92338E-03 ppm1      8.472 ppm2      8.599 CV     1
 OR {  152}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
 ASSI {  154}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HD21))
      4.500     2.500     1.500 peak   154 spectrum    1 weight  0.10000E+01 volume  0.10916E-02 ppm1      8.471 ppm2      7.296 CV     1
 OR {  154}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 138  and name HD22))
 OR {  154}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 41   and name HD% )
 OR {  154}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  160}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HB  ))
      3.700     1.700     1.700 peak   160 spectrum    1 weight  0.10000E+01 volume  0.17474E-02 ppm1      8.471 ppm2      2.205 CV     1
 OR {  160}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 137  and name HB  ))
 ASSI {  161}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      6.000     4.700     0.000 peak   161 spectrum    1 weight  0.10000E+01 volume  0.73933E-04 ppm1      8.472 ppm2      1.811 CV     1
 OR {  161}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 OR {  161}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 139  and name HB  ))
 OR {  161}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
 OR {  161}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
 ASSI {  163}
   (( segid "    " and resid 138  and name HN  ))
   (  segid "    " and resid 137  and name HG2%)
      3.400     1.500     1.500 peak   163 spectrum    1 weight  0.10000E+01 volume  0.44190E-02 ppm1      8.472 ppm2      0.656 CV     1
 OR {  163}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 37   and name HG2%)
 ASSI {  166}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.000     0.500     0.500 peak   166 spectrum    1 weight  0.10000E+01 volume  0.19408E-01 ppm1      8.397 ppm2      4.310 CV     1
 OR {  166}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
 OR {  166}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
 OR {  166}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI {  167}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      2.400     0.700     0.700 peak   167 spectrum    1 weight  0.10000E+01 volume  0.90391E-02 ppm1      8.397 ppm2      1.752 CV     1
 OR {  167}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
 OR {  167}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 OR {  167}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  168}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HG1 ))
      3.400     1.500     1.500 peak   168 spectrum    1 weight  0.10000E+01 volume  0.19073E-02 ppm1      8.397 ppm2      1.438 CV     1
 OR {  168}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HG1 ))
 OR {  168}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HG2 ))
 OR {  168}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HG2 ))
 OR {  168}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HG1 ))
 OR {  168}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HG1 ))
 ASSI {  169}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      4.100     2.100     1.900 peak   169 spectrum    1 weight  0.10000E+01 volume  0.86923E-03 ppm1      7.722 ppm2      9.200 CV     1
 OR {  169}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
 ASSI {  170}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.000     2.000     2.000 peak   170 spectrum    1 weight  0.10000E+01 volume  0.80654E-03 ppm1      7.721 ppm2      9.078 CV     1
 OR {  170}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
 ASSI {  172}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HD22))
      3.600     1.600     1.600 peak   172 spectrum    1 weight  0.10000E+01 volume  0.13227E-02 ppm1      7.721 ppm2      7.413 CV     1
 OR {  172}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HD22))
 ASSI {  173}
   (( segid "    " and resid 40   and name HN  ))
   (  segid "    " and resid 41   and name HE% )
      6.000     6.000     0.000 peak   173 spectrum    1 weight  0.10000E+01 volume  0.24493E-04 ppm1      7.722 ppm2      6.953 CV     1
 OR {  173}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {  174}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HD21))
      3.600     1.600     1.600 peak   174 spectrum    1 weight  0.10000E+01 volume  0.50324E-03 ppm1      7.722 ppm2      6.704 CV     1
 OR {  174}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 40   and name HD21))
 ASSI {  182}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HB  ))
      3.300     1.400     1.400 peak   182 spectrum    1 weight  0.10000E+01 volume  0.18183E-02 ppm1      7.721 ppm2      1.802 CV     1
 OR {  182}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
 ASSI {  191}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 169  and name HN  ))
      5.000     3.100     1.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.13895E-03 ppm1      8.520 ppm2      8.186 CV     1
 OR {  191}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  193}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      3.700     1.700     1.700 peak   193 spectrum    1 weight  0.10000E+01 volume  0.63921E-03 ppm1      8.519 ppm2      7.464 CV     1
 OR {  193}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 173  and name HN  ))
 OR {  193}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 175  and name HN  ))
 ASSI {  194}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HD1 ))
      4.000     2.000     2.000 peak   194 spectrum    1 weight  0.10000E+01 volume  0.15524E-02 ppm1      8.520 ppm2      7.399 CV     1
 OR {  194}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 171  and name HD1 ))
 ASSI {  195}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 171  and name HE3 ))
      4.500     2.600     1.500 peak   195 spectrum    1 weight  0.10000E+01 volume  0.76670E-03 ppm1      8.520 ppm2      7.260 CV     1
 OR {  195}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HE3 ))
 ASSI {  196}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      5.000     3.200     1.000 peak   196 spectrum    1 weight  0.10000E+01 volume  0.27428E-03 ppm1      8.520 ppm2      7.100 CV     1
 OR {  196}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 174  and name HN  ))
 OR {  196}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HD22))
 ASSI {  198}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 169  and name HA  ))
      6.000     5.400     0.000 peak   198 spectrum    1 weight  0.10000E+01 volume  0.25251E-04 ppm1      8.520 ppm2      4.380 CV     1
 OR {  198}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI {  199}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.500     0.800     0.800 peak   199 spectrum    1 weight  0.10000E+01 volume  0.63689E-02 ppm1      8.520 ppm2      4.186 CV     1
 OR {  199}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 171  and name HA  ))
 OR {  199}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {  200}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     6.000     0.000 peak   200 spectrum    1 weight  0.10000E+01 volume  0.24793E-04 ppm1      8.521 ppm2      3.873 CV     1
 OR {  200}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
 ASSI {  202}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 170  and name HB2 ))
      2.500     0.800     0.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.45344E-02 ppm1      8.519 ppm2      3.084 CV     1
 OR {  202}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {  202}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 OR {  202}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 170  and name HB1 ))
 ASSI {  203}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
      3.400     1.400     1.400 peak   203 spectrum    1 weight  0.10000E+01 volume  0.36658E-02 ppm1      8.520 ppm2      2.977 CV     1
 OR {  203}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  204}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
      3.800     1.800     1.800 peak   204 spectrum    1 weight  0.10000E+01 volume  0.25640E-02 ppm1      8.519 ppm2      2.001 CV     1
 OR {  204}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
 OR {  204}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HG  ))
 OR {  204}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 172  and name HG  ))
 ASSI {  205}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.900     3.000     1.100 peak   205 spectrum    1 weight  0.10000E+01 volume  0.35913E-03 ppm1      8.519 ppm2      1.577 CV     1
 OR {  205}
   (( segid "    " and resid 171  and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI {  208}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
      4.700     2.800     1.300 peak   208 spectrum    1 weight  0.10000E+01 volume  0.31740E-03 ppm1      8.519 ppm2      0.053 CV     1
 OR {  208}
   (( segid "    " and resid 171  and name HN  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  214}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.400     0.700     0.700 peak   214 spectrum    1 weight  0.10000E+01 volume  0.80857E-02 ppm1      8.403 ppm2      4.273 CV     1
 OR {  214}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI {  216}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HD2 ))
      4.400     2.400     1.600 peak   216 spectrum    1 weight  0.10000E+01 volume  0.66581E-03 ppm1      8.403 ppm2      1.820 CV     1
 OR {  216}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HD2 ))
 OR {  216}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HD1 ))
 OR {  216}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  217}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      2.900     1.100     1.100 peak   217 spectrum    1 weight  0.10000E+01 volume  0.27296E-02 ppm1      8.404 ppm2      1.735 CV     1
 OR {  217}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB2 ))
 OR {  217}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HB1 ))
 OR {  217}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
 ASSI {  218}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HG2 ))
      4.400     2.400     1.600 peak   218 spectrum    1 weight  0.10000E+01 volume  0.52808E-03 ppm1      8.404 ppm2      1.443 CV     1
 OR {  218}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HG2 ))
 OR {  218}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HG1 ))
 OR {  218}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HG1 ))
 ASSI {  223}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.100     0.600     0.600 peak   223 spectrum    1 weight  0.10000E+01 volume  0.92044E-02 ppm1      8.732 ppm2      4.745 CV     1
 OR {  223}
   (( segid "    " and resid 160  and name HN  ))
   (( segid "    " and resid 159  and name HA  ))
 ASSI {  226}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      2.700     0.900     0.900 peak   226 spectrum    1 weight  0.10000E+01 volume  0.24221E-02 ppm1      8.733 ppm2      3.145 CV     1
 OR {  226}
   (( segid "    " and resid 160  and name HN  ))
   (( segid "    " and resid 160  and name HA  ))
 ASSI {  228}
   (( segid "    " and resid 160  and name HN  ))
   (( segid "    " and resid 160  and name HG12))
      3.500     1.500     1.500 peak   228 spectrum    1 weight  0.10000E+01 volume  0.44439E-02 ppm1      8.733 ppm2      1.271 CV     1
 OR {  228}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI {  229}
   (( segid "    " and resid 160  and name HN  ))
   (  segid "    " and resid 160  and name HG2%)
      2.700     0.900     0.900 peak   229 spectrum    1 weight  0.10000E+01 volume  0.28270E-02 ppm1      8.733 ppm2      0.627 CV     1
 OR {  229}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
 ASSI {  230}
   (( segid "    " and resid 160  and name HN  ))
   (  segid "    " and resid 160  and name HD1%)
      3.800     1.800     1.800 peak   230 spectrum    1 weight  0.10000E+01 volume  0.34101E-02 ppm1      8.733 ppm2      0.510 CV     1
 OR {  230}
   (( segid "    " and resid 60   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI {  231}
   (( segid "    " and resid 160  and name HN  ))
   (( segid "    " and resid 160  and name HG11))
      3.500     1.500     1.500 peak   231 spectrum    1 weight  0.10000E+01 volume  0.29435E-02 ppm1      8.733 ppm2     -0.245 CV     1
 OR {  231}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 60   and name HG11))
 ASSI {  232}
   (( segid "    " and resid 3    and name HN  ))
   (( segid "    " and resid 4    and name HN  ))
      3.800     1.800     1.800 peak   232 spectrum    1 weight  0.10000E+01 volume  0.60800E-03 ppm1      8.707 ppm2      8.561 CV     1
 OR {  232}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI {  238}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA  ))
      2.700     0.900     0.900 peak   238 spectrum    1 weight  0.10000E+01 volume  0.41151E-02 ppm1      8.561 ppm2      4.398 CV     1
 OR {  238}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
 ASSI {  239}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HA  ))
      3.100     1.200     1.200 peak   239 spectrum    1 weight  0.10000E+01 volume  0.17288E-02 ppm1      8.561 ppm2      4.243 CV     1
 OR {  239}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  240}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HG2 ))
      5.200     3.400     0.800 peak   240 spectrum    1 weight  0.10000E+01 volume  0.22619E-03 ppm1      8.561 ppm2      2.292 CV     1
 OR {  240}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HG2 ))
 OR {  240}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HG1 ))
 OR {  240}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HG1 ))
 ASSI {  241}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.000     1.100     1.100 peak   241 spectrum    1 weight  0.10000E+01 volume  0.27234E-02 ppm1      8.561 ppm2      1.947 CV     1
 OR {  241}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
 OR {  241}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 OR {  241}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  248}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG1 ))
      4.000     2.000     2.000 peak   248 spectrum    1 weight  0.10000E+01 volume  0.85608E-03 ppm1      8.504 ppm2      2.499 CV     1
 OR {  248}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HG2 ))
 ASSI {  250}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 111  and name HB1 ))
      2.500     2.500     3.500 peak   250 spectrum    1 weight  0.10000E+01 volume  0.11608E-02 ppm1      8.505 ppm2      1.804 CV     1
 OR {  250}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI {  256}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      4.400     2.400     1.600 peak   256 spectrum    1 weight  0.10000E+01 volume  0.72639E-03 ppm1      9.216 ppm2      8.830 CV     1
 OR {  256}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
 OR {  256}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  258}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 41   and name HD% )
      4.700     2.700     1.300 peak   258 spectrum    1 weight  0.10000E+01 volume  0.60500E-03 ppm1      9.216 ppm2      7.317 CV     1
 OR {  258}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  264}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      6.000     4.700     0.000 peak   264 spectrum    1 weight  0.10000E+01 volume  0.23072E-03 ppm1      9.215 ppm2      6.957 CV     1
 OR {  264}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 ASSI {  265}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      6.000     4.400     0.000 peak   265 spectrum    1 weight  0.10000E+01 volume  0.20734E-03 ppm1      9.215 ppm2      2.180 CV     1
 OR {  265}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
 OR {  265}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR {  265}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
 ASSI {  266}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 145  and name HB2 ))
      4.100     2.100     1.900 peak   266 spectrum    1 weight  0.10000E+01 volume  0.23310E-03 ppm1      9.215 ppm2      2.010 CV     1
 OR {  266}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
 OR {  266}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
 OR {  266}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  267}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 34   and name HG2%)
      4.000     2.000     2.000 peak   267 spectrum    1 weight  0.10000E+01 volume  0.60207E-03 ppm1      9.215 ppm2      0.725 CV     1
 OR {  267}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI {  275}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HB  ))
      2.200     0.600     0.600 peak   275 spectrum    1 weight  0.10000E+01 volume  0.92179E-02 ppm1      8.203 ppm2      2.048 CV     1
 OR {  275}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HB  ))
 ASSI {  276}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.600     0.900     0.900 peak   276 spectrum    1 weight  0.10000E+01 volume  0.38799E-02 ppm1      8.202 ppm2      4.125 CV     1
 OR {  276}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
 ASSI {  278}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HG2 ))
      4.000     2.000     2.000 peak   278 spectrum    1 weight  0.10000E+01 volume  0.11643E-02 ppm1      8.203 ppm2      1.608 CV     1
 OR {  278}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HG2 ))
 OR {  278}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HG1 ))
 OR {  278}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HG1 ))
 ASSI {  279}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      2.600     0.800     0.800 peak   279 spectrum    1 weight  0.10000E+01 volume  0.87651E-02 ppm1      8.203 ppm2      0.945 CV     1
 OR {  279}
   (( segid "    " and resid 124  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
 OR {  279}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 OR {  279}
   (( segid "    " and resid 124  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI {  290}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 15   and name HE% )
      4.600     2.600     1.400 peak   290 spectrum    1 weight  0.10000E+01 volume  0.41803E-03 ppm1      8.414 ppm2      7.273 CV     1
 OR {  290}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 115  and name HE% )
 ASSI {  292}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      2.500     0.800     0.800 peak   292 spectrum    1 weight  0.10000E+01 volume  0.51868E-02 ppm1      8.415 ppm2      4.660 CV     1
 OR {  292}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  293}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.000     0.500     0.500 peak   293 spectrum    1 weight  0.10000E+01 volume  0.11921E-01 ppm1      8.415 ppm2      4.325 CV     1
 OR {  293}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
 ASSI {  294}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HB  ))
      2.700     0.900     0.900 peak   294 spectrum    1 weight  0.10000E+01 volume  0.22332E-02 ppm1      8.415 ppm2      4.153 CV     1
 OR {  294}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI {  295}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      2.900     1.000     1.000 peak   295 spectrum    1 weight  0.10000E+01 volume  0.22691E-02 ppm1      8.415 ppm2      3.185 CV     1
 OR {  295}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB1 ))
 ASSI {  296}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB2 ))
      3.100     1.200     1.200 peak   296 spectrum    1 weight  0.10000E+01 volume  0.40599E-02 ppm1      8.415 ppm2      3.029 CV     1
 OR {  296}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB2 ))
 ASSI {  297}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      4.400     2.400     1.600 peak   297 spectrum    1 weight  0.10000E+01 volume  0.10640E-02 ppm1      8.415 ppm2      1.129 CV     1
 OR {  297}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 14   and name HG2%)
 ASSI {  301}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      2.100     0.600     0.600 peak   301 spectrum    1 weight  0.10000E+01 volume  0.12309E-01 ppm1      8.245 ppm2      4.537 CV     1
 OR {  301}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
 ASSI {  302}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HB1 ))
      3.700     1.700     1.700 peak   302 spectrum    1 weight  0.10000E+01 volume  0.16531E-02 ppm1      8.245 ppm2      3.881 CV     1
 OR {  302}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
 ASSI {  303}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HB  ))
      2.800     1.000     1.000 peak   303 spectrum    1 weight  0.10000E+01 volume  0.42296E-02 ppm1      8.245 ppm2      2.080 CV     1
 OR {  303}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB  ))
 ASSI {  305}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      6.000     5.500     0.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.50141E-04 ppm1      8.245 ppm2      8.488 CV     1
 OR {  305}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
 ASSI {  306}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.300     1.300     1.300 peak   306 spectrum    1 weight  0.10000E+01 volume  0.58480E-02 ppm1      8.245 ppm2      4.824 CV     1
 OR {  306}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  307}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      3.000     1.100     1.100 peak   307 spectrum    1 weight  0.10000E+01 volume  0.16883E-02 ppm1      8.244 ppm2      4.113 CV     1
 OR {  307}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI {  309}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      2.800     1.000     1.000 peak   309 spectrum    1 weight  0.10000E+01 volume  0.19706E-02 ppm1      9.076 ppm2      9.425 CV     1
 OR {  309}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {  310}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      4.200     2.200     1.800 peak   310 spectrum    1 weight  0.10000E+01 volume  0.73837E-03 ppm1      9.077 ppm2      9.215 CV     1
 OR {  310}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
 ASSI {  313}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 41   and name HD% )
      3.300     1.400     1.400 peak   313 spectrum    1 weight  0.10000E+01 volume  0.15022E-02 ppm1      9.075 ppm2      7.317 CV     1
 OR {  313}
   (( segid "    " and resid 141  and name HN  ))
   (  segid "    " and resid 141  and name HD% )
 ASSI {  314}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      1.900     0.400     0.400 peak   314 spectrum    1 weight  0.10000E+01 volume  0.14297E-01 ppm1      9.076 ppm2      5.174 CV     1
 OR {  314}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
 ASSI {  315}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      3.300     1.300     1.300 peak   315 spectrum    1 weight  0.10000E+01 volume  0.19286E-02 ppm1      9.077 ppm2      4.600 CV     1
 OR {  315}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
 ASSI {  316}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.800     1.800     1.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.12205E-02 ppm1      9.076 ppm2      4.512 CV     1
 OR {  316}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
 OR {  316}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
 OR {  316}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 134  and name HA  ))
 ASSI {  318}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HB2 ))
      4.100     2.100     1.900 peak   318 spectrum    1 weight  0.10000E+01 volume  0.88603E-03 ppm1      9.077 ppm2      2.587 CV     1
 OR {  318}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
 ASSI {  319}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
      3.600     1.600     1.600 peak   319 spectrum    1 weight  0.10000E+01 volume  0.16786E-02 ppm1      9.076 ppm2      2.331 CV     1
 OR {  319}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI {  320}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      3.200     1.300     1.300 peak   320 spectrum    1 weight  0.10000E+01 volume  0.12990E-02 ppm1      9.076 ppm2      1.473 CV     1
 OR {  320}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR {  320}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
 OR {  320}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 OR {  320}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
 OR {  320}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
 ASSI {  324}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.800     1.800     1.800 peak   324 spectrum    1 weight  0.10000E+01 volume  0.17198E-02 ppm1      8.232 ppm2      9.426 CV     1
 OR {  324}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
 ASSI {  325}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 159  and name HN  ))
      6.000     5.900     0.000 peak   325 spectrum    1 weight  0.10000E+01 volume  0.25105E-04 ppm1      8.231 ppm2      8.826 CV     1
 OR {  325}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
 OR {  325}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
 ASSI {  327}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      1.800     1.800     4.200 peak   327 spectrum    1 weight  0.10000E+01 volume  0.39533E-01 ppm1      8.233 ppm2      4.415 CV     1
 OR {  327}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
 OR {  327}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  328}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 132  and name HA2 ))
      5.400     3.600     0.600 peak   328 spectrum    1 weight  0.10000E+01 volume  0.10672E-03 ppm1      8.233 ppm2      4.024 CV     1
 OR {  328}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HA2 ))
 OR {  328}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HA1 ))
 OR {  328}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 132  and name HA1 ))
 ASSI {  331}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HG11))
      2.500     0.800     0.800 peak   331 spectrum    1 weight  0.10000E+01 volume  0.69277E-02 ppm1      8.232 ppm2      1.418 CV     1
 OR {  331}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HG12))
 OR {  331}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HG2 ))
 OR {  331}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HG2 ))
 ASSI {  332}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 134  and name HG11))
      2.500     0.800     0.800 peak   332 spectrum    1 weight  0.10000E+01 volume  0.71264E-02 ppm1      8.232 ppm2      1.205 CV     1
 OR {  332}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HG12))
 OR {  332}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI {  333}
   (( segid "    " and resid 134  and name HN  ))
   (  segid "    " and resid 134  and name HD1%)
      2.900     1.000     1.000 peak   333 spectrum    1 weight  0.10000E+01 volume  0.74254E-02 ppm1      8.232 ppm2      0.722 CV     1
 OR {  333}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 34   and name HD1%)
 OR {  333}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 34   and name HG2%)
 ASSI {  335}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.400     0.700     0.700 peak   335 spectrum    1 weight  0.10000E+01 volume  0.44894E-02 ppm1      7.902 ppm2      8.447 CV     1
 OR {  335}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HN  ))
 ASSI {  336}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      2.200     0.600     0.600 peak   336 spectrum    1 weight  0.10000E+01 volume  0.78123E-02 ppm1      7.902 ppm2      8.011 CV     1
 OR {  336}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  338}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
      4.200     2.200     1.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.64056E-03 ppm1      7.902 ppm2      7.539 CV     1
 OR {  338}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 156  and name HN  ))
 ASSI {  339}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
      2.300     0.600     0.600 peak   339 spectrum    1 weight  0.10000E+01 volume  0.12266E-01 ppm1      7.902 ppm2      4.232 CV     1
 OR {  339}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI {  340}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      6.000     6.000     0.000 peak   340 spectrum    1 weight  0.10000E+01 volume  0.56851E-04 ppm1      7.902 ppm2      4.135 CV     1
 OR {  340}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
 ASSI {  341}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      2.900     1.000     1.000 peak   341 spectrum    1 weight  0.10000E+01 volume  0.33112E-02 ppm1      7.902 ppm2      3.975 CV     1
 OR {  341}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
 ASSI {  342}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      3.600     1.600     1.600 peak   342 spectrum    1 weight  0.10000E+01 volume  0.68719E-03 ppm1      7.902 ppm2      3.442 CV     1
 OR {  342}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI {  345}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      5.900     4.400     0.100 peak   345 spectrum    1 weight  0.10000E+01 volume  0.16859E-03 ppm1      7.903 ppm2      2.119 CV     1
 OR {  345}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 155  and name HB1 ))
 ASSI {  347}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 52   and name HB% )
      4.000     2.000     2.000 peak   347 spectrum    1 weight  0.10000E+01 volume  0.13114E-02 ppm1      7.902 ppm2      1.825 CV     1
 OR {  347}
   (( segid "    " and resid 154  and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {  348}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
      4.600     2.600     1.400 peak   348 spectrum    1 weight  0.10000E+01 volume  0.35281E-03 ppm1      7.903 ppm2      1.657 CV     1
 OR {  348}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 156  and name HG2 ))
 OR {  348}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 OR {  348}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
 ASSI {  350}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 150  and name HG2 ))
      3.100     3.100     2.900 peak   350 spectrum    1 weight  0.10000E+01 volume  0.32113E-03 ppm1      7.903 ppm2      1.269 CV     1
 OR {  350}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {  350}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 150  and name HG1 ))
 OR {  350}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI {  351}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
      4.600     2.600     1.400 peak   351 spectrum    1 weight  0.10000E+01 volume  0.53768E-03 ppm1      7.903 ppm2      1.179 CV     1
 OR {  351}
   (( segid "    " and resid 154  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
 ASSI {  352}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      3.600     1.600     1.600 peak   352 spectrum    1 weight  0.10000E+01 volume  0.11196E-02 ppm1      7.901 ppm2      8.273 CV     1
 OR {  352}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 152  and name HN  ))
 ASSI {  354}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
      5.100     3.300     0.900 peak   354 spectrum    1 weight  0.10000E+01 volume  0.10725E-03 ppm1      9.068 ppm2      3.968 CV     1
 OR {  354}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
 OR {  354}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
 OR {  354}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
 ASSI {  355}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
      2.500     0.800     0.800 peak   355 spectrum    1 weight  0.10000E+01 volume  0.73854E-02 ppm1      9.068 ppm2      3.243 CV     1
 OR {  355}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
 OR {  355}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 ASSI {  356}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 52   and name HB% )
      4.000     2.000     2.000 peak   356 spectrum    1 weight  0.10000E+01 volume  0.10103E-02 ppm1      9.068 ppm2      1.795 CV     1
 OR {  356}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 OR {  356}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HB  ))
 OR {  356}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 139  and name HB  ))
 OR {  356}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 136  and name HB1 ))
 OR {  356}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 136  and name HB2 ))
 OR {  356}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 134  and name HB  ))
 OR {  356}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI {  357}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
      6.000     6.000     0.000 peak   357 spectrum    1 weight  0.10000E+01 volume  0.25317E-04 ppm1      9.068 ppm2      1.546 CV     1
 OR {  357}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 OR {  357}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HD1 ))
 OR {  357}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HD1 ))
 OR {  357}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HD2 ))
 OR {  357}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HD2 ))
 OR {  357}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
 OR {  357}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 135  and name HD2 ))
 ASSI {  358}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
      6.000     6.000     0.000 peak   358 spectrum    1 weight  0.10000E+01 volume  0.24859E-04 ppm1      9.069 ppm2      1.275 CV     1
 OR {  358}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HG1 ))
 OR {  358}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 47   and name HG2%)
 OR {  358}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 147  and name HG2%)
 OR {  358}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {  358}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HG2 ))
 OR {  358}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 160  and name HG12))
 ASSI {  360}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      2.700     0.900     0.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.21792E-02 ppm1      9.067 ppm2      4.880 CV     1
 OR {  360}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  361}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.500     1.500     1.500 peak   361 spectrum    1 weight  0.10000E+01 volume  0.82487E-03 ppm1      9.067 ppm2      4.172 CV     1
 OR {  361}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  362}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      3.500     1.500     1.500 peak   362 spectrum    1 weight  0.10000E+01 volume  0.13279E-02 ppm1      9.067 ppm2      3.865 CV     1
 OR {  362}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  363}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.100     0.500     0.500 peak   363 spectrum    1 weight  0.10000E+01 volume  0.41556E-02 ppm1      9.067 ppm2      3.097 CV     1
 OR {  363}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
 ASSI {  364}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HB2 ))
      3.300     1.400     1.400 peak   364 spectrum    1 weight  0.10000E+01 volume  0.80105E-03 ppm1      9.067 ppm2      2.097 CV     1
 OR {  364}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI {  365}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      2.900     1.100     1.100 peak   365 spectrum    1 weight  0.10000E+01 volume  0.21250E-02 ppm1      9.067 ppm2      1.938 CV     1
 OR {  365}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HB1 ))
 OR {  365}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HG1 ))
 ASSI {  366}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 72   and name HD2%)
      4.000     2.000     2.000 peak   366 spectrum    1 weight  0.10000E+01 volume  0.52464E-03 ppm1      9.067 ppm2      1.056 CV     1
 OR {  366}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 172  and name HD2%)
 ASSI {  370}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      5.500     3.800     0.500 peak   370 spectrum    1 weight  0.10000E+01 volume  0.51662E-04 ppm1      8.241 ppm2      7.919 CV     1
 OR {  370}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 165  and name HN  ))
 ASSI {  371}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 149  and name HZ  ))
      4.900     3.000     1.100 peak   371 spectrum    1 weight  0.10000E+01 volume  0.54099E-03 ppm1      8.241 ppm2      6.608 CV     1
 OR {  371}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 49   and name HZ  ))
 ASSI {  378}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      3.300     1.300     1.300 peak   378 spectrum    1 weight  0.10000E+01 volume  0.12242E-02 ppm1      8.400 ppm2      8.585 CV     1
 OR {  378}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
 ASSI {  382}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.400     0.700     0.700 peak   382 spectrum    1 weight  0.10000E+01 volume  0.51551E-02 ppm1      8.400 ppm2      4.307 CV     1
 OR {  382}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
 OR {  382}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
 OR {  382}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  383}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB1 ))
      5.900     4.300     0.100 peak   383 spectrum    1 weight  0.10000E+01 volume  0.48412E-04 ppm1      8.399 ppm2      3.174 CV     1
 OR {  383}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB1 ))
 OR {  383}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HD1 ))
 OR {  383}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HD1 ))
 ASSI {  384}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.500     2.500     1.500 peak   384 spectrum    1 weight  0.10000E+01 volume  0.40484E-03 ppm1      8.400 ppm2      2.864 CV     1
 OR {  384}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
 ASSI {  385}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HB2 ))
      4.000     2.000     2.000 peak   385 spectrum    1 weight  0.10000E+01 volume  0.77554E-03 ppm1      8.400 ppm2      2.766 CV     1
 OR {  385}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI {  386}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HB2 ))
      2.900     1.000     1.000 peak   386 spectrum    1 weight  0.10000E+01 volume  0.24529E-02 ppm1      8.400 ppm2      1.876 CV     1
 OR {  386}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  388}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HG1 ))
      3.400     1.400     1.400 peak   388 spectrum    1 weight  0.10000E+01 volume  0.36315E-02 ppm1      8.400 ppm2      1.606 CV     1
 OR {  388}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
 OR {  388}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HG2 ))
 OR {  388}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HG2 ))
 ASSI {  391}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 48   and name HG2 ))
      3.000     1.100     1.100 peak   391 spectrum    1 weight  0.10000E+01 volume  0.28209E-02 ppm1      8.270 ppm2      1.656 CV     1
 OR {  391}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
 OR {  391}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 OR {  391}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
 OR {  391}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 156  and name HG2 ))
 OR {  391}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 163  and name HB  ))
 ASSI {  393}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      2.400     0.700     0.700 peak   393 spectrum    1 weight  0.10000E+01 volume  0.34268E-02 ppm1      8.240 ppm2      7.659 CV     1
 OR {  393}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 162  and name HN  ))
 ASSI {  394}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
      5.000     3.200     1.000 peak   394 spectrum    1 weight  0.10000E+01 volume  0.42223E-03 ppm1      8.241 ppm2      6.505 CV     1
 OR {  394}
   (( segid "    " and resid 163  and name HN  ))
   (  segid "    " and resid 149  and name HE% )
 ASSI {  396}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      4.400     2.400     1.600 peak   396 spectrum    1 weight  0.10000E+01 volume  0.71464E-03 ppm1      8.240 ppm2      3.146 CV     1
 OR {  396}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 160  and name HA  ))
 ASSI {  397}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB2 ))
      2.900     1.100     1.100 peak   397 spectrum    1 weight  0.10000E+01 volume  0.23988E-02 ppm1      8.240 ppm2      2.709 CV     1
 OR {  397}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 162  and name HB2 ))
 ASSI {  398}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 162  and name HB1 ))
      2.700     0.900     0.900 peak   398 spectrum    1 weight  0.10000E+01 volume  0.25570E-02 ppm1      8.240 ppm2      2.588 CV     1
 OR {  398}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB1 ))
 ASSI {  399}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 143  and name HB2 ))
      6.000     6.000     0.000 peak   399 spectrum    1 weight  0.10000E+01 volume  0.24845E-04 ppm1      8.241 ppm2      2.102 CV     1
 OR {  399}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
 OR {  399}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 64   and name HB  ))
 OR {  399}
   (( segid "    " and resid 163  and name HN  ))
   (( segid "    " and resid 164  and name HB  ))
 ASSI {  402}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      5.300     3.500     0.700 peak   402 spectrum    1 weight  0.10000E+01 volume  0.20180E-03 ppm1      8.240 ppm2      0.620 CV     1
 OR {  402}
   (( segid "    " and resid 163  and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI {  407}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HD2 ))
      6.000     6.000     0.000 peak   407 spectrum    1 weight  0.10000E+01 volume  0.24323E-04 ppm1      8.156 ppm2      3.200 CV     1
 OR {  407}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HD2 ))
 OR {  407}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HD1 ))
 OR {  407}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HD1 ))
 ASSI {  408}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      3.500     1.500     1.500 peak   408 spectrum    1 weight  0.10000E+01 volume  0.21998E-02 ppm1      8.154 ppm2      8.262 CV     1
 OR {  408}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  412}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      2.000     0.500     0.500 peak   412 spectrum    1 weight  0.10000E+01 volume  0.16235E-01 ppm1      8.155 ppm2      4.237 CV     1
 OR {  412}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  413}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HG2 ))
      5.000     3.100     1.000 peak   413 spectrum    1 weight  0.10000E+01 volume  0.35736E-03 ppm1      8.155 ppm2      2.272 CV     1
 OR {  413}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HG2 ))
 OR {  413}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HG1 ))
 OR {  413}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HG1 ))
 ASSI {  414}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB1 ))
      3.400     1.500     1.500 peak   414 spectrum    1 weight  0.10000E+01 volume  0.21247E-02 ppm1      8.155 ppm2      2.053 CV     1
 OR {  414}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
 ASSI {  415}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      4.600     2.700     1.400 peak   415 spectrum    1 weight  0.10000E+01 volume  0.83949E-03 ppm1      8.155 ppm2      1.968 CV     1
 OR {  415}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI {  417}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB2 ))
      2.400     0.700     0.700 peak   417 spectrum    1 weight  0.10000E+01 volume  0.78549E-02 ppm1      8.155 ppm2      1.767 CV     1
 OR {  417}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
 OR {  417}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB1 ))
 OR {  417}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI {  418}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HG1 ))
      3.000     1.100     1.100 peak   418 spectrum    1 weight  0.10000E+01 volume  0.37293E-02 ppm1      8.155 ppm2      1.616 CV     1
 OR {  418}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HG1 ))
 OR {  418}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HG2 ))
 OR {  418}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HG2 ))
 ASSI {  419}
   (( segid "    " and resid 123  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
      4.200     2.200     1.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.53621E-03 ppm1      8.155 ppm2      0.941 CV     1
 OR {  419}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
 OR {  419}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 OR {  419}
   (( segid "    " and resid 123  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
 OR {  419}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI {  430}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      3.900     1.900     1.900 peak   430 spectrum    1 weight  0.10000E+01 volume  0.14226E-02 ppm1      8.093 ppm2      2.741 CV     1
 OR {  430}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  431}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      4.000     2.000     2.000 peak   431 spectrum    1 weight  0.10000E+01 volume  0.12275E-02 ppm1      8.093 ppm2      2.616 CV     1
 OR {  431}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
 ASSI {  433}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 121  and name HD2%)
      4.300     2.300     1.700 peak   433 spectrum    1 weight  0.10000E+01 volume  0.12592E-02 ppm1      8.093 ppm2      0.935 CV     1
 OR {  433}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 21   and name HD2%)
 ASSI {  434}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 21   and name HD1%)
      4.200     2.200     1.800 peak   434 spectrum    1 weight  0.10000E+01 volume  0.89487E-03 ppm1      8.094 ppm2      0.864 CV     1
 OR {  434}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 121  and name HD1%)
 ASSI {  438}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 155  and name HN  ))
      6.000     6.000     0.000 peak   438 spectrum    1 weight  0.10000E+01 volume  0.25413E-04 ppm1      8.275 ppm2      8.016 CV     1
 OR {  438}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
 OR {  438}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  439}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 171  and name HZ3 ))
      5.600     3.900     0.400 peak   439 spectrum    1 weight  0.10000E+01 volume  0.23281E-03 ppm1      8.274 ppm2      7.123 CV     1
 OR {  439}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 71   and name HZ3 ))
 ASSI {  440}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
      3.900     1.900     1.900 peak   440 spectrum    1 weight  0.10000E+01 volume  0.58201E-03 ppm1      8.274 ppm2      9.069 CV     1
 OR {  440}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
 OR {  440}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  441}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 153  and name HN  ))
      2.300     0.700     0.700 peak   441 spectrum    1 weight  0.10000E+01 volume  0.58789E-02 ppm1      8.274 ppm2      8.446 CV     1
 OR {  441}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI {  446}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 171  and name HH2 ))
      6.000     6.000     0.000 peak   446 spectrum    1 weight  0.10000E+01 volume  0.99041E-04 ppm1      8.274 ppm2      6.796 CV     1
 OR {  446}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 71   and name HH2 ))
 ASSI {  447}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      3.300     1.400     1.400 peak   447 spectrum    1 weight  0.10000E+01 volume  0.99904E-03 ppm1      8.274 ppm2      4.880 CV     1
 OR {  447}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  449}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.900     1.000     1.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.49131E-02 ppm1      8.274 ppm2      4.215 CV     1
 OR {  449}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  450}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
      5.100     3.300     0.900 peak   450 spectrum    1 weight  0.10000E+01 volume  0.35231E-03 ppm1      8.273 ppm2      3.977 CV     1
 OR {  450}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  451}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      6.000     6.000     0.000 peak   451 spectrum    1 weight  0.10000E+01 volume  0.25461E-04 ppm1      8.273 ppm2      3.883 CV     1
 OR {  451}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
 OR {  451}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI {  452}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      4.900     3.000     1.100 peak   452 spectrum    1 weight  0.10000E+01 volume  0.20537E-03 ppm1      8.273 ppm2      3.433 CV     1
 OR {  452}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
 OR {  452}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 155  and name HD1 ))
 ASSI {  453}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      5.500     3.800     0.500 peak   453 spectrum    1 weight  0.10000E+01 volume  0.31429E-03 ppm1      8.274 ppm2      2.801 CV     1
 OR {  453}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 153  and name HB2 ))
 ASSI {  454}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
      4.500     2.500     1.500 peak   454 spectrum    1 weight  0.10000E+01 volume  0.57726E-03 ppm1      8.272 ppm2      2.267 CV     1
 OR {  454}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR {  454}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 76   and name HG2 ))
 OR {  454}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 176  and name HG2 ))
 ASSI {  457}
   (( segid "    " and resid 152  and name HN  ))
   (  segid "    " and resid 147  and name HG2%)
      3.600     1.600     1.600 peak   457 spectrum    1 weight  0.10000E+01 volume  0.26132E-03 ppm1      8.273 ppm2      1.272 CV     1
 OR {  457}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 47   and name HG2%)
 OR {  457}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 150  and name HG1 ))
 OR {  457}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 OR {  457}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 160  and name HG12))
 OR {  457}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI {  460}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      4.900     3.000     1.100 peak   460 spectrum    1 weight  0.10000E+01 volume  0.18145E-03 ppm1      7.920 ppm2      9.219 CV     1
 OR {  460}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
 ASSI {  461}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
      2.300     0.700     0.700 peak   461 spectrum    1 weight  0.10000E+01 volume  0.52073E-02 ppm1      7.921 ppm2      8.847 CV     1
 OR {  461}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
 OR {  461}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  462}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HN  ))
      2.200     0.600     0.600 peak   462 spectrum    1 weight  0.10000E+01 volume  0.65959E-02 ppm1      7.920 ppm2      8.719 CV     1
 OR {  462}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI {  464}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
      3.100     1.200     1.200 peak   464 spectrum    1 weight  0.10000E+01 volume  0.19955E-02 ppm1      7.920 ppm2      4.188 CV     1
 OR {  464}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
 ASSI {  466}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      3.700     1.700     1.700 peak   466 spectrum    1 weight  0.10000E+01 volume  0.13537E-02 ppm1      7.921 ppm2      3.876 CV     1
 OR {  466}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 OR {  466}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
 OR {  466}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  467}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HB1 ))
      5.100     3.200     0.900 peak   467 spectrum    1 weight  0.10000E+01 volume  0.42986E-03 ppm1      7.921 ppm2      3.374 CV     1
 OR {  467}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
 ASSI {  468}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HE1 ))
      5.500     3.800     0.500 peak   468 spectrum    1 weight  0.10000E+01 volume  0.25336E-03 ppm1      7.920 ppm2      3.163 CV     1
 OR {  468}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HE2 ))
 ASSI {  469}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 146  and name HB2 ))
      6.000     5.600     0.000 peak   469 spectrum    1 weight  0.10000E+01 volume  0.48985E-04 ppm1      7.922 ppm2      2.963 CV     1
 OR {  469}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
 ASSI {  470}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 142  and name HB1 ))
      3.300     1.400     1.400 peak   470 spectrum    1 weight  0.10000E+01 volume  0.16449E-02 ppm1      7.921 ppm2      2.845 CV     1
 OR {  470}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 OR {  470}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
 ASSI {  472}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HG1 ))
      4.500     2.500     1.500 peak   472 spectrum    1 weight  0.10000E+01 volume  0.92399E-03 ppm1      7.920 ppm2      2.428 CV     1
 OR {  472}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HG1 ))
 OR {  472}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HG2 ))
 OR {  472}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HG2 ))
 ASSI {  474}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      2.000     0.500     0.500 peak   474 spectrum    1 weight  0.10000E+01 volume  0.15451E-01 ppm1      7.921 ppm2      2.176 CV     1
 OR {  474}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HB2 ))
 OR {  474}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
 OR {  474}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
 ASSI {  475}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.200     0.600     0.600 peak   475 spectrum    1 weight  0.10000E+01 volume  0.62776E-02 ppm1      7.921 ppm2      2.006 CV     1
 OR {  475}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HB2 ))
 OR {  475}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 OR {  475}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI {  476}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HD2 ))
      4.200     2.200     1.800 peak   476 spectrum    1 weight  0.10000E+01 volume  0.99188E-03 ppm1      7.920 ppm2      1.817 CV     1
 OR {  476}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HD2 ))
 OR {  476}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HD1 ))
 OR {  476}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HD1 ))
 ASSI {  477}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 135  and name HD2 ))
      3.700     3.700     2.300 peak   477 spectrum    1 weight  0.10000E+01 volume  0.18991E-02 ppm1      7.920 ppm2      1.514 CV     1
 OR {  477}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 35   and name HD1 ))
 OR {  477}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 173  and name HG2 ))
 OR {  477}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 150  and name HD1 ))
 OR {  477}
   (( segid "    " and resid 145  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 OR {  477}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
 ASSI {  478}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HG2 ))
      3.000     1.100     1.100 peak   478 spectrum    1 weight  0.10000E+01 volume  0.11480E-02 ppm1      7.921 ppm2      1.427 CV     1
 OR {  478}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
 OR {  478}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
 OR {  478}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
 ASSI {  479}
   (( segid "    " and resid 145  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      6.000     5.100     0.000 peak   479 spectrum    1 weight  0.10000E+01 volume  0.53266E-04 ppm1      7.918 ppm2      4.817 CV     1
 OR {  479}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  486}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      4.300     2.300     1.700 peak   486 spectrum    1 weight  0.10000E+01 volume  0.47487E-03 ppm1      8.349 ppm2      8.824 CV     1
 OR {  486}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  489}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 134  and name HN  ))
      2.800     1.000     1.000 peak   489 spectrum    1 weight  0.10000E+01 volume  0.29198E-02 ppm1      8.349 ppm2      8.232 CV     1
 OR {  489}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
 ASSI {  490}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.400     3.400     2.600 peak   490 spectrum    1 weight  0.10000E+01 volume  0.27616E-02 ppm1      8.348 ppm2      4.822 CV     1
 OR {  490}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  491}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
      3.600     1.600     1.600 peak   491 spectrum    1 weight  0.10000E+01 volume  0.15339E-02 ppm1      8.348 ppm2      4.511 CV     1
 OR {  491}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 OR {  491}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI {  492}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HA  ))
      2.400     0.700     0.700 peak   492 spectrum    1 weight  0.10000E+01 volume  0.78878E-02 ppm1      8.349 ppm2      4.417 CV     1
 OR {  492}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI {  493}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA2 ))
      2.100     0.600     0.600 peak   493 spectrum    1 weight  0.10000E+01 volume  0.19200E-01 ppm1      8.349 ppm2      4.027 CV     1
 OR {  493}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HA2 ))
 OR {  493}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA1 ))
 OR {  493}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HA1 ))
 ASSI {  494}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.500     1.500     1.500 peak   494 spectrum    1 weight  0.10000E+01 volume  0.11594E-02 ppm1      8.349 ppm2      3.931 CV     1
 OR {  494}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
 OR {  494}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
 OR {  494}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
 ASSI {  495}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 143  and name HG1 ))
      5.000     3.100     1.000 peak   495 spectrum    1 weight  0.10000E+01 volume  0.28407E-03 ppm1      8.349 ppm2      2.283 CV     1
 OR {  495}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 43   and name HG1 ))
 OR {  495}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 143  and name HG2 ))
 ASSI {  496}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 143  and name HB2 ))
      3.900     1.900     1.900 peak   496 spectrum    1 weight  0.10000E+01 volume  0.87719E-03 ppm1      8.348 ppm2      2.070 CV     1
 OR {  496}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
 OR {  496}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 143  and name HB1 ))
 ASSI {  498}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      2.500     0.800     0.800 peak   498 spectrum    1 weight  0.10000E+01 volume  0.15712E-01 ppm1      8.349 ppm2      1.769 CV     1
 OR {  498}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HB1 ))
 ASSI {  501}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 134  and name HG11))
      4.700     2.700     1.300 peak   501 spectrum    1 weight  0.10000E+01 volume  0.20492E-03 ppm1      8.351 ppm2      1.209 CV     1
 OR {  501}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HG12))
 ASSI {  502}
   (( segid "    " and resid 133  and name HN  ))
   (  segid "    " and resid 134  and name HD1%)
      4.000     2.000     2.000 peak   502 spectrum    1 weight  0.10000E+01 volume  0.81632E-03 ppm1      8.349 ppm2      0.726 CV     1
 OR {  502}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 34   and name HD1%)
 OR {  502}
   (( segid "    " and resid 133  and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
 ASSI {  503}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      2.200     0.600     0.600 peak   503 spectrum    1 weight  0.10000E+01 volume  0.65066E-02 ppm1      8.187 ppm2      8.675 CV     1
 OR {  503}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  504}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      3.100     1.200     1.200 peak   504 spectrum    1 weight  0.10000E+01 volume  0.18967E-02 ppm1      8.188 ppm2      8.563 CV     1
 OR {  504}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  506}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      2.300     0.600     0.600 peak   506 spectrum    1 weight  0.10000E+01 volume  0.56507E-02 ppm1      8.188 ppm2      7.717 CV     1
 OR {  506}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 170  and name HN  ))
 ASSI {  507}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      6.000     6.000     0.000 peak   507 spectrum    1 weight  0.10000E+01 volume  0.24751E-04 ppm1      8.188 ppm2      6.951 CV     1
 OR {  507}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 66   and name HE21))
 OR {  507}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  508}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      5.300     3.500     0.700 peak   508 spectrum    1 weight  0.10000E+01 volume  0.33326E-03 ppm1      8.187 ppm2      4.493 CV     1
 OR {  508}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI {  510}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak   510 spectrum    1 weight  0.10000E+01 volume  0.47379E-02 ppm1      8.188 ppm2      4.159 CV     1
 OR {  510}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
 OR {  510}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
 ASSI {  511}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.300     1.300     1.300 peak   511 spectrum    1 weight  0.10000E+01 volume  0.12165E-02 ppm1      8.188 ppm2      3.914 CV     1
 OR {  511}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 165  and name HA  ))
 ASSI {  513}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.000     1.100     1.100 peak   513 spectrum    1 weight  0.10000E+01 volume  0.19492E-02 ppm1      8.188 ppm2      3.286 CV     1
 OR {  513}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 168  and name HA  ))
 OR {  513}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
 OR {  513}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  513}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  514}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 170  and name HB2 ))
      4.100     2.100     1.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.14189E-02 ppm1      8.188 ppm2      3.084 CV     1
 OR {  514}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {  514}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 170  and name HB1 ))
 OR {  514}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {  515}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
      2.000     0.500     0.500 peak   515 spectrum    1 weight  0.10000E+01 volume  0.10347E-01 ppm1      8.188 ppm2      2.978 CV     1
 OR {  515}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  516}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.700     0.900     0.900 peak   516 spectrum    1 weight  0.10000E+01 volume  0.85308E-02 ppm1      8.188 ppm2      2.666 CV     1
 OR {  516}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 169  and name HB1 ))
 ASSI {  517}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
      6.000     6.000     0.000 peak   517 spectrum    1 weight  0.10000E+01 volume  0.26631E-04 ppm1      8.188 ppm2      2.261 CV     1
 OR {  517}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR {  517}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  518}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
      2.600     0.800     0.800 peak   518 spectrum    1 weight  0.10000E+01 volume  0.54625E-02 ppm1      8.188 ppm2      1.921 CV     1
 OR {  518}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 168  and name HB  ))
 OR {  518}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  518}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  518}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  518}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  518}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
 ASSI {  519}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
      4.600     2.700     1.400 peak   519 spectrum    1 weight  0.10000E+01 volume  0.23623E-03 ppm1      8.188 ppm2      1.579 CV     1
 OR {  519}
   (( segid "    " and resid 169  and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI {  520}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
      4.700     2.800     1.300 peak   520 spectrum    1 weight  0.10000E+01 volume  0.40699E-03 ppm1      8.189 ppm2      1.070 CV     1
 OR {  520}
   (( segid "    " and resid 169  and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
 OR {  520}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
 ASSI {  522}
   (( segid "    " and resid 169  and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
      3.100     1.200     1.200 peak   522 spectrum    1 weight  0.10000E+01 volume  0.41647E-02 ppm1      8.188 ppm2      0.605 CV     1
 OR {  522}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI {  523}
   (( segid "    " and resid 169  and name HN  ))
   (  segid "    " and resid 168  and name HG1%)
      2.700     0.900     0.900 peak   523 spectrum    1 weight  0.10000E+01 volume  0.30387E-02 ppm1      8.187 ppm2      0.052 CV     1
 OR {  523}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
 ASSI {  529}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
      2.400     0.700     0.700 peak   529 spectrum    1 weight  0.10000E+01 volume  0.38825E-02 ppm1      8.036 ppm2      9.067 CV     1
 OR {  529}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
 ASSI {  530}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      6.000     5.300     0.000 peak   530 spectrum    1 weight  0.10000E+01 volume  0.24451E-04 ppm1      8.035 ppm2      8.847 CV     1
 OR {  530}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 146  and name HN  ))
 ASSI {  532}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      4.300     2.300     1.700 peak   532 spectrum    1 weight  0.10000E+01 volume  0.62418E-03 ppm1      8.036 ppm2      8.252 CV     1
 OR {  532}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 152  and name HN  ))
 ASSI {  534}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
      5.700     4.100     0.300 peak   534 spectrum    1 weight  0.10000E+01 volume  0.16096E-03 ppm1      8.037 ppm2      4.852 CV     1
 OR {  534}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
 ASSI {  536}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      2.400     0.700     0.700 peak   536 spectrum    1 weight  0.10000E+01 volume  0.54825E-02 ppm1      8.036 ppm2      4.174 CV     1
 OR {  536}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI {  537}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
      3.300     1.300     1.300 peak   537 spectrum    1 weight  0.10000E+01 volume  0.10541E-02 ppm1      8.036 ppm2      3.966 CV     1
 OR {  537}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI {  538}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
      3.500     1.500     1.500 peak   538 spectrum    1 weight  0.10000E+01 volume  0.10213E-02 ppm1      8.037 ppm2      3.654 CV     1
 OR {  538}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  539}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HD2 ))
      4.100     2.100     1.900 peak   539 spectrum    1 weight  0.10000E+01 volume  0.13446E-02 ppm1      8.036 ppm2      3.381 CV     1
 OR {  539}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HB1 ))
 OR {  539}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HD1 ))
 ASSI {  540}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HD2 ))
      6.000     5.100     0.000 peak   540 spectrum    1 weight  0.10000E+01 volume  0.14873E-03 ppm1      8.036 ppm2      3.238 CV     1
 OR {  540}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HD1 ))
 OR {  540}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 OR {  540}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
 ASSI {  542}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HB2 ))
      2.300     0.600     0.600 peak   542 spectrum    1 weight  0.10000E+01 volume  0.51125E-02 ppm1      8.036 ppm2      2.098 CV     1
 OR {  542}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB1 ))
 ASSI {  543}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      2.200     0.600     0.600 peak   543 spectrum    1 weight  0.10000E+01 volume  0.86128E-02 ppm1      8.036 ppm2      1.953 CV     1
 OR {  543}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HG1 ))
 OR {  543}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HB1 ))
 ASSI {  544}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 52   and name HB% )
      3.400     3.400     2.600 peak   544 spectrum    1 weight  0.10000E+01 volume  0.31306E-02 ppm1      8.036 ppm2      1.776 CV     1
 OR {  544}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {  545}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
      4.600     2.700     1.400 peak   545 spectrum    1 weight  0.10000E+01 volume  0.52487E-03 ppm1      8.037 ppm2      1.546 CV     1
 OR {  545}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 OR {  545}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 150  and name HD1 ))
 OR {  545}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
 OR {  545}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI {  550}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 171  and name HE3 ))
      2.600     0.800     0.800 peak   550 spectrum    1 weight  0.10000E+01 volume  0.19842E-02 ppm1      9.441 ppm2      7.260 CV     1
 OR {  550}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HE3 ))
 ASSI {  551}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 174  and name HN  ))
      4.200     2.200     1.800 peak   551 spectrum    1 weight  0.10000E+01 volume  0.72944E-03 ppm1      9.441 ppm2      7.110 CV     1
 OR {  551}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 171  and name HZ3 ))
 OR {  551}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HZ3 ))
 ASSI {  552}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      3.500     1.500     1.500 peak   552 spectrum    1 weight  0.10000E+01 volume  0.77272E-03 ppm1      9.442 ppm2      4.381 CV     1
 OR {  552}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 169  and name HA  ))
 ASSI {  553}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 171  and name HA  ))
      3.400     1.500     1.500 peak   553 spectrum    1 weight  0.10000E+01 volume  0.14440E-02 ppm1      9.442 ppm2      4.188 CV     1
 OR {  553}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
 OR {  553}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {  555}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      2.000     0.500     0.500 peak   555 spectrum    1 weight  0.10000E+01 volume  0.57423E-02 ppm1      9.441 ppm2      3.339 CV     1
 OR {  555}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  555}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 OR {  555}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI {  556}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
      6.000     6.000     0.000 peak   556 spectrum    1 weight  0.10000E+01 volume  0.26161E-04 ppm1      9.443 ppm2      2.978 CV     1
 OR {  556}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  557}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB1 ))
      2.300     0.700     0.700 peak   557 spectrum    1 weight  0.10000E+01 volume  0.79809E-02 ppm1      9.441 ppm2      2.080 CV     1
 OR {  557}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 172  and name HB1 ))
 ASSI {  558}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HG  ))
      2.900     1.100     1.100 peak   558 spectrum    1 weight  0.10000E+01 volume  0.70128E-02 ppm1      9.442 ppm2      2.001 CV     1
 OR {  558}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 172  and name HG  ))
 OR {  558}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
 ASSI {  559}
   (( segid "    " and resid 172  and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
      2.100     0.500     0.500 peak   559 spectrum    1 weight  0.10000E+01 volume  0.36468E-02 ppm1      9.441 ppm2      1.569 CV     1
 OR {  559}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HB2 ))
 ASSI {  560}
   (( segid "    " and resid 172  and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
      3.400     1.500     1.500 peak   560 spectrum    1 weight  0.10000E+01 volume  0.32471E-02 ppm1      9.441 ppm2      1.059 CV     1
 OR {  560}
   (( segid "    " and resid 172  and name HN  ))
   (  segid "    " and resid 172  and name HD2%)
 OR {  560}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  562}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
      4.500     2.500     1.500 peak   562 spectrum    1 weight  0.10000E+01 volume  0.39656E-03 ppm1      9.442 ppm2      0.574 CV     1
 OR {  562}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI {  563}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 68   and name HG1%)
      3.800     1.800     1.800 peak   563 spectrum    1 weight  0.10000E+01 volume  0.58545E-03 ppm1      9.441 ppm2      0.052 CV     1
 OR {  563}
   (( segid "    " and resid 172  and name HN  ))
   (  segid "    " and resid 168  and name HG1%)
 ASSI {  564}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 148  and name HN  ))
      4.700     2.700     1.300 peak   564 spectrum    1 weight  0.10000E+01 volume  0.24666E-03 ppm1      9.070 ppm2      8.035 CV     1
 OR {  564}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
 ASSI {  566}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      4.000     2.000     2.000 peak   566 spectrum    1 weight  0.10000E+01 volume  0.14432E-02 ppm1      9.069 ppm2      6.958 CV     1
 OR {  566}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 149  and name HD% )
 ASSI {  567}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.500     1.500     1.500 peak   567 spectrum    1 weight  0.10000E+01 volume  0.70193E-03 ppm1      9.068 ppm2      4.878 CV     1
 OR {  567}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  568}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      5.100     3.300     0.900 peak   568 spectrum    1 weight  0.10000E+01 volume  0.41060E-03 ppm1      9.070 ppm2      4.199 CV     1
 OR {  568}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  569}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      4.400     2.400     1.600 peak   569 spectrum    1 weight  0.10000E+01 volume  0.46295E-03 ppm1      9.068 ppm2      3.863 CV     1
 OR {  569}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI {  570}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
      3.300     1.400     1.400 peak   570 spectrum    1 weight  0.10000E+01 volume  0.10262E-02 ppm1      9.069 ppm2      3.655 CV     1
 OR {  570}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
 ASSI {  572}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
      2.800     1.000     1.000 peak   572 spectrum    1 weight  0.10000E+01 volume  0.18928E-02 ppm1      9.069 ppm2      3.243 CV     1
 OR {  572}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
 ASSI {  573}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 49   and name HB2 ))
      2.900     1.100     1.100 peak   573 spectrum    1 weight  0.10000E+01 volume  0.27186E-02 ppm1      9.069 ppm2      3.098 CV     1
 OR {  573}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
 ASSI {  575}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HD1 ))
      3.200     1.300     1.300 peak   575 spectrum    1 weight  0.10000E+01 volume  0.30992E-02 ppm1      9.069 ppm2      1.551 CV     1
 OR {  575}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HD1 ))
 OR {  575}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 50   and name HD2 ))
 OR {  575}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 OR {  575}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
 ASSI {  578}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 160  and name HD1%)
      3.600     1.600     1.600 peak   578 spectrum    1 weight  0.10000E+01 volume  0.17241E-02 ppm1      9.069 ppm2      0.512 CV     1
 OR {  578}
   (( segid "    " and resid 50   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
 ASSI {  579}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 152  and name HN  ))
      3.800     1.800     1.800 peak   579 spectrum    1 weight  0.10000E+01 volume  0.76923E-03 ppm1      9.066 ppm2      8.268 CV     1
 OR {  579}
   (( segid "    " and resid 50   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
 ASSI {  582}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      2.600     0.800     0.800 peak   582 spectrum    1 weight  0.10000E+01 volume  0.26071E-02 ppm1      8.673 ppm2      8.582 CV     1
 OR {  582}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HN  ))
 ASSI {  584}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      5.200     3.400     0.800 peak   584 spectrum    1 weight  0.10000E+01 volume  0.99487E-04 ppm1      8.673 ppm2      7.794 CV     1
 OR {  584}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 166  and name HN  ))
 OR {  584}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 70   and name HD21))
 ASSI {  586}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      3.000     1.200     1.200 peak   586 spectrum    1 weight  0.10000E+01 volume  0.23179E-02 ppm1      8.672 ppm2      4.165 CV     1
 OR {  586}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  586}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  586}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
 OR {  586}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 ASSI {  588}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 164  and name HA  ))
      3.800     1.800     1.800 peak   588 spectrum    1 weight  0.10000E+01 volume  0.11411E-02 ppm1      8.673 ppm2      3.388 CV     1
 OR {  588}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
 OR {  588}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 164  and name HA  ))
 ASSI {  589}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.700     0.900     0.900 peak   589 spectrum    1 weight  0.10000E+01 volume  0.27291E-02 ppm1      8.673 ppm2      3.285 CV     1
 OR {  589}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 168  and name HA  ))
 OR {  589}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  589}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
 OR {  589}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 171  and name HB2 ))
 OR {  589}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 168  and name HA  ))
 OR {  589}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI {  590}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
      4.200     2.200     1.800 peak   590 spectrum    1 weight  0.10000E+01 volume  0.73023E-03 ppm1      8.672 ppm2      2.981 CV     1
 OR {  590}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI {  591}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      6.000     5.500     0.000 peak   591 spectrum    1 weight  0.10000E+01 volume  0.77615E-04 ppm1      8.673 ppm2      2.665 CV     1
 OR {  591}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 169  and name HB1 ))
 ASSI {  592}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
      2.700     0.900     0.900 peak   592 spectrum    1 weight  0.10000E+01 volume  0.24413E-02 ppm1      8.673 ppm2      2.018 CV     1
 OR {  592}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
 ASSI {  593}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 168  and name HB  ))
      2.100     0.500     0.500 peak   593 spectrum    1 weight  0.10000E+01 volume  0.95911E-02 ppm1      8.673 ppm2      1.919 CV     1
 OR {  593}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
 OR {  593}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  593}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  593}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  593}
   (( segid "    " and resid 168  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  593}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI {  595}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
      3.000     1.100     1.100 peak   595 spectrum    1 weight  0.10000E+01 volume  0.18958E-02 ppm1      8.673 ppm2      1.079 CV     1
 OR {  595}
   (( segid "    " and resid 168  and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
 OR {  595}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
 ASSI {  596}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 64   and name HG1%)
      3.600     1.700     1.700 peak   596 spectrum    1 weight  0.10000E+01 volume  0.78279E-03 ppm1      8.673 ppm2      0.948 CV     1
 OR {  596}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 164  and name HG2%)
 ASSI {  599}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      6.000     4.900     0.000 peak   599 spectrum    1 weight  0.10000E+01 volume  0.53964E-04 ppm1      8.670 ppm2      6.954 CV     1
 OR {  599}
   (( segid "    " and resid 168  and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  599}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 ASSI {  606}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      2.700     2.700     3.300 peak   606 spectrum    1 weight  0.10000E+01 volume  0.67850E-03 ppm1      8.382 ppm2      4.698 CV     1
 OR {  606}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  608}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HA  ))
      2.200     0.600     0.600 peak   608 spectrum    1 weight  0.10000E+01 volume  0.94910E-02 ppm1      8.382 ppm2      4.297 CV     1
 OR {  608}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  609}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB2 ))
      2.900     1.000     1.000 peak   609 spectrum    1 weight  0.10000E+01 volume  0.35396E-02 ppm1      8.382 ppm2      2.741 CV     1
 OR {  609}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  610}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      2.600     0.900     0.900 peak   610 spectrum    1 weight  0.10000E+01 volume  0.62092E-02 ppm1      8.382 ppm2      2.616 CV     1
 OR {  610}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 120  and name HB1 ))
 ASSI {  611}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.700     1.800     1.800 peak   611 spectrum    1 weight  0.10000E+01 volume  0.18609E-02 ppm1      8.381 ppm2      1.876 CV     1
 OR {  611}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HB2 ))
 ASSI {  612}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HB1 ))
      3.800     1.800     1.800 peak   612 spectrum    1 weight  0.10000E+01 volume  0.16172E-02 ppm1      8.381 ppm2      1.746 CV     1
 OR {  612}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI {  613}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
      4.000     2.000     2.000 peak   613 spectrum    1 weight  0.10000E+01 volume  0.12865E-02 ppm1      8.382 ppm2      1.613 CV     1
 OR {  613}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HG1 ))
 OR {  613}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HG2 ))
 OR {  613}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HG2 ))
 OR {  613}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  615}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
      2.400     0.700     0.700 peak   615 spectrum    1 weight  0.10000E+01 volume  0.50541E-02 ppm1      7.811 ppm2      9.069 CV     1
 OR {  615}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI {  616}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      3.800     1.800     1.800 peak   616 spectrum    1 weight  0.10000E+01 volume  0.63645E-03 ppm1      7.811 ppm2      8.447 CV     1
 OR {  616}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 153  and name HN  ))
 ASSI {  619}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      6.000     5.400     0.000 peak   619 spectrum    1 weight  0.10000E+01 volume  0.24581E-04 ppm1      7.810 ppm2      4.879 CV     1
 OR {  619}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI {  620}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      2.400     0.700     0.700 peak   620 spectrum    1 weight  0.10000E+01 volume  0.89190E-02 ppm1      7.812 ppm2      4.218 CV     1
 OR {  620}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  621}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.800     1.800     1.800 peak   621 spectrum    1 weight  0.10000E+01 volume  0.61857E-03 ppm1      7.812 ppm2      3.654 CV     1
 OR {  621}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 147  and name HA  ))
 ASSI {  623}
   (( segid "    " and resid 51   and name HN  ))
   (  segid "    " and resid 52   and name HB% )
      3.800     1.800     1.800 peak   623 spectrum    1 weight  0.10000E+01 volume  0.19936E-02 ppm1      7.811 ppm2      1.814 CV     1
 OR {  623}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {  627}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HG1 ))
      3.200     1.300     1.300 peak   627 spectrum    1 weight  0.10000E+01 volume  0.36964E-02 ppm1      7.812 ppm2      1.271 CV     1
 OR {  627}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 OR {  627}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HG2 ))
 OR {  627}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI {  641}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      4.900     3.000     1.100 peak   641 spectrum    1 weight  0.10000E+01 volume  0.32457E-03 ppm1      8.361 ppm2      8.256 CV     1
 OR {  641}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
 ASSI {  646}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      2.600     0.800     0.800 peak   646 spectrum    1 weight  0.10000E+01 volume  0.44263E-02 ppm1      8.328 ppm2      4.129 CV     1
 OR {  646}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  647}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HD2 ))
      3.400     3.400     2.600 peak   647 spectrum    1 weight  0.10000E+01 volume  0.18054E-03 ppm1      8.329 ppm2      3.653 CV     1
 OR {  647}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HD1 ))
 ASSI {  648}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB2 ))
      3.300     1.300     1.300 peak   648 spectrum    1 weight  0.10000E+01 volume  0.34086E-02 ppm1      8.328 ppm2      2.295 CV     1
 OR {  648}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HB1 ))
 ASSI {  649}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HB  ))
      2.400     0.700     0.700 peak   649 spectrum    1 weight  0.10000E+01 volume  0.84927E-02 ppm1      8.328 ppm2      2.090 CV     1
 OR {  649}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HB  ))
 ASSI {  650}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HB2 ))
      3.000     1.100     1.100 peak   650 spectrum    1 weight  0.10000E+01 volume  0.62450E-02 ppm1      8.328 ppm2      1.907 CV     1
 OR {  650}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB1 ))
 ASSI {  651}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 127  and name HB% )
      4.200     2.200     1.800 peak   651 spectrum    1 weight  0.10000E+01 volume  0.51134E-04 ppm1      8.330 ppm2      1.365 CV     1
 OR {  651}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 27   and name HB% )
 ASSI {  652}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
      2.500     0.800     0.800 peak   652 spectrum    1 weight  0.10000E+01 volume  0.10281E-01 ppm1      8.328 ppm2      0.977 CV     1
 OR {  652}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 129  and name HG2%)
 OR {  652}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 129  and name HG1%)
 OR {  652}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HG1%)
 ASSI {  653}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      3.200     1.200     1.200 peak   653 spectrum    1 weight  0.10000E+01 volume  0.15075E-02 ppm1      8.309 ppm2      8.585 CV     1
 OR {  653}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
 ASSI {  654}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      4.600     2.600     1.400 peak   654 spectrum    1 weight  0.10000E+01 volume  0.25644E-03 ppm1      8.309 ppm2      8.424 CV     1
 OR {  654}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
 OR {  654}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
 ASSI {  657}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      4.900     3.000     1.100 peak   657 spectrum    1 weight  0.10000E+01 volume  0.28494E-03 ppm1      8.309 ppm2      4.660 CV     1
 OR {  657}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
 ASSI {  658}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      2.700     0.900     0.900 peak   658 spectrum    1 weight  0.10000E+01 volume  0.35713E-02 ppm1      8.309 ppm2      4.263 CV     1
 OR {  658}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  659}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HA1 ))
      2.600     0.800     0.800 peak   659 spectrum    1 weight  0.10000E+01 volume  0.55453E-02 ppm1      8.309 ppm2      3.963 CV     1
 OR {  659}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA2 ))
 ASSI {  660}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA1 ))
      2.600     0.800     0.800 peak   660 spectrum    1 weight  0.10000E+01 volume  0.54804E-02 ppm1      8.309 ppm2      3.866 CV     1
 OR {  660}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HA2 ))
 ASSI {  661}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG1 ))
      3.400     1.500     1.500 peak   661 spectrum    1 weight  0.10000E+01 volume  0.23937E-02 ppm1      8.309 ppm2      2.253 CV     1
 OR {  661}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HG1 ))
 OR {  661}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HG2 ))
 OR {  661}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {  663}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.700     0.900     0.900 peak   663 spectrum    1 weight  0.10000E+01 volume  0.54787E-02 ppm1      8.309 ppm2      1.945 CV     1
 OR {  663}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
 OR {  663}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
 OR {  663}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
 OR {  663}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HB1 ))
 ASSI {  666}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      3.100     1.200     1.200 peak   666 spectrum    1 weight  0.10000E+01 volume  0.40490E-02 ppm1      8.261 ppm2      8.097 CV     1
 OR {  666}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI {  668}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      3.000     3.000     3.000 peak   668 spectrum    1 weight  0.10000E+01 volume  0.36168E-03 ppm1      8.261 ppm2      4.572 CV     1
 OR {  668}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  669}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.000     0.500     0.500 peak   669 spectrum    1 weight  0.10000E+01 volume  0.17234E-01 ppm1      8.261 ppm2      4.274 CV     1
 OR {  669}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
 OR {  669}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
 ASSI {  670}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HG1 ))
      3.700     1.700     1.700 peak   670 spectrum    1 weight  0.10000E+01 volume  0.32507E-02 ppm1      8.261 ppm2      2.279 CV     1
 OR {  670}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HG1 ))
 OR {  670}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HG2 ))
 OR {  670}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HG2 ))
 ASSI {  672}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.200     0.600     0.600 peak   672 spectrum    1 weight  0.10000E+01 volume  0.82798E-02 ppm1      8.261 ppm2      1.968 CV     1
 OR {  672}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI {  673}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB1 ))
      3.100     1.200     1.200 peak   673 spectrum    1 weight  0.10000E+01 volume  0.46506E-02 ppm1      8.261 ppm2      1.625 CV     1
 OR {  673}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 OR {  673}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
 OR {  673}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HB2 ))
 ASSI {  674}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 121  and name HD2%)
      3.000     3.000     3.000 peak   674 spectrum    1 weight  0.10000E+01 volume  0.98239E-03 ppm1      8.261 ppm2      0.935 CV     1
 OR {  674}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 21   and name HD2%)
 OR {  674}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
 OR {  674}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 124  and name HG2%)
 OR {  674}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 OR {  674}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 124  and name HG1%)
 ASSI {  692}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      2.600     0.900     0.900 peak   692 spectrum    1 weight  0.10000E+01 volume  0.49137E-02 ppm1      8.583 ppm2      4.707 CV     1
 OR {  692}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
 ASSI {  694}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      3.000     1.100     1.100 peak   694 spectrum    1 weight  0.10000E+01 volume  0.24130E-02 ppm1      8.583 ppm2      2.864 CV     1
 OR {  694}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB1 ))
 ASSI {  698}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      3.900     1.900     1.900 peak   698 spectrum    1 weight  0.10000E+01 volume  0.38159E-03 ppm1      7.795 ppm2      8.933 CV     1
 OR {  698}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 164  and name HN  ))
 ASSI {  699}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.500     1.500     1.500 peak   699 spectrum    1 weight  0.10000E+01 volume  0.10527E-02 ppm1      7.793 ppm2      8.674 CV     1
 OR {  699}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  700}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 167  and name HN  ))
      2.200     0.600     0.600 peak   700 spectrum    1 weight  0.10000E+01 volume  0.52943E-02 ppm1      7.793 ppm2      8.583 CV     1
 OR {  700}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI {  701}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      5.500     3.700     0.500 peak   701 spectrum    1 weight  0.10000E+01 volume  0.73217E-04 ppm1      7.793 ppm2      8.204 CV     1
 OR {  701}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 169  and name HN  ))
 OR {  701}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 163  and name HN  ))
 OR {  701}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
 ASSI {  702}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      2.400     0.700     0.700 peak   702 spectrum    1 weight  0.10000E+01 volume  0.34847E-02 ppm1      7.793 ppm2      7.919 CV     1
 OR {  702}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 165  and name HN  ))
 ASSI {  704}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 166  and name HE21))
      4.400     2.500     1.600 peak   704 spectrum    1 weight  0.10000E+01 volume  0.73155E-03 ppm1      7.794 ppm2      7.430 CV     1
 OR {  704}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 71   and name HD1 ))
 OR {  704}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 171  and name HD1 ))
 OR {  704}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HE22))
 ASSI {  705}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HE21))
      5.100     3.200     0.900 peak   705 spectrum    1 weight  0.10000E+01 volume  0.39830E-03 ppm1      7.794 ppm2      6.955 CV     1
 OR {  705}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 166  and name HE22))
 OR {  705}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 141  and name HE% )
 ASSI {  706}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      3.700     1.700     1.700 peak   706 spectrum    1 weight  0.10000E+01 volume  0.81926E-03 ppm1      7.792 ppm2      4.425 CV     1
 OR {  706}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
 ASSI {  707}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
      2.400     0.700     0.700 peak   707 spectrum    1 weight  0.10000E+01 volume  0.79950E-02 ppm1      7.793 ppm2      4.156 CV     1
 OR {  707}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
 ASSI {  708}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.100     1.200     1.200 peak   708 spectrum    1 weight  0.10000E+01 volume  0.17693E-02 ppm1      7.793 ppm2      3.915 CV     1
 OR {  708}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 165  and name HA  ))
 ASSI {  709}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      3.000     1.100     1.100 peak   709 spectrum    1 weight  0.10000E+01 volume  0.23845E-02 ppm1      7.793 ppm2      3.517 CV     1
 OR {  709}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 163  and name HA  ))
 ASSI {  710}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      4.100     2.100     1.900 peak   710 spectrum    1 weight  0.10000E+01 volume  0.43215E-03 ppm1      7.793 ppm2      3.393 CV     1
 OR {  710}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 164  and name HA  ))
 ASSI {  711}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 165  and name HB1 ))
      2.800     1.000     1.000 peak   711 spectrum    1 weight  0.10000E+01 volume  0.33992E-02 ppm1      7.794 ppm2      2.997 CV     1
 OR {  711}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  712}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      2.600     0.900     0.900 peak   712 spectrum    1 weight  0.10000E+01 volume  0.46119E-02 ppm1      7.793 ppm2      2.664 CV     1
 OR {  712}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 165  and name HB2 ))
 ASSI {  716}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
      3.400     1.400     1.400 peak   716 spectrum    1 weight  0.10000E+01 volume  0.13891E-02 ppm1      7.793 ppm2      2.018 CV     1
 OR {  716}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
 ASSI {  717}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 168  and name HB  ))
      4.300     2.300     1.700 peak   717 spectrum    1 weight  0.10000E+01 volume  0.85088E-03 ppm1      7.793 ppm2      1.916 CV     1
 OR {  717}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
 OR {  717}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  717}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  717}
   (( segid "    " and resid 166  and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
 OR {  717}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  717}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 ASSI {  719}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
      4.300     2.400     1.700 peak   719 spectrum    1 weight  0.10000E+01 volume  0.76086E-03 ppm1      7.794 ppm2      1.080 CV     1
 OR {  719}
   (( segid "    " and resid 166  and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
 ASSI {  720}
   (( segid "    " and resid 166  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
      6.000     4.700     0.000 peak   720 spectrum    1 weight  0.10000E+01 volume  0.10543E-03 ppm1      7.793 ppm2      0.835 CV     1
 OR {  720}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
 ASSI {  721}
   (( segid "    " and resid 166  and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
      4.000     2.000     2.000 peak   721 spectrum    1 weight  0.10000E+01 volume  0.13085E-02 ppm1      7.793 ppm2      0.574 CV     1
 OR {  721}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 OR {  721}
   (( segid "    " and resid 166  and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
 OR {  721}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 ASSI {  724}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 131  and name HN  ))
      3.800     1.800     1.800 peak   724 spectrum    1 weight  0.10000E+01 volume  0.92059E-03 ppm1      8.467 ppm2      8.636 CV     1
 OR {  724}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
 ASSI {  726}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HN  ))
      3.800     1.800     1.800 peak   726 spectrum    1 weight  0.10000E+01 volume  0.17350E-02 ppm1      8.467 ppm2      8.325 CV     1
 OR {  726}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
 ASSI {  729}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      4.000     2.000     2.000 peak   729 spectrum    1 weight  0.10000E+01 volume  0.49105E-03 ppm1      8.467 ppm2      4.471 CV     1
 OR {  729}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HA  ))
 ASSI {  730}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      1.900     0.400     0.400 peak   730 spectrum    1 weight  0.10000E+01 volume  0.24809E-01 ppm1      8.467 ppm2      4.134 CV     1
 OR {  730}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  731}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB2 ))
      2.400     0.700     0.700 peak   731 spectrum    1 weight  0.10000E+01 volume  0.90685E-02 ppm1      8.467 ppm2      3.915 CV     1
 OR {  731}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 130  and name HB2 ))
 OR {  731}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB1 ))
 OR {  731}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 130  and name HB1 ))
 ASSI {  733}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 129  and name HB  ))
      3.400     1.400     1.400 peak   733 spectrum    1 weight  0.10000E+01 volume  0.34048E-02 ppm1      8.467 ppm2      2.092 CV     1
 OR {  733}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB  ))
 ASSI {  734}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 104  and name HB2 ))
      3.800     1.800     1.800 peak   734 spectrum    1 weight  0.10000E+01 volume  0.50972E-03 ppm1      8.467 ppm2      1.906 CV     1
 OR {  734}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
 OR {  734}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 104  and name HB1 ))
 OR {  734}
   (( segid "    " and resid 2    and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  735}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 129  and name HG1%)
      3.100     1.200     1.200 peak   735 spectrum    1 weight  0.10000E+01 volume  0.44883E-02 ppm1      8.467 ppm2      0.974 CV     1
 OR {  735}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 29   and name HG1%)
 OR {  735}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 129  and name HG2%)
 OR {  735}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
 ASSI {  736}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      2.100     0.600     0.600 peak   736 spectrum    1 weight  0.10000E+01 volume  0.97179E-02 ppm1      8.717 ppm2      8.830 CV     1
 OR {  736}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
 ASSI {  739}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
      4.000     2.000     2.000 peak   739 spectrum    1 weight  0.10000E+01 volume  0.11739E-02 ppm1      8.717 ppm2      4.815 CV     1
 OR {  739}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  740}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 147  and name HB  ))
      6.000     4.800     0.000 peak   740 spectrum    1 weight  0.10000E+01 volume  0.54287E-04 ppm1      8.718 ppm2      4.424 CV     1
 OR {  740}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 47   and name HB  ))
 ASSI {  741}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.400     0.700     0.700 peak   741 spectrum    1 weight  0.10000E+01 volume  0.58413E-02 ppm1      8.718 ppm2      4.189 CV     1
 OR {  741}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  742}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      2.900     1.000     1.000 peak   742 spectrum    1 weight  0.10000E+01 volume  0.25080E-02 ppm1      8.718 ppm2      3.894 CV     1
 OR {  742}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  743}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 142  and name HB1 ))
      3.200     1.300     1.300 peak   743 spectrum    1 weight  0.10000E+01 volume  0.58184E-03 ppm1      8.718 ppm2      2.842 CV     1
 OR {  743}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 ASSI {  744}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HB2 ))
      4.100     2.200     1.900 peak   744 spectrum    1 weight  0.10000E+01 volume  0.70962E-03 ppm1      8.718 ppm2      2.734 CV     1
 OR {  744}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 142  and name HB2 ))
 ASSI {  745}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HG1 ))
      3.200     1.300     1.300 peak   745 spectrum    1 weight  0.10000E+01 volume  0.42731E-02 ppm1      8.718 ppm2      2.429 CV     1
 OR {  745}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HG1 ))
 OR {  745}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HG2 ))
 OR {  745}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 144  and name HG2 ))
 ASSI {  751}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.300     0.600     0.600 peak   751 spectrum    1 weight  0.10000E+01 volume  0.59590E-02 ppm1      8.582 ppm2      4.164 CV     1
 OR {  751}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  751}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  751}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
 ASSI {  752}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      3.700     1.700     1.700 peak   752 spectrum    1 weight  0.10000E+01 volume  0.15037E-02 ppm1      8.582 ppm2      3.390 CV     1
 OR {  752}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 164  and name HA  ))
 ASSI {  753}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HG1 ))
      3.700     1.700     1.700 peak   753 spectrum    1 weight  0.10000E+01 volume  0.26792E-02 ppm1      8.582 ppm2      1.592 CV     1
 OR {  753}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HG1 ))
 OR {  753}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HG2 ))
 OR {  753}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 19   and name HG2 ))
 OR {  753}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 172  and name HB2 ))
 ASSI {  755}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 163  and name HA  ))
      5.700     4.100     0.300 peak   755 spectrum    1 weight  0.10000E+01 volume  0.53107E-04 ppm1      8.581 ppm2      3.515 CV     1
 OR {  755}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  757}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
      2.200     0.600     0.600 peak   757 spectrum    1 weight  0.10000E+01 volume  0.55667E-02 ppm1      8.582 ppm2      2.260 CV     1
 OR {  757}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 166  and name HB1 ))
 OR {  757}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 166  and name HB2 ))
 OR {  757}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  759}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
      2.700     0.900     0.900 peak   759 spectrum    1 weight  0.10000E+01 volume  0.53192E-02 ppm1      8.582 ppm2      1.913 CV     1
 OR {  759}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  759}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  759}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  759}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
 OR {  759}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
 OR {  759}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
 OR {  759}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
 OR {  759}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  759}
   (( segid "    " and resid 167  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 ASSI {  764}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      3.700     1.700     1.700 peak   764 spectrum    1 weight  0.10000E+01 volume  0.16768E-02 ppm1      8.264 ppm2      8.376 CV     1
 OR {  764}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
 OR {  764}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
 OR {  764}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
 ASSI {  767}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
      2.700     0.900     0.900 peak   767 spectrum    1 weight  0.10000E+01 volume  0.37715E-02 ppm1      8.265 ppm2      4.326 CV     1
 OR {  767}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
 ASSI {  768}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      1.800     0.400     0.400 peak   768 spectrum    1 weight  0.10000E+01 volume  0.29703E-01 ppm1      8.264 ppm2      4.187 CV     1
 OR {  768}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  769}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
      3.200     1.300     1.300 peak   769 spectrum    1 weight  0.10000E+01 volume  0.30472E-02 ppm1      8.264 ppm2      2.074 CV     1
 OR {  769}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB  ))
 ASSI {  770}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 127  and name HB% )
      6.000     5.300     0.000 peak   770 spectrum    1 weight  0.10000E+01 volume  0.50127E-04 ppm1      8.266 ppm2      1.366 CV     1
 OR {  770}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 27   and name HB% )
 ASSI {  771}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 26   and name HG2%)
      2.900     1.000     1.000 peak   771 spectrum    1 weight  0.10000E+01 volume  0.29958E-02 ppm1      8.264 ppm2      1.200 CV     1
 OR {  771}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 126  and name HG2%)
 ASSI {  772}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 125  and name HG1%)
      3.000     1.100     1.100 peak   772 spectrum    1 weight  0.10000E+01 volume  0.59860E-02 ppm1      8.264 ppm2      0.932 CV     1
 OR {  772}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HG1%)
 OR {  772}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
 ASSI {  775}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.500     2.500     1.500 peak   775 spectrum    1 weight  0.10000E+01 volume  0.74682E-03 ppm1      8.634 ppm2      8.542 CV     1
 OR {  775}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 132  and name HN  ))
 ASSI {  777}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      6.000     4.500     0.000 peak   777 spectrum    1 weight  0.10000E+01 volume  0.52261E-04 ppm1      8.635 ppm2      8.344 CV     1
 OR {  777}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 133  and name HN  ))
 ASSI {  780}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      4.700     2.800     1.300 peak   780 spectrum    1 weight  0.10000E+01 volume  0.24509E-04 ppm1      8.633 ppm2      4.134 CV     1
 OR {  780}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  781}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB2 ))
      2.400     0.700     0.700 peak   781 spectrum    1 weight  0.10000E+01 volume  0.10864E-01 ppm1      8.633 ppm2      3.935 CV     1
 OR {  781}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
 OR {  781}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HB1 ))
 OR {  781}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
 OR {  781}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB1 ))
 OR {  781}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HB1 ))
 ASSI {  782}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 129  and name HG1%)
      3.000     3.000     3.000 peak   782 spectrum    1 weight  0.10000E+01 volume  0.35140E-03 ppm1      8.633 ppm2      0.973 CV     1
 OR {  782}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 29   and name HG1%)
 OR {  782}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 129  and name HG2%)
 OR {  782}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 29   and name HG2%)
 ASSI {  784}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HN  ))
      4.500     2.600     1.500 peak   784 spectrum    1 weight  0.10000E+01 volume  0.36030E-03 ppm1      8.484 ppm2      8.242 CV     1
 OR {  784}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
 OR {  784}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
 OR {  784}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
 ASSI {  786}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      3.000     1.100     1.100 peak   786 spectrum    1 weight  0.10000E+01 volume  0.20690E-02 ppm1      8.483 ppm2      4.558 CV     1
 OR {  786}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI {  787}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HA  ))
      2.600     0.800     0.800 peak   787 spectrum    1 weight  0.10000E+01 volume  0.48022E-02 ppm1      8.484 ppm2      4.390 CV     1
 OR {  787}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HA  ))
 ASSI {  788}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HB  ))
      4.300     2.300     1.700 peak   788 spectrum    1 weight  0.10000E+01 volume  0.58648E-03 ppm1      8.484 ppm2      4.210 CV     1
 OR {  788}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {  791}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      4.600     2.700     1.400 peak   791 spectrum    1 weight  0.10000E+01 volume  0.19783E-03 ppm1      8.008 ppm2      8.447 CV     1
 OR {  791}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 153  and name HN  ))
 ASSI {  793}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      2.400     0.700     0.700 peak   793 spectrum    1 weight  0.10000E+01 volume  0.56214E-02 ppm1      8.007 ppm2      7.901 CV     1
 OR {  793}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 154  and name HN  ))
 OR {  793}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
 ASSI {  795}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 156  and name HA  ))
      5.600     3.900     0.400 peak   795 spectrum    1 weight  0.10000E+01 volume  0.23427E-03 ppm1      8.007 ppm2      4.429 CV     1
 OR {  795}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HA  ))
 ASSI {  796}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      2.900     1.100     1.100 peak   796 spectrum    1 weight  0.10000E+01 volume  0.33200E-02 ppm1      8.007 ppm2      4.299 CV     1
 OR {  796}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 152  and name HA  ))
 ASSI {  797}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.600     0.900     0.900 peak   797 spectrum    1 weight  0.10000E+01 volume  0.55101E-02 ppm1      8.007 ppm2      4.234 CV     1
 OR {  797}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
 ASSI {  799}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      4.300     2.300     1.700 peak   799 spectrum    1 weight  0.10000E+01 volume  0.46477E-03 ppm1      8.007 ppm2      3.976 CV     1
 OR {  799}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
 OR {  799}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 57   and name HA1 ))
 OR {  799}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 157  and name HA1 ))
 ASSI {  800}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HD1 ))
      4.900     3.000     1.100 peak   800 spectrum    1 weight  0.10000E+01 volume  0.40461E-03 ppm1      8.007 ppm2      3.389 CV     1
 OR {  800}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HD1 ))
 ASSI {  801}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 155  and name HD2 ))
      4.500     2.500     1.500 peak   801 spectrum    1 weight  0.10000E+01 volume  0.65319E-03 ppm1      8.007 ppm2      3.266 CV     1
 OR {  801}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HD2 ))
 ASSI {  802}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      5.000     3.200     1.000 peak   802 spectrum    1 weight  0.10000E+01 volume  0.33382E-03 ppm1      8.007 ppm2      2.255 CV     1
 OR {  802}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR {  802}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
 OR {  802}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
 ASSI {  805}
   (( segid "    " and resid 55   and name HN  ))
   (  segid "    " and resid 52   and name HB% )
      4.500     2.600     1.500 peak   805 spectrum    1 weight  0.10000E+01 volume  0.62620E-03 ppm1      8.007 ppm2      1.808 CV     1
 OR {  805}
   (( segid "    " and resid 155  and name HN  ))
   (  segid "    " and resid 152  and name HB% )
 ASSI {  806}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 156  and name HG2 ))
      3.100     1.200     1.200 peak   806 spectrum    1 weight  0.10000E+01 volume  0.47845E-02 ppm1      8.008 ppm2      1.668 CV     1
 OR {  806}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
 OR {  806}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
 OR {  806}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 ASSI {  809}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      4.900     3.000     1.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.21688E-03 ppm1      8.849 ppm2      9.072 CV     1
 OR {  809}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 OR {  809}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
 OR {  809}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
 ASSI {  813}
   (( segid "    " and resid 146  and name HN  ))
   (  segid "    " and resid 141  and name HD% )
      5.600     3.900     0.400 peak   813 spectrum    1 weight  0.10000E+01 volume  0.19670E-03 ppm1      8.850 ppm2      7.316 CV     1
 OR {  813}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 41   and name HD% )
 ASSI {  814}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HD2 ))
      5.300     3.400     0.700 peak   814 spectrum    1 weight  0.10000E+01 volume  0.22125E-03 ppm1      8.849 ppm2      6.322 CV     1
 OR {  814}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 146  and name HD2 ))
 ASSI {  815}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      5.200     3.400     0.800 peak   815 spectrum    1 weight  0.10000E+01 volume  0.10539E-03 ppm1      8.849 ppm2      4.186 CV     1
 OR {  815}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
 ASSI {  816}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HA  ))
      3.500     1.500     1.500 peak   816 spectrum    1 weight  0.10000E+01 volume  0.65295E-03 ppm1      8.850 ppm2      3.966 CV     1
 OR {  816}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI {  817}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.400     0.700     0.700 peak   817 spectrum    1 weight  0.10000E+01 volume  0.53539E-02 ppm1      8.850 ppm2      3.872 CV     1
 OR {  817}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
 OR {  817}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  819}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 141  and name HB1 ))
      3.700     1.700     1.700 peak   819 spectrum    1 weight  0.10000E+01 volume  0.10574E-02 ppm1      8.850 ppm2      3.241 CV     1
 OR {  819}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 41   and name HB2 ))
 OR {  819}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 49   and name HB1 ))
 OR {  819}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
 ASSI {  821}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 41   and name HB1 ))
      3.700     1.700     1.700 peak   821 spectrum    1 weight  0.10000E+01 volume  0.99763E-03 ppm1      8.850 ppm2      2.823 CV     1
 OR {  821}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 141  and name HB2 ))
 OR {  821}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 142  and name HB1 ))
 OR {  821}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 42   and name HB1 ))
 OR {  821}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HE2 ))
 ASSI {  823}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.800     1.000     1.000 peak   823 spectrum    1 weight  0.10000E+01 volume  0.17849E-02 ppm1      8.849 ppm2      2.009 CV     1
 OR {  823}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HB2 ))
 OR {  823}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
 OR {  823}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  824}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
      4.700     2.800     1.300 peak   824 spectrum    1 weight  0.10000E+01 volume  0.78355E-03 ppm1      8.850 ppm2      1.496 CV     1
 OR {  824}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR {  824}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HD2 ))
 OR {  824}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
 OR {  824}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI {  825}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG1 ))
      4.800     2.900     1.200 peak   825 spectrum    1 weight  0.10000E+01 volume  0.43423E-03 ppm1      8.850 ppm2      1.444 CV     1
 OR {  825}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG1 ))
 OR {  825}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HG2 ))
 OR {  825}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 145  and name HG2 ))
 OR {  825}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HB2 ))
 OR {  825}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
 OR {  825}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 135  and name HB1 ))
 OR {  825}
   (( segid "    " and resid 146  and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
 ASSI {  829}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      5.600     4.000     0.400 peak   829 spectrum    1 weight  0.10000E+01 volume  0.50086E-04 ppm1      8.588 ppm2      3.197 CV     1
 OR {  829}
   (( segid "    " and resid 7    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI {  830}
   (( segid "    " and resid 7    and name HN  ))
   (  segid "    " and resid 6    and name HB% )
      6.000     5.600     0.000 peak   830 spectrum    1 weight  0.10000E+01 volume  0.24627E-04 ppm1      8.586 ppm2      1.360 CV     1
 OR {  830}
   (( segid "    " and resid 107  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  832}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      3.800     1.800     1.800 peak   832 spectrum    1 weight  0.10000E+01 volume  0.70240E-03 ppm1      7.718 ppm2      9.442 CV     1
 OR {  832}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 172  and name HN  ))
 ASSI {  833}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      3.900     1.900     1.900 peak   833 spectrum    1 weight  0.10000E+01 volume  0.53894E-03 ppm1      7.718 ppm2      8.675 CV     1
 OR {  833}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 168  and name HN  ))
 ASSI {  837}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 170  and name HD22))
      4.900     3.000     1.100 peak   837 spectrum    1 weight  0.10000E+01 volume  0.64030E-03 ppm1      7.718 ppm2      7.096 CV     1
 OR {  837}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HD22))
 ASSI {  840}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HA  ))
      2.700     0.900     0.900 peak   840 spectrum    1 weight  0.10000E+01 volume  0.44413E-02 ppm1      7.718 ppm2      4.167 CV     1
 OR {  840}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 167  and name HA  ))
 OR {  840}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 166  and name HA  ))
 OR {  840}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 66   and name HA  ))
 OR {  840}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
 OR {  840}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 171  and name HA  ))
 ASSI {  841}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.200     1.200     1.200 peak   841 spectrum    1 weight  0.10000E+01 volume  0.27255E-02 ppm1      7.717 ppm2      3.322 CV     1
 OR {  841}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 168  and name HA  ))
 OR {  841}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
 OR {  841}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  841}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HB2 ))
 OR {  841}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI {  842}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 170  and name HB2 ))
      2.200     0.600     0.600 peak   842 spectrum    1 weight  0.10000E+01 volume  0.10296E-01 ppm1      7.718 ppm2      3.083 CV     1
 OR {  842}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB2 ))
 OR {  842}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 170  and name HB1 ))
 OR {  842}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI {  845}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
      3.600     1.700     1.700 peak   845 spectrum    1 weight  0.10000E+01 volume  0.15059E-02 ppm1      7.718 ppm2      2.000 CV     1
 OR {  845}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 167  and name HG  ))
 OR {  845}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
 OR {  845}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 72   and name HG  ))
 OR {  845}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 172  and name HG  ))
 OR {  845}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI {  846}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
      4.100     2.100     1.900 peak   846 spectrum    1 weight  0.10000E+01 volume  0.57629E-03 ppm1      7.717 ppm2      1.924 CV     1
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 173  and name HB2 ))
 OR {  846}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  846}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 167  and name HB2 ))
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 67   and name HB2 ))
 OR {  846}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 68   and name HB  ))
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 168  and name HB  ))
 OR {  846}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 67   and name HB1 ))
 OR {  846}
   (( segid "    " and resid 170  and name HN  ))
   (( segid "    " and resid 167  and name HB1 ))
 ASSI {  847}
   (( segid "    " and resid 170  and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
      4.200     2.200     1.800 peak   847 spectrum    1 weight  0.10000E+01 volume  0.96390E-03 ppm1      7.717 ppm2      1.074 CV     1
 OR {  847}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 167  and name HD1%)
 OR {  847}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
 ASSI {  848}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
      4.300     2.300     1.700 peak   848 spectrum    1 weight  0.10000E+01 volume  0.73975E-03 ppm1      7.718 ppm2      0.579 CV     1
 OR {  848}
   (( segid "    " and resid 170  and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
 OR {  848}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 167  and name HD2%)
 OR {  848}
   (( segid "    " and resid 170  and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
 ASSI {  849}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      3.600     1.600     1.600 peak   849 spectrum    1 weight  0.10000E+01 volume  0.61552E-03 ppm1      7.464 ppm2      8.518 CV     1
 OR {  849}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 171  and name HN  ))
 ASSI {  850}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 171  and name HE3 ))
      6.000     4.600     0.000 peak   850 spectrum    1 weight  0.10000E+01 volume  0.95321E-04 ppm1      7.465 ppm2      7.259 CV     1
 OR {  850}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HE3 ))
 ASSI {  851}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HA  ))
      4.900     3.000     1.100 peak   851 spectrum    1 weight  0.10000E+01 volume  0.51504E-03 ppm1      7.464 ppm2      4.248 CV     1
 OR {  851}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
 ASSI {  852}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
      3.000     1.100     1.100 peak   852 spectrum    1 weight  0.10000E+01 volume  0.17096E-02 ppm1      7.464 ppm2      3.873 CV     1
 OR {  852}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
 ASSI {  853}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 71   and name HB1 ))
      4.500     2.600     1.500 peak   853 spectrum    1 weight  0.10000E+01 volume  0.46034E-03 ppm1      7.464 ppm2      3.340 CV     1
 OR {  853}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 171  and name HB1 ))
 OR {  853}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 171  and name HB2 ))
 ASSI {  854}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HG1 ))
      4.900     3.000     1.100 peak   854 spectrum    1 weight  0.10000E+01 volume  0.54701E-03 ppm1      7.464 ppm2      2.309 CV     1
 OR {  854}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HG1 ))
 OR {  854}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
 OR {  854}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HG2 ))
 OR {  854}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 76   and name HG1 ))
 ASSI {  855}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HD1 ))
      3.300     1.400     1.400 peak   855 spectrum    1 weight  0.10000E+01 volume  0.54105E-02 ppm1      7.464 ppm2      1.752 CV     1
 OR {  855}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 173  and name HD1 ))
 OR {  855}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
 OR {  855}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HD2 ))
 OR {  855}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 173  and name HD2 ))
 ASSI {  857}
   (( segid "    " and resid 173  and name HN  ))
   (  segid "    " and resid 172  and name HD2%)
      3.700     1.700     1.700 peak   857 spectrum    1 weight  0.10000E+01 volume  0.98832E-03 ppm1      7.464 ppm2      1.058 CV     1
 OR {  857}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 72   and name HD2%)
 ASSI {  860}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      2.200     0.600     0.600 peak   860 spectrum    1 weight  0.10000E+01 volume  0.60600E-02 ppm1      7.464 ppm2      7.098 CV     1
 OR {  860}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 174  and name HN  ))
 ASSI {  865}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
      4.200     2.200     1.800 peak   865 spectrum    1 weight  0.10000E+01 volume  0.78405E-03 ppm1      7.463 ppm2      2.994 CV     1
 OR {  865}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 169  and name HB2 ))
 ASSI {  866}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      1.900     0.400     0.400 peak   866 spectrum    1 weight  0.10000E+01 volume  0.23667E-01 ppm1      7.464 ppm2      1.994 CV     1
 OR {  866}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 173  and name HB2 ))
 OR {  866}
   (( segid "    " and resid 173  and name HN  ))
   (( segid "    " and resid 173  and name HB1 ))
 OR {  866}
   (( segid "    " and resid 73   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  872}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      4.900     3.100     1.100 peak   872 spectrum    1 weight  0.10000E+01 volume  0.47428E-03 ppm1      8.934 ppm2      6.955 CV     1
 OR {  872}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  872}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  874}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 149  and name HE% )
      3.900     1.900     1.900 peak   874 spectrum    1 weight  0.10000E+01 volume  0.81177E-03 ppm1      8.934 ppm2      6.505 CV     1
 OR {  874}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 49   and name HE% )
 ASSI {  876}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      3.400     1.400     1.400 peak   876 spectrum    1 weight  0.10000E+01 volume  0.88089E-03 ppm1      8.934 ppm2      3.517 CV     1
 OR {  876}
   (( segid "    " and resid 164  and name HN  ))
   (( segid "    " and resid 163  and name HA  ))
 ASSI {  879}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      6.000     6.000     0.000 peak   879 spectrum    1 weight  0.10000E+01 volume  0.72242E-04 ppm1      8.934 ppm2      3.000 CV     1
 OR {  879}
   (( segid "    " and resid 164  and name HN  ))
   (( segid "    " and resid 165  and name HB1 ))
 ASSI {  884}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      3.000     1.100     1.100 peak   884 spectrum    1 weight  0.10000E+01 volume  0.27432E-02 ppm1      8.934 ppm2      0.831 CV     1
 OR {  884}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 OR {  884}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 137  and name HG1%)
 ASSI {  885}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      3.600     3.600     2.400 peak   885 spectrum    1 weight  0.10000E+01 volume  0.23203E-02 ppm1      8.934 ppm2      0.613 CV     1
 OR {  885}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 OR {  885}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
 ASSI {  886}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 139  and name HG2%)
      5.400     3.700     0.600 peak   886 spectrum    1 weight  0.10000E+01 volume  0.64702E-03 ppm1      8.934 ppm2      0.475 CV     1
 OR {  886}
   (( segid "    " and resid 164  and name HN  ))
   (  segid "    " and resid 39   and name HG2%)
 ASSI {  889}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 163  and name HN  ))
      4.100     2.100     1.900 peak   889 spectrum    1 weight  0.10000E+01 volume  0.86169E-03 ppm1      8.874 ppm2      8.247 CV     1
 OR {  889}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
 OR {  889}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 161  and name HN  ))
 OR {  889}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  894}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 159  and name HA  ))
      2.600     0.900     0.900 peak   894 spectrum    1 weight  0.10000E+01 volume  0.36426E-02 ppm1      8.874 ppm2      4.746 CV     1
 OR {  894}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
 ASSI {  895}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
      5.300     3.600     0.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.44052E-03 ppm1      8.874 ppm2      4.429 CV     1
 OR {  895}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI {  896}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 159  and name HB2 ))
      3.300     1.400     1.400 peak   896 spectrum    1 weight  0.10000E+01 volume  0.10526E-02 ppm1      8.874 ppm2      4.106 CV     1
 OR {  896}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 OR {  896}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 159  and name HB1 ))
 OR {  896}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  901}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
      5.300     3.500     0.700 peak   901 spectrum    1 weight  0.10000E+01 volume  0.20410E-03 ppm1      8.873 ppm2      2.251 CV     1
 OR {  901}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR {  901}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
 OR {  901}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 OR {  901}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 166  and name HB2 ))
 ASSI {  904}
   (( segid "    " and resid 159  and name HN  ))
   (( segid "    " and resid 160  and name HN  ))
      6.000     6.000     0.000 peak   904 spectrum    1 weight  0.10000E+01 volume  0.49017E-04 ppm1      8.872 ppm2      8.729 CV     1
 OR {  904}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI {  906}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HB2 ))
      5.500     3.700     0.500 peak   906 spectrum    1 weight  0.10000E+01 volume  0.21718E-03 ppm1      8.719 ppm2      1.966 CV     1
 OR {  906}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 148  and name HB1 ))
 ASSI {  907}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      3.700     1.700     1.700 peak   907 spectrum    1 weight  0.10000E+01 volume  0.77886E-03 ppm1      8.717 ppm2      9.068 CV     1
 OR {  907}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 OR {  907}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
 ASSI {  911}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 145  and name HN  ))
      4.300     2.300     1.700 peak   911 spectrum    1 weight  0.10000E+01 volume  0.45984E-03 ppm1      8.717 ppm2      7.921 CV     1
 OR {  911}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  914}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      2.900     1.100     1.100 peak   914 spectrum    1 weight  0.10000E+01 volume  0.31382E-02 ppm1      8.717 ppm2      4.186 CV     1
 OR {  914}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 144  and name HA  ))
 OR {  914}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  915}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HA  ))
      2.900     1.000     1.000 peak   915 spectrum    1 weight  0.10000E+01 volume  0.26504E-02 ppm1      8.717 ppm2      3.875 CV     1
 OR {  915}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
 OR {  915}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
 ASSI {  918}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 46   and name HB2 ))
      3.500     1.500     1.500 peak   918 spectrum    1 weight  0.10000E+01 volume  0.20565E-02 ppm1      8.717 ppm2      2.961 CV     1
 OR {  918}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 146  and name HB2 ))
 ASSI {  919}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.600     1.600     1.600 peak   919 spectrum    1 weight  0.10000E+01 volume  0.84706E-03 ppm1      8.717 ppm2      2.171 CV     1
 OR {  919}
   (( segid "    " and resid 147  and name HN  ))
   (( segid "    " and resid 144  and name HB1 ))
 ASSI {  925}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 141  and name HE% )
      3.300     1.300     1.300 peak   925 spectrum    1 weight  0.10000E+01 volume  0.24810E-02 ppm1      7.918 ppm2      6.962 CV     1
 OR {  925}
   (( segid "    " and resid 165  and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 OR {  925}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 41   and name HE% )
 ASSI {  928}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 164  and name HA  ))
      3.500     1.600     1.600 peak   928 spectrum    1 weight  0.10000E+01 volume  0.49090E-03 ppm1      7.918 ppm2      3.393 CV     1
 OR {  928}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI {  929}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 165  and name HB1 ))
      3.000     1.100     1.100 peak   929 spectrum    1 weight  0.10000E+01 volume  0.62133E-02 ppm1      7.918 ppm2      3.000 CV     1
 OR {  929}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
 ASSI {  931}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 166  and name HB2 ))
      6.000     6.000     0.000 peak   931 spectrum    1 weight  0.10000E+01 volume  0.25263E-04 ppm1      7.917 ppm2      2.264 CV     1
 OR {  931}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 OR {  931}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
 OR {  931}
   (( segid "    " and resid 165  and name HN  ))
   (( segid "    " and resid 166  and name HB1 ))
 ASSI {  933}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
      6.000     6.000     0.000 peak   933 spectrum    1 weight  0.10000E+01 volume  0.24815E-04 ppm1      7.918 ppm2      1.265 CV     1
 OR {  933}
   (( segid "    " and resid 165  and name HN  ))
   (  segid "    " and resid 161  and name HG2%)
 ASSI {  936}
   (( segid "    " and resid 165  and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
      5.300     3.400     0.700 peak   936 spectrum    1 weight  0.10000E+01 volume  0.19148E-03 ppm1      7.918 ppm2      0.612 CV     1
 OR {  936}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 68   and name HG2%)
 OR {  936}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 168  and name HG2%)
 ASSI {  940}
   (( segid "    " and resid 175  and name HD21))
   (( segid "    " and resid 171  and name HD1 ))
      2.600     2.600     3.400 peak   940 spectrum    1 weight  0.10000E+01 volume  0.90869E-03 ppm1      6.713 ppm2      7.396 CV     1
 OR {  940}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 71   and name HD1 ))
 ASSI {  941}
   (( segid "    " and resid 175  and name HD21))
   (( segid "    " and resid 171  and name HZ3 ))
      4.500     2.500     1.500 peak   941 spectrum    1 weight  0.10000E+01 volume  0.30281E-03 ppm1      6.713 ppm2      7.101 CV     1
 OR {  941}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 71   and name HZ3 ))
 OR {  941}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  946}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 148  and name HB1 ))
      3.400     1.500     1.500 peak   946 spectrum    1 weight  0.10000E+01 volume  0.13628E-02 ppm1      6.714 ppm2      1.947 CV     1
 OR {  946}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 156  and name HB2 ))
 OR {  946}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 155  and name HB2 ))
 OR {  946}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 148  and name HG2 ))
 OR {  946}
   (( segid "    " and resid 175  and name HD21))
   (( segid "    " and resid 48   and name HG1 ))
 ASSI {  947}
   (( segid "    " and resid 75   and name HD21))
   (  segid "    " and resid 152  and name HB% )
      3.600     1.700     1.700 peak   947 spectrum    1 weight  0.10000E+01 volume  0.32166E-02 ppm1      6.713 ppm2      1.789 CV     1
 OR {  947}
   (( segid "    " and resid 175  and name HD21))
   (  segid "    " and resid 52   and name HB% )
 ASSI {  953}
   (( segid "    " and resid 175  and name HD22))
   (( segid "    " and resid 175  and name HA  ))
      6.000     5.500     0.000 peak   953 spectrum    1 weight  0.10000E+01 volume  0.13630E-03 ppm1      6.058 ppm2      4.564 CV     1
 OR {  953}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  954}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 71   and name HA  ))
      3.500     1.500     1.500 peak   954 spectrum    1 weight  0.10000E+01 volume  0.56683E-03 ppm1      6.056 ppm2      4.190 CV     1
 OR {  954}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 148  and name HA  ))
 OR {  954}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 151  and name HA  ))
 ASSI {  955}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 148  and name HB1 ))
      4.300     2.400     1.700 peak   955 spectrum    1 weight  0.10000E+01 volume  0.31508E-03 ppm1      6.056 ppm2      1.948 CV     1
 OR {  955}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 155  and name HB2 ))
 OR {  955}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 156  and name HB2 ))
 OR {  955}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 155  and name HG1 ))
 OR {  955}
   (( segid "    " and resid 75   and name HD22))
   (( segid "    " and resid 148  and name HG2 ))
 ASSI {  956}
   (( segid "    " and resid 75   and name HD22))
   (  segid "    " and resid 152  and name HB% )
      2.700     0.900     0.900 peak   956 spectrum    1 weight  0.10000E+01 volume  0.17442E-02 ppm1      6.058 ppm2      1.789 CV     1
 OR {  956}
   (( segid "    " and resid 175  and name HD22))
   (  segid "    " and resid 52   and name HB% )
 ASSI {  961}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 71   and name HZ3 ))
      5.800     4.200     0.200 peak   961 spectrum    1 weight  0.10000E+01 volume  0.10254E-03 ppm1      8.447 ppm2      7.123 CV     1
 OR {  961}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 171  and name HZ3 ))
 ASSI {  962}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 150  and name HG2 ))
      4.800     2.800     1.200 peak   962 spectrum    1 weight  0.10000E+01 volume  0.17290E-03 ppm1      8.446 ppm2      1.269 CV     1
 OR {  962}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {  962}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 160  and name HG12))
 OR {  962}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI {  966}
   (( segid "    " and resid 153  and name HN  ))
   (  segid "    " and resid 149  and name HD% )
      4.400     2.400     1.600 peak   966 spectrum    1 weight  0.10000E+01 volume  0.59440E-03 ppm1      8.446 ppm2      6.958 CV     1
 OR {  966}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
 ASSI {  967}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 171  and name HH2 ))
      4.100     2.100     1.900 peak   967 spectrum    1 weight  0.10000E+01 volume  0.42775E-03 ppm1      8.445 ppm2      6.793 CV     1
 OR {  967}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 71   and name HH2 ))
 ASSI {  968}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 52   and name HA  ))
      3.300     1.300     1.300 peak   968 spectrum    1 weight  0.10000E+01 volume  0.14612E-02 ppm1      8.446 ppm2      4.301 CV     1
 OR {  968}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 152  and name HA  ))
 ASSI {  969}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.800     1.800     1.800 peak   969 spectrum    1 weight  0.10000E+01 volume  0.11564E-02 ppm1      8.446 ppm2      4.229 CV     1
 OR {  969}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
 OR {  969}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
 OR {  969}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI {  971}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.400     1.400 peak   971 spectrum    1 weight  0.10000E+01 volume  0.98189E-03 ppm1      8.446 ppm2      3.442 CV     1
 OR {  971}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
 ASSI {  976}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 54   and name HB% )
      3.700     1.700     1.700 peak   976 spectrum    1 weight  0.10000E+01 volume  0.31808E-02 ppm1      8.446 ppm2      1.546 CV     1
 OR {  976}
   (( segid "    " and resid 153  and name HN  ))
   (  segid "    " and resid 154  and name HB% )
 OR {  976}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 51   and name HB% )
 OR {  976}
   (( segid "    " and resid 153  and name HN  ))
   (  segid "    " and resid 151  and name HB% )
 ASSI {  977}
   (( segid "    " and resid 153  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
      4.700     2.700     1.300 peak   977 spectrum    1 weight  0.10000E+01 volume  0.73995E-03 ppm1      8.446 ppm2      1.180 CV     1
 OR {  977}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI {  981}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HB  ))
      3.800     1.800     1.800 peak   981 spectrum    1 weight  0.10000E+01 volume  0.72882E-03 ppm1      8.234 ppm2      4.212 CV     1
 OR {  981}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HB  ))
 ASSI {  988}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
      3.900     1.900     1.900 peak   988 spectrum    1 weight  0.10000E+01 volume  0.73842E-03 ppm1      7.539 ppm2      4.237 CV     1
 OR {  988}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI {  990}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
      3.000     1.100     1.100 peak   990 spectrum    1 weight  0.10000E+01 volume  0.46803E-02 ppm1      7.540 ppm2      3.976 CV     1
 OR {  990}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
 OR {  990}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HA1 ))
 OR {  990}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 157  and name HA1 ))
 ASSI {  993}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      2.100     0.600     0.600 peak   993 spectrum    1 weight  0.10000E+01 volume  0.11230E-01 ppm1      7.540 ppm2      1.933 CV     1
 OR {  993}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 155  and name HB2 ))
 OR {  993}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
 OR {  993}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI {  996}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
      3.500     1.500     1.500 peak   996 spectrum    1 weight  0.10000E+01 volume  0.19595E-02 ppm1      7.539 ppm2      1.179 CV     1
 OR {  996}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
 ASSI {  998}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      3.700     1.700     1.700 peak   998 spectrum    1 weight  0.10000E+01 volume  0.89663E-03 ppm1      8.128 ppm2      8.508 CV     1
 OR {  998}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HN  ))
 ASSI {  999}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.100     2.100     1.900 peak   999 spectrum    1 weight  0.10000E+01 volume  0.11010E-02 ppm1      8.129 ppm2      8.414 CV     1
 OR {  999}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
 OR {  999}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI { 1002}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.200     0.600     0.600 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.11633E-01 ppm1      8.129 ppm2      4.516 CV     1
 OR { 1002}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI { 1003}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HA  ))
      2.900     1.000     1.000 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.22781E-02 ppm1      8.129 ppm2      4.314 CV     1
 OR { 1003}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 1004}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 14   and name HB  ))
      3.500     1.500     1.500 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.19978E-02 ppm1      8.128 ppm2      4.153 CV     1
 OR { 1004}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
 ASSI { 1005}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HB2 ))
      3.400     1.500     1.500 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.24743E-02 ppm1      8.129 ppm2      1.983 CV     1
 OR { 1005}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 1005}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
 OR { 1005}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HB1 ))
 ASSI { 1006}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      3.300     1.400     1.400 peak  1006 spectrum    1 weight  0.10000E+01 volume  0.16244E-02 ppm1      8.128 ppm2      1.129 CV     1
 OR { 1006}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 14   and name HG2%)
 ASSI { 1011}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 171  and name HE3 ))
      6.000     6.000     0.000 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.24431E-04 ppm1      7.496 ppm2      7.268 CV     1
 OR { 1011}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HE3 ))
 OR { 1011}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 71   and name HZ2 ))
 ASSI { 1012}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 174  and name HN  ))
      2.100     0.600     0.600 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.84706E-02 ppm1      7.496 ppm2      7.098 CV     1
 OR { 1012}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI { 1013}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HD21))
      2.900     1.000     1.000 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.36098E-02 ppm1      7.496 ppm2      6.713 CV     1
 OR { 1013}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 175  and name HD21))
 ASSI { 1014}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HD22))
      3.800     1.800     1.800 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.45858E-02 ppm1      7.496 ppm2      6.056 CV     1
 OR { 1014}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 175  and name HD22))
 ASSI { 1015}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.500     0.800     0.800 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.59393E-02 ppm1      7.496 ppm2      4.564 CV     1
 OR { 1015}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 175  and name HA  ))
 ASSI { 1017}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.900     1.900     1.900 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.87963E-03 ppm1      7.497 ppm2      4.045 CV     1
 OR { 1017}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 173  and name HA  ))
 ASSI { 1018}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
      3.200     1.300     1.300 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.34738E-02 ppm1      7.496 ppm2      3.877 CV     1
 OR { 1018}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
 OR { 1018}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
 OR { 1018}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 1019}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HG2 ))
      3.800     1.800     1.800 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.19705E-02 ppm1      7.496 ppm2      2.306 CV     1
 OR { 1019}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 174  and name HG2 ))
 OR { 1019}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HG1 ))
 OR { 1019}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 174  and name HG1 ))
 ASSI { 1021}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      2.800     1.000     1.000 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.85364E-02 ppm1      7.496 ppm2      1.973 CV     1
 OR { 1021}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 176  and name HB2 ))
 OR { 1021}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
 OR { 1021}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 176  and name HB1 ))
 ASSI { 1022}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 174  and name HB2 ))
      2.400     0.700     0.700 peak  1022 spectrum    1 weight  0.10000E+01 volume  0.72565E-02 ppm1      7.496 ppm2      1.789 CV     1
 OR { 1022}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HB2 ))
 ASSI { 1023}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.900     1.100     1.100 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.81832E-02 ppm1      7.496 ppm2      1.701 CV     1
 OR { 1023}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI { 1025}
   (( segid "    " and resid 175  and name HN  ))
   (( segid "    " and resid 175  and name HB1 ))
      2.000     0.500     0.500 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.65921E-02 ppm1      7.496 ppm2      0.790 CV     1
 OR { 1025}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 1027}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      4.800     2.900     1.200 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.32971E-03 ppm1      8.050 ppm2      8.874 CV     1
 OR { 1027}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 159  and name HN  ))
 ASSI { 1030}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 156  and name HN  ))
      3.700     1.700     1.700 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.17846E-02 ppm1      8.050 ppm2      7.541 CV     1
 OR { 1030}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HN  ))
 ASSI { 1032}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 156  and name HA  ))
      3.400     3.400     2.600 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.56698E-03 ppm1      8.050 ppm2      4.428 CV     1
 OR { 1032}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
 OR { 1032}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1034}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      3.500     1.500     1.500 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.15440E-02 ppm1      8.050 ppm2      1.927 CV     1
 OR { 1034}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 1035}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 54   and name HB% )
      2.700     2.700     3.300 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.74427E-03 ppm1      8.050 ppm2      1.538 CV     1
 OR { 1035}
   (( segid "    " and resid 158  and name HN  ))
   (  segid "    " and resid 154  and name HB% )
 ASSI { 1036}
   (( segid "    " and resid 58   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      4.500     2.500     1.500 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.50884E-03 ppm1      8.050 ppm2      0.832 CV     1
 OR { 1036}
   (( segid "    " and resid 158  and name HN  ))
   (  segid "    " and resid 163  and name HG1%)
 ASSI { 1038}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.000     1.100     1.100 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.23129E-02 ppm1      8.049 ppm2      4.235 CV     1
 OR { 1038}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
 ASSI { 1039}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.500     1.500     1.500 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.15881E-02 ppm1      8.049 ppm2      2.258 CV     1
 OR { 1039}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 153  and name HB1 ))
 OR { 1039}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
 OR { 1039}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
 ASSI { 1040}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
      6.000     4.700     0.000 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.10193E-03 ppm1      8.048 ppm2      1.684 CV     1
 OR { 1040}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 OR { 1040}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
 ASSI { 1042}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      2.700     0.900     0.900 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.23963E-02 ppm1      8.275 ppm2      8.732 CV     1
 OR { 1042}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 160  and name HN  ))
 ASSI { 1044}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 162  and name HN  ))
      2.400     0.700     0.700 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.29820E-02 ppm1      8.275 ppm2      7.659 CV     1
 OR { 1044}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 1046}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      3.800     1.800     1.800 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.13280E-02 ppm1      8.275 ppm2      4.747 CV     1
 OR { 1046}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 159  and name HA  ))
 ASSI { 1047}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 162  and name HA  ))
      6.000     6.000     0.000 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.24741E-04 ppm1      8.275 ppm2      4.428 CV     1
 OR { 1047}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 1048}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.300     0.600     0.600 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.90153E-02 ppm1      8.275 ppm2      4.084 CV     1
 OR { 1048}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 161  and name HB  ))
 OR { 1048}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
 OR { 1048}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 159  and name HB1 ))
 OR { 1048}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1051}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
      3.100     1.200     1.200 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.45602E-02 ppm1      8.275 ppm2      1.636 CV     1
 OR { 1051}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 160  and name HB  ))
 ASSI { 1052}
   (( segid "    " and resid 161  and name HN  ))
   (  segid "    " and resid 161  and name HG2%)
      2.900     1.100     1.100 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.82032E-02 ppm1      8.275 ppm2      1.266 CV     1
 OR { 1052}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
 OR { 1052}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG12))
 ASSI { 1053}
   (( segid "    " and resid 161  and name HN  ))
   (  segid "    " and resid 160  and name HG2%)
      2.500     0.800     0.800 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.39850E-02 ppm1      8.275 ppm2      0.627 CV     1
 OR { 1053}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
 ASSI { 1054}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HD1%)
      3.700     1.700     1.700 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.23817E-02 ppm1      8.275 ppm2      0.500 CV     1
 OR { 1054}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 139  and name HG2%)
 ASSI { 1055}
   (( segid "    " and resid 161  and name HN  ))
   (( segid "    " and resid 160  and name HG11))
      4.000     2.000     2.000 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.80044E-03 ppm1      8.275 ppm2     -0.243 CV     1
 OR { 1055}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HG11))
 ASSI { 1056}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 63   and name HG2%)
      5.700     4.000     0.300 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.99282E-04 ppm1      8.274 ppm2      0.814 CV     1
 OR { 1056}
   (( segid "    " and resid 161  and name HN  ))
   (  segid "    " and resid 37   and name HG1%)
 OR { 1056}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 137  and name HG1%)
 ASSI { 1057}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 172  and name HN  ))
      5.000     3.100     1.000 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.14580E-03 ppm1      7.099 ppm2      9.443 CV     1
 OR { 1057}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 1061}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HD21))
      3.700     1.800     1.800 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.11791E-02 ppm1      7.098 ppm2      6.714 CV     1
 OR { 1061}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HD21))
 ASSI { 1062}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HD22))
      4.500     2.500     1.500 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.14331E-02 ppm1      7.098 ppm2      6.055 CV     1
 OR { 1062}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HD22))
 ASSI { 1063}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HA  ))
      4.700     2.700     1.300 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.83793E-03 ppm1      7.099 ppm2      4.562 CV     1
 OR { 1063}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI { 1066}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 172  and name HA  ))
      4.000     2.000     2.000 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.73426E-03 ppm1      7.097 ppm2      3.875 CV     1
 OR { 1066}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 72   and name HA  ))
 OR { 1066}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 176  and name HA  ))
 ASSI { 1069}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 173  and name HB2 ))
      2.100     0.500     0.500 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.16023E-01 ppm1      7.098 ppm2      1.976 CV     1
 OR { 1069}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 1069}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 1069}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 173  and name HB1 ))
 ASSI { 1071}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 173  and name HG1 ))
      4.000     2.000     2.000 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.17700E-02 ppm1      7.098 ppm2      1.681 CV     1
 OR { 1071}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HG1 ))
 OR { 1071}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
 OR { 1071}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HB2 ))
 ASSI { 1073}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 175  and name HB1 ))
      4.400     2.400     1.600 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.76142E-03 ppm1      7.098 ppm2      0.791 CV     1
 OR { 1073}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 1074}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      4.800     2.900     1.200 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.10660E-03 ppm1      7.097 ppm2      4.495 CV     1
 OR { 1074}
   (( segid "    " and resid 174  and name HN  ))
   (( segid "    " and resid 170  and name HA  ))
 ASSI { 1088}
   (( segid "    " and resid 18   and name HD22))
   (( segid "    " and resid 18   and name HB2 ))
      3.700     1.700     1.700 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.24836E-02 ppm1      7.646 ppm2      2.767 CV     1
 OR { 1088}
   (( segid "    " and resid 118  and name HD22))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI { 1098}
   (( segid "    " and resid 118  and name HD21))
   (( segid "    " and resid 118  and name HB2 ))
      4.000     2.000     2.000 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.32865E-03 ppm1      6.969 ppm2      2.863 CV     1
 OR { 1098}
   (( segid "    " and resid 18   and name HD21))
   (( segid "    " and resid 18   and name HB1 ))
 ASSI { 1099}
   (( segid "    " and resid 18   and name HD21))
   (( segid "    " and resid 18   and name HB2 ))
      3.500     1.500     1.500 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.80014E-03 ppm1      6.970 ppm2      2.767 CV     1
 OR { 1099}
   (( segid "    " and resid 118  and name HD21))
   (( segid "    " and resid 118  and name HB1 ))
 ASSI { 1106}
   (( segid "    " and resid 65   and name HD21))
   (( segid "    " and resid 65   and name HB1 ))
      3.700     1.800     1.800 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.19355E-02 ppm1      7.432 ppm2      3.000 CV     1
 OR { 1106}
   (( segid "    " and resid 165  and name HD22))
   (( segid "    " and resid 165  and name HB1 ))
 ASSI { 1125}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 38   and name HN  ))
      4.100     2.100     1.900 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.13611E-02 ppm1      7.291 ppm2      8.471 CV     1
 OR { 1125}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 1126}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 40   and name HD22))
      6.000     4.400     0.000 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.53380E-04 ppm1      7.290 ppm2      7.404 CV     1
 OR { 1126}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 140  and name HD22))
 ASSI { 1129}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 38   and name HA  ))
      3.300     1.400     1.400 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.11289E-02 ppm1      7.291 ppm2      5.089 CV     1
 OR { 1129}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 138  and name HA  ))
 ASSI { 1130}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 38   and name HB1 ))
      2.400     0.700     0.700 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.11979E-01 ppm1      7.291 ppm2      2.435 CV     1
 OR { 1130}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 38   and name HB2 ))
 OR { 1130}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 138  and name HB1 ))
 OR { 1130}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 138  and name HB2 ))
 ASSI { 1131}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 36   and name HB1 ))
      6.000     5.600     0.000 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.24983E-04 ppm1      7.291 ppm2      1.814 CV     1
 OR { 1131}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 36   and name HB2 ))
 OR { 1131}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 136  and name HB1 ))
 OR { 1131}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 136  and name HB2 ))
 OR { 1131}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 39   and name HB  ))
 ASSI { 1132}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 36   and name HG2 ))
      3.600     1.600     1.600 peak  1132 spectrum    1 weight  0.10000E+01 volume  0.12419E-02 ppm1      7.291 ppm2      1.619 CV     1
 OR { 1132}
   (( segid "    " and resid 138  and name HD22))
   (( segid "    " and resid 36   and name HG1 ))
 OR { 1132}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 136  and name HG2 ))
 OR { 1132}
   (( segid "    " and resid 38   and name HD21))
   (( segid "    " and resid 136  and name HG1 ))
 ASSI { 1137}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 139  and name HN  ))
      5.900     4.400     0.100 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.54957E-04 ppm1      6.629 ppm2      9.199 CV     1
 OR { 1137}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 39   and name HN  ))
 ASSI { 1138}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 138  and name HN  ))
      4.400     2.400     1.600 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.84345E-03 ppm1      6.628 ppm2      8.472 CV     1
 OR { 1138}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 1139}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 140  and name HD22))
      4.600     2.600     1.400 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.25773E-03 ppm1      6.627 ppm2      7.405 CV     1
 OR { 1139}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 40   and name HD22))
 ASSI { 1142}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 140  and name HA  ))
      6.000     5.900     0.000 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.25505E-04 ppm1      6.627 ppm2      5.174 CV     1
 OR { 1142}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 1143}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 138  and name HA  ))
      3.700     1.800     1.800 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.56854E-03 ppm1      6.628 ppm2      5.089 CV     1
 OR { 1143}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 38   and name HA  ))
 ASSI { 1144}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 136  and name HA  ))
      4.600     2.600     1.400 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.31044E-03 ppm1      6.628 ppm2      4.598 CV     1
 OR { 1144}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 1146}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 136  and name HB1 ))
      4.400     2.400     1.600 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.29403E-03 ppm1      6.629 ppm2      1.816 CV     1
 OR { 1146}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 136  and name HB2 ))
 OR { 1146}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 36   and name HB1 ))
 OR { 1146}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 36   and name HB2 ))
 OR { 1146}
   (( segid "    " and resid 138  and name HD21))
   (( segid "    " and resid 139  and name HB  ))
 ASSI { 1148}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 170  and name HN  ))
      4.300     4.300     1.700 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.58844E-04 ppm1      7.801 ppm2      7.706 CV     1
 OR { 1148}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1149}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 166  and name HG2 ))
      6.000     5.500     0.000 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.25743E-04 ppm1      7.802 ppm2      2.568 CV     1
 OR { 1149}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI { 1150}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 171  and name HN  ))
      6.000     4.600     0.000 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.10101E-03 ppm1      7.799 ppm2      8.520 CV     1
 OR { 1150}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 71   and name HN  ))
 ASSI { 1153}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 70   and name HA  ))
      3.200     1.300     1.300 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.11218E-02 ppm1      7.800 ppm2      4.490 CV     1
 OR { 1153}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 170  and name HA  ))
 ASSI { 1154}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 167  and name HA  ))
      3.200     1.300     1.300 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.17885E-02 ppm1      7.800 ppm2      4.170 CV     1
 OR { 1154}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 67   and name HA  ))
 OR { 1154}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 166  and name HA  ))
 OR { 1154}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 1155}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 170  and name HB2 ))
      2.500     0.800     0.800 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.61070E-02 ppm1      7.800 ppm2      3.084 CV     1
 OR { 1155}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 70   and name HB2 ))
 OR { 1155}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 70   and name HB1 ))
 OR { 1155}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 170  and name HB1 ))
 ASSI { 1156}
   (( segid "    " and resid 170  and name HD21))
   (( segid "    " and resid 169  and name HB2 ))
      2.800     1.000     1.000 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.45388E-02 ppm1      7.800 ppm2      2.977 CV     1
 OR { 1156}
   (( segid "    " and resid 70   and name HD21))
   (( segid "    " and resid 69   and name HB2 ))
 ASSI { 1160}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 166  and name HG2 ))
      4.200     2.300     1.800 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.25141E-03 ppm1      7.097 ppm2      2.570 CV     1
 OR { 1160}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI { 1163}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 70   and name HA  ))
      4.400     2.400     1.600 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.80778E-03 ppm1      7.095 ppm2      4.491 CV     1
 OR { 1163}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 170  and name HA  ))
 ASSI { 1164}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 167  and name HA  ))
      3.500     1.500     1.500 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.14364E-02 ppm1      7.095 ppm2      4.168 CV     1
 OR { 1164}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 67   and name HA  ))
 OR { 1164}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 166  and name HA  ))
 OR { 1164}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 1165}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 170  and name HB2 ))
      3.300     1.300     1.300 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.44210E-02 ppm1      7.095 ppm2      3.084 CV     1
 OR { 1165}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 70   and name HB2 ))
 OR { 1165}
   (( segid "    " and resid 170  and name HD22))
   (( segid "    " and resid 170  and name HB1 ))
 OR { 1165}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI { 1177}
   (( segid "    " and resid 40   and name HD22))
   (( segid "    " and resid 40   and name HD21))
      1.600     0.300     0.600 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.25782E-01 ppm1      7.408 ppm2      6.705 CV     1
 OR { 1177}
   (( segid "    " and resid 140  and name HD22))
   (( segid "    " and resid 140  and name HD21))
 ASSI { 1178}
   (( segid "    " and resid 40   and name HD22))
   (( segid "    " and resid 40   and name HA  ))
      5.000     3.100     1.000 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.33672E-03 ppm1      7.408 ppm2      5.177 CV     1
 OR { 1178}
   (( segid "    " and resid 140  and name HD22))
   (( segid "    " and resid 140  and name HA  ))
 ASSI { 1180}
   (( segid "    " and resid 40   and name HD22))
   (( segid "    " and resid 40   and name HB1 ))
      3.500     1.500     1.500 peak  1180 spectrum    1 weight  0.10000E+01 volume  0.32383E-02 ppm1      7.408 ppm2      2.333 CV     1
 OR { 1180}
   (( segid "    " and resid 140  and name HD22))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1181}
   (( segid "    " and resid 140  and name HD22))
   (  segid "    " and resid 61   and name HG2%)
      3.600     1.600     1.600 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.97632E-03 ppm1      7.407 ppm2      1.265 CV     1
 OR { 1181}
   (( segid "    " and resid 40   and name HD22))
   (  segid "    " and resid 161  and name HG2%)
 ASSI { 1182}
   (( segid "    " and resid 40   and name HD22))
   (  segid "    " and resid 134  and name HG2%)
      2.200     2.200     3.800 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.23428E-02 ppm1      7.408 ppm2      0.723 CV     1
 OR { 1182}
   (( segid "    " and resid 140  and name HD22))
   (  segid "    " and resid 34   and name HG2%)
 ASSI { 1185}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 38   and name HD21))
      5.200     3.400     0.800 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.24623E-04 ppm1      6.704 ppm2      7.301 CV     1
 OR { 1185}
   (( segid "    " and resid 140  and name HD21))
   (( segid "    " and resid 138  and name HD22))
 OR { 1185}
   (( segid "    " and resid 40   and name HD21))
   (  segid "    " and resid 41   and name HD% )
 ASSI { 1187}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HA  ))
      5.300     3.500     0.700 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.10035E-03 ppm1      6.705 ppm2      5.175 CV     1
 OR { 1187}
   (( segid "    " and resid 140  and name HD21))
   (( segid "    " and resid 140  and name HA  ))
 ASSI { 1188}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HB2 ))
      2.600     0.900     0.900 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.32292E-02 ppm1      6.705 ppm2      2.587 CV     1
 OR { 1188}
   (( segid "    " and resid 140  and name HD21))
   (( segid "    " and resid 140  and name HB2 ))
 ASSI { 1189}
   (( segid "    " and resid 40   and name HD21))
   (( segid "    " and resid 40   and name HB1 ))
      2.800     1.000     1.000 peak  1189 spectrum    1 weight  0.10000E+01 volume  0.26840E-02 ppm1      6.704 ppm2      2.333 CV     1
 OR { 1189}
   (( segid "    " and resid 140  and name HD21))
   (( segid "    " and resid 140  and name HB1 ))
 ASSI { 1193}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 166  and name HN  ))
      3.600     1.600     1.600 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.38960E-03 ppm1      7.437 ppm2      7.796 CV     1
 OR { 1193}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 70   and name HD21))
 ASSI { 1196}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 166  and name HA  ))
      4.700     2.700     1.300 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.40766E-03 ppm1      7.437 ppm2      4.159 CV     1
 OR { 1196}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 1198}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 169  and name HB2 ))
      4.700     2.700     1.300 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.24903E-04 ppm1      7.437 ppm2      2.983 CV     1
 OR { 1198}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 69   and name HB2 ))
 OR { 1198}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 165  and name HB1 ))
 ASSI { 1199}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 166  and name HG2 ))
      2.500     0.800     0.800 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.55976E-02 ppm1      7.437 ppm2      2.573 CV     1
 OR { 1199}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 66   and name HG1 ))
 ASSI { 1201}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 166  and name HB1 ))
      4.400     2.500     1.600 peak  1201 spectrum    1 weight  0.10000E+01 volume  0.41054E-03 ppm1      7.438 ppm2      2.265 CV     1
 OR { 1201}
   (( segid "    " and resid 166  and name HE21))
   (( segid "    " and resid 166  and name HB2 ))
 OR { 1201}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 66   and name HB1 ))
 OR { 1201}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1202}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HN  ))
      4.600     2.600     1.400 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.97080E-04 ppm1      6.922 ppm2      7.797 CV     1
 OR { 1202}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 70   and name HD21))
 ASSI { 1205}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HA  ))
      5.100     3.300     0.900 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.24344E-03 ppm1      6.923 ppm2      4.157 CV     1
 OR { 1205}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HA  ))
 ASSI { 1208}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HG2 ))
      3.200     1.300     1.300 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.13249E-02 ppm1      6.923 ppm2      2.429 CV     1
 OR { 1208}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HG1 ))
 ASSI { 1209}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HB1 ))
      6.000     6.000     0.000 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.25875E-04 ppm1      6.923 ppm2      2.262 CV     1
 OR { 1209}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1209}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HB1 ))
 OR { 1209}
   (( segid "    " and resid 166  and name HE22))
   (( segid "    " and resid 166  and name HB2 ))
 ASSI { 1218}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HB1 ))
      6.000     4.500     0.000 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.14516E-03 ppm1      8.563 ppm2      1.766 CV     1
 OR { 1218}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 133  and name HB1 ))
 ASSI { 1225}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA2 ))
      2.400     0.700     0.700 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.53324E-02 ppm1      8.418 ppm2      3.963 CV     1
 OR { 1225}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HA1 ))
 ASSI { 1228}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HB2 ))
      4.300     2.300     1.700 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.54563E-03 ppm1      8.418 ppm2      3.031 CV     1
 OR { 1228}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB2 ))
 ASSI { 1272}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 158  and name HA  ))
      6.000     6.000     0.000 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.25093E-04 ppm1      7.904 ppm2      4.964 CV     1
 OR { 1272}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 1274}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
      2.800     1.000     1.000 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.24040E-02 ppm1      7.904 ppm2      4.236 CV     1
 OR { 1274}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
 ASSI { 1275}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      3.900     1.900     1.900 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.61616E-03 ppm1      7.905 ppm2      4.137 CV     1
 OR { 1275}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
 ASSI { 1276}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 57   and name HA1 ))
      2.200     0.600     0.600 peak  1276 spectrum    1 weight  0.10000E+01 volume  0.19636E-01 ppm1      7.904 ppm2      3.980 CV     1
 OR { 1276}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HA1 ))
 ASSI { 1277}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.800     1.800     1.800 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.87337E-03 ppm1      7.904 ppm2      2.262 CV     1
 OR { 1277}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
 ASSI { 1278}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      3.200     1.300     1.300 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.21856E-02 ppm1      7.905 ppm2      1.930 CV     1
 OR { 1278}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HB1 ))
 ASSI { 1279}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HG2 ))
      5.000     3.100     1.000 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.44789E-03 ppm1      7.906 ppm2      1.682 CV     1
 OR { 1279}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HG2 ))
 OR { 1279}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HG1 ))
 OR { 1279}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 56   and name HG1 ))
 ASSI { 1280}
   (( segid "    " and resid 157  and name HN  ))
   (  segid "    " and resid 154  and name HB% )
      2.800     2.800     3.200 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.61728E-03 ppm1      7.904 ppm2      1.540 CV     1
 OR { 1280}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 54   and name HB% )
 ASSI { 1281}
   (( segid "    " and resid 157  and name HN  ))
   (  segid "    " and resid 158  and name HG2%)
      3.700     1.700     1.700 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.10429E-02 ppm1      7.903 ppm2      1.177 CV     1
 OR { 1281}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 58   and name HG2%)
!
! unambiguous restraints - the dimer symmetry was maintained by NCS term of CNS
!
!
 ASSI {    7}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 49   and name HD% )
      5.400     3.600     0.600 peak     7 spectrum    1 weight  0.11000E+01 volume  0.15221E-03 ppm1      8.937 ppm2      6.958 CV     1
 ASSI {   14}
   (( segid "    " and resid 64   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      3.300     3.300     2.700 peak    14 spectrum    1 weight  0.11000E+01 volume  0.18214E-02 ppm1      8.936 ppm2      0.624 CV     1
 ASSI {   76}
   (( segid "    " and resid 46   and name HE1 ))
   (( segid "    " and resid 135  and name HG2 ))
      4.100     2.100     1.900 peak    76 spectrum    1 weight  0.11000E+01 volume  0.11101E-02 ppm1      7.699 ppm2      0.958 CV     1
 ASSI {   91}
   (( segid "    " and resid 71   and name HD1 ))
   (( segid "    " and resid 169  and name HB2 ))
      5.900     4.300     0.100 peak    91 spectrum    1 weight  0.11000E+01 volume  0.57969E-04 ppm1      7.398 ppm2      2.986 CV     1
 ASSI {  100}
   (( segid "    " and resid 71   and name HD1 ))
   (  segid "    " and resid 167  and name HD2%)
      2.800     2.800     3.200 peak   100 spectrum    1 weight  0.11000E+01 volume  0.82328E-02 ppm1      7.397 ppm2      0.570 CV     1
 ASSI {  102}
   (( segid "    " and resid 171  and name HD1 ))
   (  segid "    " and resid 63   and name HG1%)
      3.100     3.100     2.900 peak   102 spectrum    1 weight  0.11000E+01 volume  0.48494E-02 ppm1      7.397 ppm2     -0.194 CV     1
 ASSI {  113}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 40   and name HA  ))
      3.600     1.600     1.600 peak   113 spectrum    1 weight  0.11000E+01 volume  0.11359E-02 ppm1      7.325 ppm2      5.194 CV     1
 ASSI {  127}
   (  segid "    " and resid 41   and name HD% )
   (( segid "    " and resid 136  and name HA  ))
      4.900     3.000     1.100 peak   127 spectrum    1 weight  0.11000E+01 volume  0.20293E-03 ppm1      7.316 ppm2      4.589 CV     1
 ASSI {  146}
   (( segid "    " and resid 171  and name HZ2 ))
   (  segid "    " and resid 63   and name HG1%)
      2.800     1.000     1.000 peak   146 spectrum    1 weight  0.11000E+01 volume  0.36896E-02 ppm1      7.305 ppm2     -0.195 CV     1
 ASSI {  148}
   (( segid "    " and resid 71   and name HZ2 ))
   (( segid "    " and resid 156  and name HA  ))
      5.900     4.300     0.100 peak   148 spectrum    1 weight  0.11000E+01 volume  0.21213E-03 ppm1      7.302 ppm2      4.425 CV     1
 ASSI {  184}
   (( segid "    " and resid 71   and name HE3 ))
   (  segid "    " and resid 167  and name HD2%)
      3.100     1.200     1.200 peak   184 spectrum    1 weight  0.11000E+01 volume  0.13421E-02 ppm1      7.259 ppm2      0.568 CV     1
 ASSI {  200}
   (( segid "    " and resid 71   and name HZ3 ))
   (( segid "    " and resid 149  and name HZ  ))
      4.600     2.600     1.400 peak   200 spectrum    1 weight  0.11000E+01 volume  0.30416E-03 ppm1      7.129 ppm2      6.615 CV     1
 ASSI {  206}
   (( segid "    " and resid 71   and name HZ3 ))
   (  segid "    " and resid 158  and name HG2%)
      4.400     4.400     1.600 peak   206 spectrum    1 weight  0.11000E+01 volume  0.43682E-03 ppm1      7.129 ppm2      1.179 CV     1
 ASSI {  226}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 46   and name HB2 ))
      3.800     3.800     2.200 peak   226 spectrum    1 weight  0.11000E+01 volume  0.10900E-02 ppm1      6.958 ppm2      2.975 CV     1
 ASSI {  234}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HG2 ))
      3.600     3.600     2.400 peak   234 spectrum    1 weight  0.11000E+01 volume  0.18350E-02 ppm1      6.957 ppm2      1.417 CV     1
 OR {  234}
   (  segid "    " and resid 49   and name HD% )
   (( segid "    " and resid 45   and name HG1 ))
 ASSI {  242}
   (  segid "    " and resid 41   and name HE% )
   (( segid "    " and resid 41   and name HA  ))
      3.300     1.400     1.400 peak   242 spectrum    1 weight  0.11000E+01 volume  0.29996E-02 ppm1      6.951 ppm2      5.121 CV     1
 ASSI {  268}
   (( segid "    " and resid 41   and name HZ  ))
   (  segid "    " and resid 63   and name HG1%)
      6.000     6.000     0.000 peak   268 spectrum    1 weight  0.11000E+01 volume  0.50547E-04 ppm1      6.884 ppm2     -0.198 CV     1
 ASSI {  272}
   (( segid "    " and resid 71   and name HH2 ))
   (( segid "    " and resid 155  and name HB2 ))
      3.600     3.600     2.400 peak   272 spectrum    1 weight  0.11000E+01 volume  0.19136E-02 ppm1      6.802 ppm2      1.939 CV     1
 ASSI {  282}
   (( segid "    " and resid 71   and name HH2 ))
   (  segid "    " and resid 158  and name HG2%)
      2.700     2.700     3.300 peak   282 spectrum    1 weight  0.11000E+01 volume  0.43051E-02 ppm1      6.799 ppm2      1.183 CV     1
 ASSI {  285}
   (( segid "    " and resid 171  and name HH2 ))
   (  segid "    " and resid 63   and name HG1%)
      3.100     1.200     1.200 peak   285 spectrum    1 weight  0.11000E+01 volume  0.13555E-02 ppm1      6.799 ppm2     -0.194 CV     1
 ASSI {  341}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 48   and name HB2 ))
      4.300     4.300     1.700 peak   341 spectrum    1 weight  0.11000E+01 volume  0.73100E-03 ppm1      6.504 ppm2      1.926 CV     1
 OR {  341}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 48   and name HG1 ))
 ASSI {  342}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 45   and name HD1 ))
      3.300     3.300     2.700 peak   342 spectrum    1 weight  0.11000E+01 volume  0.21291E-02 ppm1      6.502 ppm2      1.822 CV     1
 OR {  342}
   (  segid "    " and resid 49   and name HE% )
   (( segid "    " and resid 45   and name HD2 ))
 ASSI {  361}
   (( segid "    " and resid 46   and name HD2 ))
   (( segid "    " and resid 41   and name HA  ))
      5.900     4.400     0.100 peak   361 spectrum    1 weight  0.11000E+01 volume  0.24024E-03 ppm1      6.321 ppm2      5.122 CV     1
 ASSI {   90}
   (  segid "    " and resid 49   and name HE% )
   (  segid "    " and resid 64   and name HG2%)
      2.100     2.100     3.900 peak    90 spectrum    1 weight  0.10000E+01 volume  0.68076E-02 ppm1      6.507 ppm2      1.139 CV     1
 ASSI {  135}
   (  segid "    " and resid 67   and name HD2%)
   (( segid "    " and resid 172  and name HN  ))
      5.900     4.300     0.100 peak   135 spectrum    1 weight  0.10000E+01 volume  0.72066E-04 ppm1      1.083 ppm2      9.461 CV     1
 ASSI {  199}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 64   and name HN  ))
      2.000     0.500     0.500 peak   199 spectrum    1 weight  0.10000E+01 volume  0.77803E-02 ppm1      1.142 ppm2      8.947 CV     1
 ASSI {  200}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 164  and name HN  ))
      2.300     2.300     3.700 peak   200 spectrum    1 weight  0.10000E+01 volume  0.28279E-02 ppm1      0.955 ppm2      8.949 CV     1
 ASSI {  202}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 164  and name HN  ))
      4.400     2.400     1.600 peak   202 spectrum    1 weight  0.10000E+01 volume  0.81521E-03 ppm1      0.473 ppm2      8.968 CV     1
 ASSI {  206}
   (  segid "    " and resid 39   and name HG1%)
   (( segid "    " and resid 164  and name HN  ))
      6.000     6.000     0.000 peak   206 spectrum    1 weight  0.10000E+01 volume  0.19888E-04 ppm1      0.777 ppm2      8.934 CV     1
 ASSI {  242}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 60   and name HN  ))
      3.300     3.300     2.700 peak   242 spectrum    1 weight  0.10000E+01 volume  0.24303E-02 ppm1      0.513 ppm2      8.750 CV     1
 ASSI {  327}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 53   and name HN  ))
      4.200     2.200     1.800 peak   327 spectrum    1 weight  0.10000E+01 volume  0.41309E-03 ppm1      1.182 ppm2      8.450 CV     1
 ASSI {  385}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 152  and name HN  ))
      3.100     3.100     2.900 peak   385 spectrum    1 weight  0.10000E+01 volume  0.15748E-02 ppm1      1.059 ppm2      8.272 CV     1
 ASSI {  390}
   (  segid "    " and resid 60   and name HD1%)
   (( segid "    " and resid 61   and name HN  ))
      3.800     1.800     1.800 peak   390 spectrum    1 weight  0.10000E+01 volume  0.82478E-03 ppm1      0.512 ppm2      8.284 CV     1
 ASSI {  391}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 161  and name HN  ))
      4.100     2.100     1.900 peak   391 spectrum    1 weight  0.10000E+01 volume  0.30381E-03 ppm1      0.472 ppm2      8.290 CV     1
 ASSI {  409}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 63   and name HN  ))
      3.600     1.600     1.600 peak   409 spectrum    1 weight  0.10000E+01 volume  0.92299E-03 ppm1      1.143 ppm2      8.255 CV     1
 ASSI {  413}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 63   and name HN  ))
      2.000     2.000     4.000 peak   413 spectrum    1 weight  0.10000E+01 volume  0.82387E-02 ppm1      0.836 ppm2      8.253 CV     1
 ASSI {  416}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 163  and name HN  ))
      2.500     0.800     0.800 peak   416 spectrum    1 weight  0.10000E+01 volume  0.21653E-02 ppm1     -0.196 ppm2      8.254 CV     1
 ASSI {  471}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 176  and name HN  ))
      3.000     3.000     3.000 peak   471 spectrum    1 weight  0.10000E+01 volume  0.23537E-02 ppm1      1.820 ppm2      7.958 CV     1
 ASSI {  499}
   (  segid "    " and resid 39   and name HG2%)
   (( segid "    " and resid 165  and name HN  ))
      4.200     2.200     1.800 peak   499 spectrum    1 weight  0.10000E+01 volume  0.49152E-03 ppm1      0.478 ppm2      7.915 CV     1
 ASSI {  548}
   (  segid "    " and resid 63   and name HG2%)
   (( segid "    " and resid 62   and name HN  ))
      4.200     2.200     1.800 peak   548 spectrum    1 weight  0.10000E+01 volume  0.50899E-03 ppm1      0.835 ppm2      7.663 CV     1
 ASSI {  609}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 140  and name HD22))
      3.100     3.100     2.900 peak   609 spectrum    1 weight  0.10000E+01 volume  0.15735E-02 ppm1      0.717 ppm2      7.403 CV     1
 ASSI {  627}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 71   and name HZ2 ))
      2.600     2.600     3.400 peak   627 spectrum    1 weight  0.10000E+01 volume  0.38558E-02 ppm1      0.835 ppm2      7.312 CV     1
 ASSI {  670}
   (  segid "    " and resid 72   and name HD2%)
   (  segid "    " and resid 149  and name HD% )
      2.300     2.300     3.700 peak   670 spectrum    1 weight  0.10000E+01 volume  0.97082E-02 ppm1      1.060 ppm2      6.971 CV     1
 ASSI {  707}
   (  segid "    " and resid 163  and name HG1%)
   (( segid "    " and resid 71   and name HH2 ))
      2.700     0.900     0.900 peak   707 spectrum    1 weight  0.10000E+01 volume  0.20016E-02 ppm1      0.835 ppm2      6.786 CV     1
 ASSI {  720}
   (  segid "    " and resid 34   and name HG2%)
   (( segid "    " and resid 140  and name HD21))
      3.300     3.300     2.700 peak   720 spectrum    1 weight  0.10000E+01 volume  0.94731E-03 ppm1      0.715 ppm2      6.714 CV     1
 ASSI {  728}
   (  segid "    " and resid 164  and name HG2%)
   (  segid "    " and resid 149  and name HE% )
      2.600     2.600     3.400 peak   728 spectrum    1 weight  0.10000E+01 volume  0.21618E-02 ppm1      0.954 ppm2      6.546 CV     1
 ASSI {  740}
   (  segid "    " and resid 72   and name HD2%)
   (  segid "    " and resid 149  and name HE% )
      3.400     3.400     2.600 peak   740 spectrum    1 weight  0.10000E+01 volume  0.11468E-02 ppm1      1.060 ppm2      6.495 CV     1
 ASSI {  785}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 149  and name HA  ))
      2.500     2.500     3.500 peak   785 spectrum    1 weight  0.10000E+01 volume  0.65674E-02 ppm1      1.059 ppm2      4.888 CV     1
 ASSI { 1010}
   (  segid "    " and resid 72   and name HD2%)
   (( segid "    " and resid 148  and name HA  ))
      3.600     1.600     1.600 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.11950E-02 ppm1      1.060 ppm2      4.171 CV     1
 ASSI { 1082}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 176  and name HA  ))
      3.300     3.300     2.700 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.61167E-03 ppm1      4.308 ppm2      3.915 CV     1
 ASSI { 1177}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 48   and name HD1 ))
      4.900     3.000     1.100 peak  1177 spectrum    1 weight  0.10000E+01 volume  0.77777E-04 ppm1      4.306 ppm2      3.352 CV     1
 ASSI { 1267}
   (  segid "    " and resid 163  and name HG2%)
   (( segid "    " and resid 160  and name HA  ))
      3.100     1.200     1.200 peak  1267 spectrum    1 weight  0.10000E+01 volume  0.65007E-03 ppm1     -0.198 ppm2      3.136 CV     1
 ASSI { 1275}
   (  segid "    " and resid 52   and name HB% )
   (( segid "    " and resid 49   and name HB2 ))
      4.000     2.000     2.000 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.35184E-03 ppm1      1.822 ppm2      3.087 CV     1
 ASSI { 1335}
   (  segid "    " and resid 37   and name HG1%)
   (( segid "    " and resid 141  and name HB2 ))
      4.000     2.000     2.000 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.64344E-03 ppm1      0.830 ppm2      2.810 CV     1
 ASSI { 1337}
   (  segid "    " and resid 37   and name HG2%)
   (( segid "    " and resid 141  and name HB2 ))
      2.700     2.700     3.300 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.36594E-02 ppm1      0.658 ppm2      2.813 CV     1
 ASSI { 1412}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 140  and name HB1 ))
      3.100     3.100     2.900 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.17713E-02 ppm1      1.267 ppm2      2.332 CV     1
 ASSI { 1531}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 143  and name HB2 ))
      6.000     5.200     0.000 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.20134E-04 ppm1      2.792 ppm2      2.075 CV     1
 OR { 1531}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 143  and name HB2 ))
 OR { 1531}
   (( segid "    " and resid 35   and name HE2 ))
   (( segid "    " and resid 143  and name HB1 ))
 OR { 1531}
   (( segid "    " and resid 35   and name HE1 ))
   (( segid "    " and resid 143  and name HB1 ))
 ASSI { 1561}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 145  and name HB2 ))
      5.200     3.400     0.800 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.87243E-04 ppm1      4.512 ppm2      2.043 CV     1
 OR { 1561}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 145  and name HB1 ))
 ASSI { 1849}
   (  segid "    " and resid 64   and name HG2%)
   (( segid "    " and resid 63   and name HB  ))
      2.900     1.000     1.000 peak  1849 spectrum    1 weight  0.10000E+01 volume  0.29697E-02 ppm1      1.140 ppm2      1.634 CV     1
 ASSI { 1852}
   (  segid "    " and resid 164  and name HG2%)
   (( segid "    " and resid 163  and name HB  ))
      3.500     1.600     1.600 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.90940E-03 ppm1      0.950 ppm2      1.651 CV     1
 ASSI { 1986}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 145  and name HG2 ))
      1.700     1.700     4.300 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.44627E-01 ppm1      1.688 ppm2      1.434 CV     1
 OR { 1986}
   (( segid "    " and resid 73   and name HG1 ))
   (( segid "    " and resid 145  and name HG1 ))
 ASSI { 2171}
   (( segid "    " and resid 161  and name HA  ))
   (  segid "    " and resid 164  and name HG2%)
      3.100     3.100     2.900 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.76097E-03 ppm1      3.847 ppm2      0.971 CV     1
 ASSI { 2346}
   (( segid "    " and resid 76   and name HG1 ))
   (  segid "    " and resid 72   and name HD1%)
      4.100     2.100     1.900 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.31555E-03 ppm1      2.310 ppm2      0.844 CV     1
 OR { 2346}
   (( segid "    " and resid 76   and name HG2 ))
   (  segid "    " and resid 72   and name HD1%)
 ASSI { 2388}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 63   and name HG2%)
      2.500     0.800     0.800 peak  2388 spectrum    1 weight  0.10000E+01 volume  0.23167E-02 ppm1      3.145 ppm2      0.826 CV     1
 ASSI { 2422}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 134  and name HG2%)
      3.700     3.700     2.300 peak  2422 spectrum    1 weight  0.10000E+01 volume  0.70557E-03 ppm1      2.842 ppm2      0.731 CV     1
 OR { 2422}
   (( segid "    " and resid 42   and name HB1 ))
   (  segid "    " and resid 134  and name HD1%)
 ASSI { 2423}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 134  and name HG2%)
      4.000     2.000     2.000 peak  2423 spectrum    1 weight  0.10000E+01 volume  0.42396E-03 ppm1      2.732 ppm2      0.721 CV     1
 OR { 2423}
   (( segid "    " and resid 42   and name HB2 ))
   (  segid "    " and resid 134  and name HD1%)
 ASSI { 2429}
   (( segid "    " and resid 36   and name HG2 ))
   (  segid "    " and resid 34   and name HG2%)
      2.700     2.700     3.300 peak  2429 spectrum    1 weight  0.10000E+01 volume  0.16629E-02 ppm1      1.624 ppm2      0.716 CV     1
 OR { 2429}
   (( segid "    " and resid 36   and name HG1 ))
   (  segid "    " and resid 34   and name HG2%)
 ASSI { 2480}
   (  segid "    " and resid 72   and name HD2%)
   (  segid "    " and resid 68   and name HG2%)
      3.200     3.200     2.800 peak  2480 spectrum    1 weight  0.10000E+01 volume  0.12685E-02 ppm1      1.065 ppm2      0.607 CV     1
 ASSI { 2492}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 167  and name HD2%)
      2.500     2.500     3.500 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.62547E-02 ppm1      1.589 ppm2      0.568 CV     1
 ASSI { 2541}
   (  segid "    " and resid 72   and name HD2%)
   (  segid "    " and resid 68   and name HG1%)
      2.800     2.800     3.200 peak  2541 spectrum    1 weight  0.10000E+01 volume  0.25005E-02 ppm1      1.059 ppm2      0.056 CV     1
 ASSI { 2554}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 63   and name HG1%)
      5.700     4.000     0.300 peak  2554 spectrum    1 weight  0.10000E+01 volume  0.58639E-04 ppm1      2.248 ppm2     -0.192 CV     1
 OR { 2554}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 63   and name HG1%)
 ASSI { 2555}
   (( segid "    " and resid 67   and name HG  ))
   (  segid "    " and resid 63   and name HG1%)
      3.000     3.000     3.000 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.16994E-02 ppm1      2.023 ppm2     -0.205 CV     1
 ASSI { 2559}
   (  segid "    " and resid 67   and name HD2%)
   (  segid "    " and resid 63   and name HG1%)
      2.300     2.300     3.700 peak  2559 spectrum    1 weight  0.10000E+01 volume  0.50089E-02 ppm1      1.079 ppm2     -0.209 CV     1
 ASSI { 2564}
   (  segid "    " and resid 67   and name HD1%)
   (  segid "    " and resid 63   and name HG1%)
      2.400     2.400     3.600 peak  2564 spectrum    1 weight  0.10000E+01 volume  0.69535E-02 ppm1      0.568 ppm2     -0.199 CV     1
 ASSI {   10}
   (( segid "    " and resid 71   and name HE1 ))
   (  segid "    " and resid 163  and name HG1%)
      3.300     3.300     2.700 peak    10 spectrum    1 weight  0.11000E+01 volume  0.24839E-02 ppm1     10.497 ppm2      0.821 CV     1
 ASSI {   11}
   (( segid "    " and resid 171  and name HE1 ))
   (  segid "    " and resid 63   and name HG1%)
      3.200     3.200     2.800 peak    11 spectrum    1 weight  0.11000E+01 volume  0.28784E-02 ppm1     10.496 ppm2     -0.207 CV     1
 ASSI {  134}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 134  and name HG2%)
      3.600     3.600     2.400 peak   134 spectrum    1 weight  0.11000E+01 volume  0.18730E-02 ppm1      8.817 ppm2      0.718 CV     1
 OR {  134}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 134  and name HD1%)
 ASSI {  150}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 34   and name HG2%)
      6.000     4.900     0.000 peak   150 spectrum    1 weight  0.11000E+01 volume  0.55935E-04 ppm1      8.458 ppm2      0.693 CV     1
 ASSI {  183}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HD2 ))
      4.200     2.200     1.800 peak   183 spectrum    1 weight  0.11000E+01 volume  0.56542E-04 ppm1      8.337 ppm2      1.799 CV     1
 OR {  183}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HD1 ))
 ASSI {  184}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      2.900     1.000     1.000 peak   184 spectrum    1 weight  0.11000E+01 volume  0.43432E-02 ppm1      8.336 ppm2      1.350 CV     1
 ASSI {  198}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      3.800     1.800     1.800 peak   198 spectrum    1 weight  0.11000E+01 volume  0.20028E-02 ppm1      8.393 ppm2      4.112 CV     1
 ASSI {  221}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 110  and name HG1%)
      4.200     2.200     1.800 peak   221 spectrum    1 weight  0.11000E+01 volume  0.55479E-04 ppm1      8.393 ppm2      0.927 CV     1
 OR {  221}
   (( segid "    " and resid 112  and name HN  ))
   (  segid "    " and resid 110  and name HG2%)
 ASSI {  226}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      2.300     0.700     0.700 peak   226 spectrum    1 weight  0.11000E+01 volume  0.13672E-01 ppm1      8.396 ppm2      1.757 CV     1
 OR {  226}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  256}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      4.900     3.000     1.100 peak   256 spectrum    1 weight  0.11000E+01 volume  0.15048E-03 ppm1      8.380 ppm2      8.518 CV     1
 ASSI {  301}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      1.900     0.500     0.500 peak   301 spectrum    1 weight  0.11000E+01 volume  0.21763E-01 ppm1      8.203 ppm2      4.330 CV     1
 ASSI {  302}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.700     0.900     0.900 peak   302 spectrum    1 weight  0.11000E+01 volume  0.35496E-02 ppm1      8.203 ppm2      4.099 CV     1
 ASSI {  303}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HB  ))
      2.300     0.700     0.700 peak   303 spectrum    1 weight  0.11000E+01 volume  0.79906E-02 ppm1      8.203 ppm2      2.039 CV     1
 ASSI {  304}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HG2 ))
      4.500     2.600     1.500 peak   304 spectrum    1 weight  0.11000E+01 volume  0.65069E-03 ppm1      8.203 ppm2      1.604 CV     1
 OR {  304}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HG1 ))
 ASSI {  305}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG2%)
      2.700     0.900     0.900 peak   305 spectrum    1 weight  0.11000E+01 volume  0.73564E-02 ppm1      8.203 ppm2      0.935 CV     1
 OR {  305}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HG1%)
 ASSI {  314}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      4.900     3.000     1.100 peak   314 spectrum    1 weight  0.11000E+01 volume  0.31329E-03 ppm1      8.420 ppm2      8.134 CV     1
 ASSI {  315}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HA  ))
      3.100     1.200     1.200 peak   315 spectrum    1 weight  0.11000E+01 volume  0.14722E-02 ppm1      8.420 ppm2      4.645 CV     1
 ASSI {  316}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 114  and name HG2%)
      6.000     6.000     0.000 peak   316 spectrum    1 weight  0.11000E+01 volume  0.17783E-04 ppm1      8.420 ppm2      1.129 CV     1
 ASSI {  318}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB  ))
      2.800     1.000     1.000 peak   318 spectrum    1 weight  0.11000E+01 volume  0.21660E-02 ppm1      8.416 ppm2      4.143 CV     1
 ASSI {  319}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB1 ))
      3.100     1.200     1.200 peak   319 spectrum    1 weight  0.11000E+01 volume  0.16969E-02 ppm1      8.414 ppm2      3.181 CV     1
 ASSI {  320}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HB2 ))
      3.300     1.400     1.400 peak   320 spectrum    1 weight  0.11000E+01 volume  0.30117E-02 ppm1      8.417 ppm2      3.017 CV     1
 ASSI {  322}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 115  and name HE% )
      6.000     5.300     0.000 peak   322 spectrum    1 weight  0.11000E+01 volume  0.54807E-04 ppm1      8.407 ppm2      7.269 CV     1
 ASSI {  323}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.100     0.500     0.500 peak   323 spectrum    1 weight  0.11000E+01 volume  0.10935E-01 ppm1      8.407 ppm2      4.312 CV     1
 ASSI {  328}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA  ))
      2.900     1.000     1.000 peak   328 spectrum    1 weight  0.11000E+01 volume  0.24924E-02 ppm1      8.243 ppm2      4.083 CV     1
 ASSI {  331}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      2.100     0.600     0.600 peak   331 spectrum    1 weight  0.11000E+01 volume  0.14090E-01 ppm1      8.241 ppm2      4.526 CV     1
 ASSI {  332}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HB  ))
      2.700     0.900     0.900 peak   332 spectrum    1 weight  0.11000E+01 volume  0.49208E-02 ppm1      8.241 ppm2      2.066 CV     1
 ASSI {  333}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 110  and name HG2%)
      2.700     0.900     0.900 peak   333 spectrum    1 weight  0.11000E+01 volume  0.48797E-02 ppm1      8.241 ppm2      0.936 CV     1
 OR {  333}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 110  and name HG1%)
 ASSI {  341}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      4.200     2.200     1.800 peak   341 spectrum    1 weight  0.11000E+01 volume  0.11228E-02 ppm1      8.242 ppm2      3.871 CV     1
 ASSI {  389}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      2.000     0.500     0.500 peak   389 spectrum    1 weight  0.11000E+01 volume  0.19441E-01 ppm1      8.153 ppm2      4.236 CV     1
 ASSI {  390}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.200     1.300     1.300 peak   390 spectrum    1 weight  0.11000E+01 volume  0.32002E-02 ppm1      8.152 ppm2      2.033 CV     1
 ASSI {  391}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB2 ))
      2.300     0.700     0.700 peak   391 spectrum    1 weight  0.11000E+01 volume  0.93063E-02 ppm1      8.154 ppm2      1.779 CV     1
 OR {  391}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HB1 ))
 ASSI {  392}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HG1 ))
      3.200     1.300     1.300 peak   392 spectrum    1 weight  0.11000E+01 volume  0.28967E-02 ppm1      8.153 ppm2      1.600 CV     1
 OR {  392}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HG2 ))
 ASSI {  520}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG1 ))
      4.100     2.100     1.900 peak   520 spectrum    1 weight  0.11000E+01 volume  0.85661E-03 ppm1      8.305 ppm2      2.248 CV     1
 OR {  520}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI {  521}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      3.300     1.400     1.400 peak   521 spectrum    1 weight  0.11000E+01 volume  0.12563E-02 ppm1      8.304 ppm2      8.593 CV     1
 ASSI {  524}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      2.900     1.100     1.100 peak   524 spectrum    1 weight  0.11000E+01 volume  0.24298E-02 ppm1      8.303 ppm2      4.261 CV     1
 ASSI {  525}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA1 ))
      2.500     2.500     3.500 peak   525 spectrum    1 weight  0.11000E+01 volume  0.74383E-02 ppm1      8.304 ppm2      3.885 CV     1
 ASSI {  526}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.800     1.000     1.000 peak   526 spectrum    1 weight  0.11000E+01 volume  0.38934E-02 ppm1      8.304 ppm2      1.939 CV     1
 OR {  526}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HB1 ))
 ASSI {  559}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      2.800     1.000     1.000 peak   559 spectrum    1 weight  0.11000E+01 volume  0.14454E-02 ppm1      8.575 ppm2      7.787 CV     1
 ASSI {  560}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB1 ))
      2.400     0.700     0.700 peak   560 spectrum    1 weight  0.11000E+01 volume  0.39392E-02 ppm1      8.575 ppm2      2.249 CV     1
 OR {  560}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI {  561}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HG  ))
      1.400     0.300     0.800 peak   561 spectrum    1 weight  0.11000E+01 volume  0.91542E-02 ppm1      8.574 ppm2      2.008 CV     1
 ASSI {  572}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      6.000     6.000     0.000 peak   572 spectrum    1 weight  0.11000E+01 volume  0.35939E-04 ppm1      8.576 ppm2      3.382 CV     1
 ASSI {  573}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HD2%)
      2.700     2.700     3.300 peak   573 spectrum    1 weight  0.11000E+01 volume  0.37742E-02 ppm1      8.574 ppm2      1.072 CV     1
 ASSI {  574}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 67   and name HD1%)
      3.200     1.300     1.300 peak   574 spectrum    1 weight  0.11000E+01 volume  0.55077E-02 ppm1      8.574 ppm2      0.564 CV     1
 ASSI {  826}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      3.000     1.100     1.100 peak   826 spectrum    1 weight  0.11000E+01 volume  0.14328E-02 ppm1      8.274 ppm2      8.727 CV     1
 ASSI {  828}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      2.500     0.800     0.800 peak   828 spectrum    1 weight  0.11000E+01 volume  0.26396E-02 ppm1      8.272 ppm2      7.655 CV     1
 ASSI {  829}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      2.400     0.700     0.700 peak   829 spectrum    1 weight  0.11000E+01 volume  0.80866E-02 ppm1      8.272 ppm2      4.076 CV     1
 ASSI {  830}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.500     0.800     0.800 peak   830 spectrum    1 weight  0.11000E+01 volume  0.45960E-02 ppm1      8.272 ppm2      3.833 CV     1
 ASSI {  831}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HB  ))
      3.200     1.300     1.300 peak   831 spectrum    1 weight  0.11000E+01 volume  0.42590E-02 ppm1      8.273 ppm2      1.631 CV     1
 ASSI {  833}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      5.300     3.500     0.700 peak   833 spectrum    1 weight  0.11000E+01 volume  0.62403E-04 ppm1      8.271 ppm2      3.136 CV     1
 ASSI {  836}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      2.500     0.800     0.800 peak   836 spectrum    1 weight  0.11000E+01 volume  0.46589E-02 ppm1      8.273 ppm2      0.620 CV     1
 ASSI {  882}
   (( segid "    " and resid 18   and name HD22))
   (( segid "    " and resid 18   and name HD21))
      2.500     0.800     0.800 peak   882 spectrum    1 weight  0.11000E+01 volume  0.19665E-02 ppm1      7.642 ppm2      6.964 CV     1
 ASSI {  921}
   (( segid "    " and resid 48   and name HE  ))
   (( segid "    " and resid 48   and name HN  ))
      6.000     6.000     0.000 peak   921 spectrum    1 weight  0.11000E+01 volume  0.17467E-04 ppm1      7.465 ppm2      8.000 CV     1
 ASSI {  962}
   (( segid "    " and resid 70   and name HD22))
   (  segid "    " and resid 67   and name HD2%)
      4.500     4.500     1.500 peak   962 spectrum    1 weight  0.11000E+01 volume  0.46181E-03 ppm1      7.091 ppm2      1.068 CV     1
 ASSI {   10}
   (( segid "    " and resid 71   and name HE1 ))
   (  segid "    " and resid 167  and name HD2%)
      5.300     3.600     0.700 peak    10 spectrum    1 weight  0.10000E+01 volume  0.10796E-03 ppm1     10.500 ppm2      0.565 CV     1
 ASSI {   95}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HG1 ))
      4.400     2.400     1.600 peak    95 spectrum    1 weight  0.10000E+01 volume  0.72401E-03 ppm1      8.462 ppm2      1.208 CV     1
 ASSI {  149}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 60   and name HG2%)
      6.000     5.400     0.000 peak   149 spectrum    1 weight  0.10000E+01 volume  0.53195E-04 ppm1      7.657 ppm2      0.625 CV     1
 ASSI {  177}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 161  and name HB  ))
      4.800     2.900     1.200 peak   177 spectrum    1 weight  0.10000E+01 volume  0.39912E-03 ppm1      7.722 ppm2      4.086 CV     1
 ASSI {  179}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 161  and name HA  ))
      5.700     4.100     0.300 peak   179 spectrum    1 weight  0.10000E+01 volume  0.16124E-03 ppm1      7.722 ppm2      3.839 CV     1
 ASSI {  458}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 172  and name HD2%)
      3.800     3.800     2.200 peak   458 spectrum    1 weight  0.10000E+01 volume  0.86727E-03 ppm1      8.274 ppm2      1.055 CV     1
 ASSI {  722}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 63   and name HG1%)
      4.200     2.200     1.800 peak   722 spectrum    1 weight  0.10000E+01 volume  0.71799E-03 ppm1      7.793 ppm2     -0.198 CV     1
 ASSI {  754}
   (( segid "    " and resid 67   and name HN  ))
   (  segid "    " and resid 63   and name HG1%)
      3.700     3.700     2.300 peak   754 spectrum    1 weight  0.10000E+01 volume  0.12257E-02 ppm1      8.583 ppm2     -0.198 CV     1
 ASSI {  868}
   (( segid "    " and resid 73   and name HN  ))
   (  segid "    " and resid 72   and name HD1%)
      3.800     1.800     1.800 peak   868 spectrum    1 weight  0.10000E+01 volume  0.11542E-02 ppm1      7.463 ppm2      0.872 CV     1
 ASSI {  937}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 139  and name HG2%)
      4.900     3.100     1.100 peak   937 spectrum    1 weight  0.10000E+01 volume  0.34979E-03 ppm1      7.917 ppm2      0.473 CV     1
 ASSI {  938}
   (( segid "    " and resid 75   and name HD21))
   (( segid "    " and resid 71   and name HE1 ))
      3.600     1.600     1.600 peak   938 spectrum    1 weight  0.10000E+01 volume  0.62805E-03 ppm1      6.713 ppm2     10.504 CV     1
 ASSI { 1103}
   (( segid "    " and resid 65   and name HD21))
   (  segid "    " and resid 141  and name HE% )
      2.200     2.200     3.800 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.11672E-01 ppm1      7.432 ppm2      6.965 CV     1
 ASSI { 1104}
   (( segid "    " and resid 65   and name HD21))
   (( segid "    " and resid 62   and name HA  ))
      4.500     2.600     1.500 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.18137E-03 ppm1      7.433 ppm2      4.427 CV     1
 ASSI { 1108}
   (( segid "    " and resid 65   and name HD21))
   (  segid "    " and resid 61   and name HG2%)
      2.700     2.700     3.300 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.25027E-02 ppm1      7.432 ppm2      1.265 CV     1
 ASSI { 1109}
   (( segid "    " and resid 65   and name HD21))
   (  segid "    " and resid 139  and name HG2%)
      3.500     3.500     2.500 peak  1109 spectrum    1 weight  0.10000E+01 volume  0.18963E-02 ppm1      7.431 ppm2      0.471 CV     1
 ASSI { 1116}
   (( segid "    " and resid 118  and name HD21))
   (( segid "    " and resid 116  and name HA2 ))
      5.700     4.100     0.300 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.26087E-04 ppm1      6.964 ppm2      3.847 CV     1
 ASSI { 1136}
   (( segid "    " and resid 38   and name HD22))
   (( segid "    " and resid 137  and name HA  ))
      4.000     2.000     2.000 peak  1136 spectrum    1 weight  0.10000E+01 volume  0.25274E-03 ppm1      6.637 ppm2      4.157 CV     1
 ASSI { 1167}
   (( segid "    " and resid 70   and name HD22))
   (( segid "    " and resid 66   and name HG2 ))
      4.800     2.800     1.200 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.94372E-04 ppm1      7.096 ppm2      2.429 CV     1
 ASSI { 1197}
   (( segid "    " and resid 66   and name HE22))
   (( segid "    " and resid 63   and name HA  ))
      5.800     4.200     0.200 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.52455E-04 ppm1      7.437 ppm2      3.518 CV     1
 ASSI { 1206}
   (( segid "    " and resid 66   and name HE21))
   (( segid "    " and resid 63   and name HA  ))
      6.000     5.700     0.000 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.24643E-04 ppm1      6.923 ppm2      3.516 CV     1
! restraints for symmetric betta-structure interface

assign (resid  35 and name N) (resid  141 and name O) 3.2 1.0 0.0 
assign (resid  35 and name HN) (resid  141 and name O) 2.2 1.0 0.0 

assign (resid  135 and name N) (resid  41 and name O) 3.2 1.0 0.0 
assign (resid  135 and name HN) (resid  41 and name O) 2.2 1.0 0.0 

assign (resid  37 and name N) (resid  139 and name O) 3.2 1.0 0.0 
assign (resid  37 and name HN) (resid  139 and name O) 2.2 1.0 0.0 

assign (resid  137 and name N) (resid  39 and name O) 3.2 1.0 0.0 
assign (resid  137 and name HN) (resid  39 and name O) 2.2 1.0 0.0 





! dihedral angle file generated by Csi2Aria.py

! CSI derived hbond restraint:
assign (resid  47 and name N) (resid  43 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  47 and name HN) (resid  43 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  48 and name N) (resid  44 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  48 and name HN) (resid  44 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  49 and name N) (resid  45 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  49 and name HN) (resid  45 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  50 and name N) (resid  46 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  50 and name HN) (resid  46 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  51 and name N) (resid  47 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  51 and name HN) (resid  47 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  52 and name N) (resid  48 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  52 and name HN) (resid  48 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  53 and name N) (resid  49 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  53 and name HN) (resid  49 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  54 and name N) (resid  50 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  54 and name HN) (resid  50 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  55 and name N) (resid  51 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  55 and name HN) (resid  51 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  65 and name N) (resid  61 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  65 and name HN) (resid  61 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  66 and name N) (resid  62 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  66 and name HN) (resid  62 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  67 and name N) (resid  63 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  67 and name HN) (resid  63 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  68 and name N) (resid  64 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  68 and name HN) (resid  64 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  69 and name N) (resid  65 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  69 and name HN) (resid  65 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  70 and name N) (resid  66 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  70 and name HN) (resid  66 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  71 and name N) (resid  67 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  71 and name HN) (resid  67 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  72 and name N) (resid  68 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  72 and name HN) (resid  68 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  73 and name N) (resid  69 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  73 and name HN) (resid  69 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  74 and name N) (resid  70 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid  74 and name HN) (resid  70 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 148 and name N) (resid 144 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 148 and name HN) (resid 144 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 149 and name N) (resid 145 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 149 and name HN) (resid 145 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 150 and name N) (resid 146 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 150 and name HN) (resid 146 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 151 and name N) (resid 147 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 151 and name HN) (resid 147 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 152 and name N) (resid 148 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 152 and name HN) (resid 148 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 153 and name N) (resid 149 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 153 and name HN) (resid 149 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 154 and name N) (resid 150 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 154 and name HN) (resid 150 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 155 and name N) (resid 151 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 155 and name HN) (resid 151 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 165 and name N) (resid 161 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 165 and name HN) (resid 161 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 166 and name N) (resid 162 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 166 and name HN) (resid 162 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 167 and name N) (resid 163 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 167 and name HN) (resid 163 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 168 and name N) (resid 164 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 168 and name HN) (resid 164 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 169 and name N) (resid 165 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 169 and name HN) (resid 165 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 170 and name N) (resid 166 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 170 and name HN) (resid 166 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 171 and name N) (resid 167 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 171 and name HN) (resid 167 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 172 and name N) (resid 168 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 172 and name HN) (resid 168 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 173 and name N) (resid 169 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 173 and name HN) (resid 169 and name O) 2.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 174 and name N) (resid 170 and name O) 3.2 1.0 0.0 

! CSI derived hbond restraint:
assign (resid 174 and name HN) (resid 170 and name O) 2.2 1.0 0.0 

! CSI restraints, converted by ARIA
! Phi:

! dihedral angle file generated by Csi2Aria.py

! CSI derived phi restraint:
assign (resid  33 and name C)
       (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  34 and name C)
       (resid  35 and name N)
       (resid  35 and name CA)
       (resid  35 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  35 and name C)
       (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  36 and name C)
       (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  37 and name C)
       (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  38 and name C)
       (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  39 and name C)
       (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  40 and name C)
       (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid  42 and name C)
       (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  43 and name C)
       (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  44 and name C)
       (resid  45 and name N)
       (resid  45 and name CA)
       (resid  45 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  45 and name C)
       (resid  46 and name N)
       (resid  46 and name CA)
       (resid  46 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  46 and name C)
       (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  47 and name C)
       (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  48 and name C)
       (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  49 and name C)
       (resid  50 and name N)
       (resid  50 and name CA)
       (resid  50 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  50 and name C)
       (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  51 and name C)
       (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  52 and name C)
       (resid  53 and name N)
       (resid  53 and name CA)
       (resid  53 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  53 and name C)
       (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  54 and name C)
       (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  59 and name C)
       (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  60 and name C)
       (resid  61 and name N)
       (resid  61 and name CA)
       (resid  61 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  62 and name C)
       (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  63 and name C)
       (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  64 and name C)
       (resid  65 and name N)
       (resid  65 and name CA)
       (resid  65 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  65 and name C)
       (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  66 and name C)
       (resid  67 and name N)
       (resid  67 and name CA)
       (resid  67 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  67 and name C)
       (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  68 and name C)
       (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  69 and name C)
       (resid  70 and name N)
       (resid  70 and name CA)
       (resid  70 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  70 and name C)
       (resid  71 and name N)
       (resid  71 and name CA)
       (resid  71 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  71 and name C)
       (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  72 and name C)
       (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid  73 and name C)
       (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 133 and name C)
       (resid 134 and name N)
       (resid 134 and name CA)
       (resid 134 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 134 and name C)
       (resid 135 and name N)
       (resid 135 and name CA)
       (resid 135 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 135 and name C)
       (resid 136 and name N)
       (resid 136 and name CA)
       (resid 136 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 136 and name C)
       (resid 137 and name N)
       (resid 137 and name CA)
       (resid 137 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 137 and name C)
       (resid 138 and name N)
       (resid 138 and name CA)
       (resid 138 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 138 and name C)
       (resid 139 and name N)
       (resid 139 and name CA)
       (resid 139 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 139 and name C)
       (resid 140 and name N)
       (resid 140 and name CA)
       (resid 140 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 140 and name C)
       (resid 141 and name N)
       (resid 141 and name CA)
       (resid 141 and name C)
       1.0 -135  30 2

! CSI derived phi restraint:
assign (resid 142 and name C)
       (resid 143 and name N)
       (resid 143 and name CA)
       (resid 143 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 143 and name C)
       (resid 144 and name N)
       (resid 144 and name CA)
       (resid 144 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 144 and name C)
       (resid 145 and name N)
       (resid 145 and name CA)
       (resid 145 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 145 and name C)
       (resid 146 and name N)
       (resid 146 and name CA)
       (resid 146 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 146 and name C)
       (resid 147 and name N)
       (resid 147 and name CA)
       (resid 147 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 147 and name C)
       (resid 148 and name N)
       (resid 148 and name CA)
       (resid 148 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 148 and name C)
       (resid 149 and name N)
       (resid 149 and name CA)
       (resid 149 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 149 and name C)
       (resid 150 and name N)
       (resid 150 and name CA)
       (resid 150 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 150 and name C)
       (resid 151 and name N)
       (resid 151 and name CA)
       (resid 151 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 151 and name C)
       (resid 152 and name N)
       (resid 152 and name CA)
       (resid 152 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 152 and name C)
       (resid 153 and name N)
       (resid 153 and name CA)
       (resid 153 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 153 and name C)
       (resid 154 and name N)
       (resid 154 and name CA)
       (resid 154 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 154 and name C)
       (resid 155 and name N)
       (resid 155 and name CA)
       (resid 155 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 159 and name C)
       (resid 160 and name N)
       (resid 160 and name CA)
       (resid 160 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 160 and name C)
       (resid 161 and name N)
       (resid 161 and name CA)
       (resid 161 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 161 and name C)
       (resid 162 and name N)
       (resid 162 and name CA)
       (resid 162 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 162 and name C)
       (resid 163 and name N)
       (resid 163 and name CA)
       (resid 163 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 163 and name C)
       (resid 164 and name N)
       (resid 164 and name CA)
       (resid 164 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 164 and name C)
       (resid 165 and name N)
       (resid 165 and name CA)
       (resid 165 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 165 and name C)
       (resid 166 and name N)
       (resid 166 and name CA)
       (resid 166 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 166 and name C)
       (resid 167 and name N)
       (resid 167 and name CA)
       (resid 167 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 167 and name C)
       (resid 168 and name N)
       (resid 168 and name CA)
       (resid 168 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 168 and name C)
       (resid 169 and name N)
       (resid 169 and name CA)
       (resid 169 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 169 and name C)
       (resid 170 and name N)
       (resid 170 and name CA)
       (resid 170 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 170 and name C)
       (resid 171 and name N)
       (resid 171 and name CA)
       (resid 171 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 171 and name C)
       (resid 172 and name N)
       (resid 172 and name CA)
       (resid 172 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 172 and name C)
       (resid 173 and name N)
       (resid 173 and name CA)
       (resid 173 and name C)
       1.0 -65  30 2

! CSI derived phi restraint:
assign (resid 173 and name C)
       (resid 174 and name N)
       (resid 174 and name CA)
       (resid 174 and name C)
       1.0 -65  30 2



! Psi:

! dihedral angle file generated by Csi2Aria.py

! CSI derived psi restraint:
assign (resid  34 and name N)
       (resid  34 and name CA)
       (resid  34 and name C)
       (resid  35 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  35 and name N)
       (resid  35 and name CA)
       (resid  35 and name C)
       (resid  36 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  36 and name N)
       (resid  36 and name CA)
       (resid  36 and name C)
       (resid  37 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       (resid  38 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       (resid  39 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       (resid  40 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       (resid  41 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       (resid  42 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       (resid  44 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       (resid  45 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  45 and name N)
       (resid  45 and name CA)
       (resid  45 and name C)
       (resid  46 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  46 and name N)
       (resid  46 and name CA)
       (resid  46 and name C)
       (resid  47 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
       (resid  48 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       (resid  49 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  49 and name N)
       (resid  49 and name CA)
       (resid  49 and name C)
       (resid  50 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  50 and name N)
       (resid  50 and name CA)
       (resid  50 and name C)
       (resid  51 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       (resid  52 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       (resid  53 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  53 and name N)
       (resid  53 and name CA)
       (resid  53 and name C)
       (resid  54 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       (resid  55 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  55 and name N)
       (resid  55 and name CA)
       (resid  55 and name C)
       (resid  56 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
       (resid  61 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  61 and name N)
       (resid  61 and name CA)
       (resid  61 and name C)
       (resid  62 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       (resid  64 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  64 and name N)
       (resid  64 and name CA)
       (resid  64 and name C)
       (resid  65 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  65 and name N)
       (resid  65 and name CA)
       (resid  65 and name C)
       (resid  66 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  66 and name N)
       (resid  66 and name CA)
       (resid  66 and name C)
       (resid  67 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  67 and name N)
       (resid  67 and name CA)
       (resid  67 and name C)
       (resid  68 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  68 and name N)
       (resid  68 and name CA)
       (resid  68 and name C)
       (resid  69 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  69 and name N)
       (resid  69 and name CA)
       (resid  69 and name C)
       (resid  70 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  70 and name N)
       (resid  70 and name CA)
       (resid  70 and name C)
       (resid  71 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  71 and name N)
       (resid  71 and name CA)
       (resid  71 and name C)
       (resid  72 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       (resid  73 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       (resid  74 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       (resid  75 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 134 and name N)
       (resid 134 and name CA)
       (resid 134 and name C)
       (resid 135 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 135 and name N)
       (resid 135 and name CA)
       (resid 135 and name C)
       (resid 136 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 136 and name N)
       (resid 136 and name CA)
       (resid 136 and name C)
       (resid 137 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 137 and name N)
       (resid 137 and name CA)
       (resid 137 and name C)
       (resid 138 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 138 and name N)
       (resid 138 and name CA)
       (resid 138 and name C)
       (resid 139 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 139 and name N)
       (resid 139 and name CA)
       (resid 139 and name C)
       (resid 140 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 140 and name N)
       (resid 140 and name CA)
       (resid 140 and name C)
       (resid 141 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 141 and name N)
       (resid 141 and name CA)
       (resid 141 and name C)
       (resid 142 and name N)
       1.0 135  30 2

! CSI derived psi restraint:
assign (resid 143 and name N)
       (resid 143 and name CA)
       (resid 143 and name C)
       (resid 144 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 144 and name N)
       (resid 144 and name CA)
       (resid 144 and name C)
       (resid 145 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 145 and name N)
       (resid 145 and name CA)
       (resid 145 and name C)
       (resid 146 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 146 and name N)
       (resid 146 and name CA)
       (resid 146 and name C)
       (resid 147 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 147 and name N)
       (resid 147 and name CA)
       (resid 147 and name C)
       (resid 148 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 148 and name N)
       (resid 148 and name CA)
       (resid 148 and name C)
       (resid 149 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 149 and name N)
       (resid 149 and name CA)
       (resid 149 and name C)
       (resid 150 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 150 and name N)
       (resid 150 and name CA)
       (resid 150 and name C)
       (resid 151 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 151 and name N)
       (resid 151 and name CA)
       (resid 151 and name C)
       (resid 152 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 152 and name N)
       (resid 152 and name CA)
       (resid 152 and name C)
       (resid 153 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 153 and name N)
       (resid 153 and name CA)
       (resid 153 and name C)
       (resid 154 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 154 and name N)
       (resid 154 and name CA)
       (resid 154 and name C)
       (resid 155 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 155 and name N)
       (resid 155 and name CA)
       (resid 155 and name C)
       (resid 156 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 160 and name N)
       (resid 160 and name CA)
       (resid 160 and name C)
       (resid 161 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 161 and name N)
       (resid 161 and name CA)
       (resid 161 and name C)
       (resid 162 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 162 and name N)
       (resid 162 and name CA)
       (resid 162 and name C)
       (resid 163 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 163 and name N)
       (resid 163 and name CA)
       (resid 163 and name C)
       (resid 164 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 164 and name N)
       (resid 164 and name CA)
       (resid 164 and name C)
       (resid 165 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 165 and name N)
       (resid 165 and name CA)
       (resid 165 and name C)
       (resid 166 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 166 and name N)
       (resid 166 and name CA)
       (resid 166 and name C)
       (resid 167 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 167 and name N)
       (resid 167 and name CA)
       (resid 167 and name C)
       (resid 168 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 168 and name N)
       (resid 168 and name CA)
       (resid 168 and name C)
       (resid 169 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 169 and name N)
       (resid 169 and name CA)
       (resid 169 and name C)
       (resid 170 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 170 and name N)
       (resid 170 and name CA)
       (resid 170 and name C)
       (resid 171 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 171 and name N)
       (resid 171 and name CA)
       (resid 171 and name C)
       (resid 172 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 172 and name N)
       (resid 172 and name CA)
       (resid 172 and name C)
       (resid 173 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 173 and name N)
       (resid 173 and name CA)
       (resid 173 and name C)
       (resid 174 and name N)
       1.0 -35  30 2

! CSI derived psi restraint:
assign (resid 174 and name N)
       (resid 174 and name CA)
       (resid 174 and name C)
       (resid 175 and name N)
       1.0 -35  30 2


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1 -35.377  51.303 -13.133
    2   2H    MET   1          2H        MET   1 -35.905  50.934 -11.570
    3   3H    MET   1          3H        MET   1 -36.173  52.477 -12.210
    4    HA   MET   1           HA       MET   1 -38.225  51.338 -12.322
    5   1HB   MET   1          1HB       MET   1 -37.369  52.681 -14.310
    6   2HB   MET   1          2HB       MET   1 -36.981  51.143 -15.068
    7   1HG   MET   1          1HG       MET   1 -39.736  51.528 -14.041
    8   2HG   MET   1          2HG       MET   1 -39.265  52.392 -15.503
    9   1HE   MET   1          1HE       MET   1 -40.863  51.375 -17.097
   10   2HE   MET   1          2HE       MET   1 -41.684  50.432 -15.853
   11   3HE   MET   1          3HE       MET   1 -41.151  49.652 -17.342
   12    H    SER   2           H        SER   2 -39.459  49.547 -13.379
   13    HA   SER   2           HA       SER   2 -38.808  47.071 -12.479
   14   1HB   SER   2          1HB       SER   2 -40.659  46.360 -13.589
   15   2HB   SER   2          2HB       SER   2 -40.877  48.077 -13.932
   16    HG   SER   2           HG       SER   2 -40.080  47.789 -15.939
   17    H    LEU   3           H        LEU   3 -37.800  48.565 -15.497
   18    HA   LEU   3           HA       LEU   3 -36.602  46.313 -16.675
   19   1HB   LEU   3          1HB       LEU   3 -35.159  48.102 -17.831
   20   2HB   LEU   3          2HB       LEU   3 -36.887  48.113 -18.126
   21    HG   LEU   3           HG       LEU   3 -36.727  49.818 -16.018
   22   1HD1  LEU   3          1HD1      LEU   3 -34.081  49.493 -16.714
   23   2HD1  LEU   3          2HD1      LEU   3 -34.762  50.842 -15.804
   24   3HD1  LEU   3          3HD1      LEU   3 -34.547  50.975 -17.550
   25   1HD2  LEU   3          1HD2      LEU   3 -37.554  49.912 -18.589
   26   2HD2  LEU   3          2HD2      LEU   3 -36.225  51.070 -18.629
   27   3HD2  LEU   3          3HD2      LEU   3 -37.557  51.296 -17.496
   28    H    GLU   4           H        GLU   4 -35.236  48.958 -14.731
   29    HA   GLU   4           HA       GLU   4 -32.636  48.009 -14.548
   30   1HB   GLU   4          1HB       GLU   4 -32.969  50.173 -13.705
   31   2HB   GLU   4          2HB       GLU   4 -34.339  49.679 -12.721
   32   1HG   GLU   4          1HG       GLU   4 -32.246  50.233 -11.466
   33   2HG   GLU   4          2HG       GLU   4 -32.943  48.651 -11.119
   34    H    LYS   5           H        LYS   5 -35.492  47.307 -12.620
   35    HA   LYS   5           HA       LYS   5 -34.350  45.636 -10.714
   36   1HB   LYS   5          1HB       LYS   5 -37.039  45.090 -11.942
   37   2HB   LYS   5          2HB       LYS   5 -36.524  44.847 -10.278
   38   1HG   LYS   5          1HG       LYS   5 -36.661  47.583 -11.479
   39   2HG   LYS   5          2HG       LYS   5 -38.085  46.803 -10.787
   40   1HD   LYS   5          1HD       LYS   5 -37.310  47.919  -8.948
   41   2HD   LYS   5          2HD       LYS   5 -36.447  46.391  -8.762
   42   1HE   LYS   5          1HE       LYS   5 -35.148  48.622  -8.526
   43   2HE   LYS   5          2HE       LYS   5 -34.431  47.297  -9.443
   44   1HZ   LYS   5          1HZ       LYS   5 -36.080  49.200 -10.914
   45   2HZ   LYS   5          2HZ       LYS   5 -34.676  48.389 -11.391
   46   3HZ   LYS   5          3HZ       LYS   5 -34.567  49.742 -10.384
   47    H    ALA   6           H        ALA   6 -35.563  44.990 -13.959
   48    HA   ALA   6           HA       ALA   6 -35.275  42.236 -14.035
   49   1HB   ALA   6          1HB       ALA   6 -35.896  42.538 -16.156
   50   2HB   ALA   6          2HB       ALA   6 -34.397  43.395 -16.518
   51   3HB   ALA   6          3HB       ALA   6 -35.790  44.278 -15.891
   52    H    HIS   7           H        HIS   7 -32.948  44.783 -14.825
   53    HA   HIS   7           HA       HIS   7 -30.811  42.790 -14.625
   54   1HB   HIS   7          1HB       HIS   7 -29.373  44.491 -15.722
   55   2HB   HIS   7          2HB       HIS   7 -30.745  44.012 -16.713
   56    HD1  HIS   7           HD1      HIS   7 -29.299  46.916 -14.887
   57    HD2  HIS   7           HD2      HIS   7 -32.645  46.013 -17.171
   58    HE1  HIS   7           HE1      HIS   7 -30.334  49.132 -15.465
   59    HE2  HIS   7           HE2      HIS   7 -32.318  48.562 -16.910
   60    H    THR   8           H        THR   8 -31.989  43.463 -12.282
   61    HA   THR   8           HA       THR   8 -30.971  45.659 -10.899
   62    HB   THR   8           HB       THR   8 -32.741  44.089 -10.042
   63    HG1  THR   8           HG1      THR   8 -30.530  44.580  -8.309
   64   1HG2  THR   8          1HG2      THR   8 -32.240  42.015  -9.139
   65   2HG2  THR   8          2HG2      THR   8 -30.525  42.390  -8.966
   66   3HG2  THR   8          3HG2      THR   8 -31.198  42.057 -10.561
   67    H    SER   9           H        SER   9 -29.597  42.716 -11.928
   68    HA   SER   9           HA       SER   9 -27.211  42.867 -10.307
   69   1HB   SER   9          1HB       SER   9 -26.484  41.022 -11.932
   70   2HB   SER   9          2HB       SER   9 -27.888  40.663 -10.923
   71    HG   SER   9           HG       SER   9 -28.503  40.116 -12.944
   72    H    VAL  10           H        VAL  10 -28.099  45.068 -12.023
   73    HA   VAL  10           HA       VAL  10 -26.944  45.496 -14.395
   74    HB   VAL  10           HB       VAL  10 -28.170  47.280 -13.572
   75   1HG1  VAL  10          1HG1      VAL  10 -26.709  48.227 -11.302
   76   2HG1  VAL  10          2HG1      VAL  10 -27.117  46.525 -11.079
   77   3HG1  VAL  10          3HG1      VAL  10 -28.390  47.700 -11.409
   78   1HG2  VAL  10          1HG2      VAL  10 -26.860  48.867 -14.396
   79   2HG2  VAL  10          2HG2      VAL  10 -25.494  47.756 -14.277
   80   3HG2  VAL  10          3HG2      VAL  10 -25.860  48.853 -12.943
   81    H    LYS  11           H        LYS  11 -25.230  46.697 -11.522
   82    HA   LYS  11           HA       LYS  11 -22.763  47.041 -12.637
   83   1HB   LYS  11          1HB       LYS  11 -22.219  45.967 -10.096
   84   2HB   LYS  11          2HB       LYS  11 -22.373  47.664 -10.523
   85   1HG   LYS  11          1HG       LYS  11 -23.836  47.406  -8.744
   86   2HG   LYS  11          2HG       LYS  11 -24.890  47.324 -10.156
   87   1HD   LYS  11          1HD       LYS  11 -24.483  44.766  -9.983
   88   2HD   LYS  11          2HD       LYS  11 -24.000  45.134  -8.326
   89   1HE   LYS  11          1HE       LYS  11 -26.155  46.179  -7.911
   90   2HE   LYS  11          2HE       LYS  11 -26.637  45.883  -9.582
   91   1HZ   LYS  11          1HZ       LYS  11 -26.005  43.783  -7.581
   92   2HZ   LYS  11          2HZ       LYS  11 -26.501  43.514  -9.175
   93   3HZ   LYS  11          3HZ       LYS  11 -27.560  44.235  -8.071
   94    H    LYS  12           H        LYS  12 -24.178  44.163 -11.301
   95    HA   LYS  12           HA       LYS  12 -23.588  42.153 -12.808
   96   1HB   LYS  12          1HB       LYS  12 -21.409  41.334 -12.687
   97   2HB   LYS  12          2HB       LYS  12 -21.142  43.062 -12.823
   98   1HG   LYS  12          1HG       LYS  12 -21.071  41.460 -10.274
   99   2HG   LYS  12          2HG       LYS  12 -19.672  42.047 -11.171
  100   1HD   LYS  12          1HD       LYS  12 -21.661  44.089 -10.431
  101   2HD   LYS  12          2HD       LYS  12 -20.791  43.345  -9.088
  102   1HE   LYS  12          1HE       LYS  12 -18.815  44.260  -9.682
  103   2HE   LYS  12          2HE       LYS  12 -19.163  44.161 -11.408
  104   1HZ   LYS  12          1HZ       LYS  12 -20.139  46.182 -11.419
  105   2HZ   LYS  12          2HZ       LYS  12 -19.126  46.439 -10.089
  106   3HZ   LYS  12          3HZ       LYS  12 -20.749  46.038  -9.848
  107    H    MET  13           H        MET  13 -24.396  43.427 -10.062
  108    HA   MET  13           HA       MET  13 -25.111  42.749  -8.027
  109   1HB   MET  13          1HB       MET  13 -26.427  40.862  -7.994
  110   2HB   MET  13          2HB       MET  13 -26.303  41.127  -9.723
  111   1HG   MET  13          1HG       MET  13 -24.172  39.439  -8.720
  112   2HG   MET  13          2HG       MET  13 -25.774  38.787  -8.372
  113   1HE   MET  13          1HE       MET  13 -26.445  36.810 -11.126
  114   2HE   MET  13          2HE       MET  13 -25.990  36.979  -9.430
  115   3HE   MET  13          3HE       MET  13 -24.769  36.568 -10.634
  116    H    THR  14           H        THR  14 -22.242  42.376  -8.979
  117    HA   THR  14           HA       THR  14 -20.263  41.519  -8.261
  118    HB   THR  14           HB       THR  14 -20.368  41.307  -5.571
  119    HG1  THR  14           HG1      THR  14 -22.237  43.362  -6.072
  120   1HG2  THR  14          1HG2      THR  14 -20.367  44.101  -6.300
  121   2HG2  THR  14          2HG2      THR  14 -19.459  43.141  -7.467
  122   3HG2  THR  14          3HG2      THR  14 -19.033  43.084  -5.757
  123    H    PHE  15           H        PHE  15 -22.396  39.663  -8.920
  124    HA   PHE  15           HA       PHE  15 -22.941  37.461  -7.552
  125   1HB   PHE  15          1HB       PHE  15 -22.614  36.158  -9.612
  126   2HB   PHE  15          2HB       PHE  15 -23.309  37.732  -9.991
  127    HD1  PHE  15           HD1      PHE  15 -20.693  35.449 -10.709
  128    HD2  PHE  15           HD2      PHE  15 -21.650  39.588 -10.681
  129    HE1  PHE  15           HE1      PHE  15 -18.820  35.894 -12.238
  130    HE2  PHE  15           HE2      PHE  15 -19.791  40.040 -12.215
  131    HZ   PHE  15           HZ       PHE  15 -18.368  38.191 -12.993
  132    H    GLY  16           H        GLY  16 -19.846  38.257  -8.885
  133   1HA   GLY  16          1HA       GLY  16 -18.214  37.221  -6.931
  134   2HA   GLY  16          2HA       GLY  16 -18.445  35.934  -8.119
  135    H    GLU  17           H        GLU  17 -18.680  39.242  -9.026
  136    HA   GLU  17           HA       GLU  17 -16.870  39.063 -11.123
  137   1HB   GLU  17          1HB       GLU  17 -18.664  40.912 -10.410
  138   2HB   GLU  17          2HB       GLU  17 -17.217  41.701  -9.792
  139   1HG   GLU  17          1HG       GLU  17 -18.063  41.192 -12.570
  140   2HG   GLU  17          2HG       GLU  17 -17.188  42.559 -11.875
  141    H    ASN  18           H        ASN  18 -16.477  40.454  -7.901
  142    HA   ASN  18           HA       ASN  18 -13.711  41.018  -8.200
  143   1HB   ASN  18          1HB       ASN  18 -13.743  41.558  -5.902
  144   2HB   ASN  18          2HB       ASN  18 -15.372  41.952  -6.455
  145   1HD2  ASN  18          1HD2      ASN  18 -16.714  39.723  -6.504
  146   2HD2  ASN  18          2HD2      ASN  18 -16.746  38.939  -4.965
  147    H    ARG  19           H        ARG  19 -15.569  38.229  -7.719
  148    HA   ARG  19           HA       ARG  19 -13.413  36.691  -6.524
  149   1HB   ARG  19          1HB       ARG  19 -16.103  35.684  -7.440
  150   2HB   ARG  19          2HB       ARG  19 -14.983  34.892  -6.340
  151   1HG   ARG  19          1HG       ARG  19 -16.193  37.548  -5.687
  152   2HG   ARG  19          2HG       ARG  19 -17.038  36.037  -5.353
  153   1HD   ARG  19          1HD       ARG  19 -15.889  36.625  -3.369
  154   2HD   ARG  19          2HD       ARG  19 -14.987  35.298  -4.100
  155    HE   ARG  19           HE       ARG  19 -14.159  38.100  -3.956
  156   1HH1  ARG  19          1HH1      ARG  19 -13.484  34.824  -4.923
  157   2HH1  ARG  19          2HH1      ARG  19 -11.783  35.092  -5.101
  158   1HH2  ARG  19          1HH2      ARG  19 -11.932  38.467  -4.207
  159   2HH2  ARG  19          2HH2      ARG  19 -10.901  37.164  -4.692
  160    H    ASP  20           H        ASP  20 -14.447  37.605  -9.558
  161    HA   ASP  20           HA       ASP  20 -14.100  35.339 -11.112
  162   1HB   ASP  20          1HB       ASP  20 -14.871  37.065 -12.401
  163   2HB   ASP  20          2HB       ASP  20 -13.849  38.259 -11.603
  164    H    LEU  21           H        LEU  21 -11.753  37.474  -9.633
  165    HA   LEU  21           HA       LEU  21  -9.431  36.923 -10.966
  166   1HB   LEU  21          1HB       LEU  21  -8.440  36.844  -8.508
  167   2HB   LEU  21          2HB       LEU  21  -9.025  38.335  -9.220
  168    HG   LEU  21           HG       LEU  21 -11.211  37.952  -8.064
  169   1HD1  LEU  21          1HD1      LEU  21 -10.646  36.355  -5.959
  170   2HD1  LEU  21          2HD1      LEU  21  -9.800  35.509  -7.254
  171   3HD1  LEU  21          3HD1      LEU  21 -11.528  35.835  -7.394
  172   1HD2  LEU  21          1HD2      LEU  21  -9.565  38.022  -5.742
  173   2HD2  LEU  21          2HD2      LEU  21 -10.389  39.350  -6.560
  174   3HD2  LEU  21          3HD2      LEU  21  -8.757  38.892  -7.044
  175    H    GLU  22           H        GLU  22 -11.383  34.887  -9.060
  176    HA   GLU  22           HA       GLU  22 -11.351  32.711  -8.522
  177   1HB   GLU  22          1HB       GLU  22 -10.043  32.865 -11.183
  178   2HB   GLU  22          2HB       GLU  22  -9.967  31.331 -10.323
  179   1HG   GLU  22          1HG       GLU  22 -12.329  32.785 -11.401
  180   2HG   GLU  22          2HG       GLU  22 -11.881  31.086 -11.565
  181    H    ARG  23           H        ARG  23 -10.058  33.368  -6.653
  182    HA   ARG  23           HA       ARG  23  -7.261  33.005  -6.587
  183   1HB   ARG  23          1HB       ARG  23  -8.436  32.234  -4.082
  184   2HB   ARG  23          2HB       ARG  23  -7.500  33.672  -4.463
  185   1HG   ARG  23          1HG       ARG  23  -9.436  34.629  -3.754
  186   2HG   ARG  23          2HG       ARG  23  -9.783  34.483  -5.478
  187   1HD   ARG  23          1HD       ARG  23 -10.508  32.262  -3.621
  188   2HD   ARG  23          2HD       ARG  23 -11.535  33.692  -3.721
  189    HE   ARG  23           HE       ARG  23 -11.835  33.194  -6.082
  190   1HH1  ARG  23          1HH1      ARG  23 -10.528  30.675  -4.065
  191   2HH1  ARG  23          2HH1      ARG  23 -10.988  29.398  -5.142
  192   1HH2  ARG  23          1HH2      ARG  23 -12.440  31.530  -7.504
  193   2HH2  ARG  23          2HH2      ARG  23 -12.085  29.885  -7.096
  194    H    VAL  24           H        VAL  24  -9.747  30.934  -7.211
  195    HA   VAL  24           HA       VAL  24  -9.108  28.543  -5.952
  196    HB   VAL  24           HB       VAL  24 -10.970  29.313  -7.819
  197   1HG1  VAL  24          1HG1      VAL  24  -9.404  27.147  -9.183
  198   2HG1  VAL  24          2HG1      VAL  24  -9.169  28.851  -9.569
  199   3HG1  VAL  24          3HG1      VAL  24 -10.748  28.101  -9.811
  200   1HG2  VAL  24          1HG2      VAL  24 -10.714  26.419  -7.591
  201   2HG2  VAL  24          2HG2      VAL  24 -12.011  27.494  -7.063
  202   3HG2  VAL  24          3HG2      VAL  24 -10.584  27.267  -6.049
  203    H    VAL  25           H        VAL  25  -7.413  30.400  -8.182
  204    HA   VAL  25           HA       VAL  25  -5.971  28.683  -9.761
  205    HB   VAL  25           HB       VAL  25  -4.025  30.309  -9.356
  206   1HG1  VAL  25          1HG1      VAL  25  -6.581  30.689 -10.654
  207   2HG1  VAL  25          2HG1      VAL  25  -4.959  31.082 -11.222
  208   3HG1  VAL  25          3HG1      VAL  25  -5.840  32.226 -10.209
  209   1HG2  VAL  25          1HG2      VAL  25  -5.872  32.246  -8.165
  210   2HG2  VAL  25          2HG2      VAL  25  -4.171  31.941  -7.818
  211   3HG2  VAL  25          3HG2      VAL  25  -5.415  30.927  -7.088
  212    H    THR  26           H        THR  26  -6.020  29.123  -6.384
  213    HA   THR  26           HA       THR  26  -3.571  27.950  -5.641
  214    HB   THR  26           HB       THR  26  -6.186  27.869  -4.117
  215    HG1  THR  26           HG1      THR  26  -4.979  29.794  -3.096
  216   1HG2  THR  26          1HG2      THR  26  -4.115  26.465  -3.429
  217   2HG2  THR  26          2HG2      THR  26  -4.946  27.423  -2.204
  218   3HG2  THR  26          3HG2      THR  26  -3.445  28.014  -2.917
  219    H    ALA  27           H        ALA  27  -3.526  26.215  -7.235
  220    HA   ALA  27           HA       ALA  27  -5.336  24.189  -7.547
  221   1HB   ALA  27          1HB       ALA  27  -3.481  22.765  -8.213
  222   2HB   ALA  27          2HB       ALA  27  -2.335  23.854  -7.432
  223   3HB   ALA  27          3HB       ALA  27  -3.243  24.395  -8.843
  224    HA   PRO  28           HA       PRO  28  -5.930  21.900  -3.849
  225   1HB   PRO  28          1HB       PRO  28  -4.621  19.491  -4.723
  226   2HB   PRO  28          2HB       PRO  28  -6.350  19.797  -4.558
  227   1HG   PRO  28          1HG       PRO  28  -4.653  19.879  -6.960
  228   2HG   PRO  28          2HG       PRO  28  -6.410  19.686  -6.828
  229   1HD   PRO  28          1HD       PRO  28  -5.263  21.950  -7.760
  230   2HD   PRO  28          2HD       PRO  28  -6.783  21.967  -6.837
  231    H    VAL  29           H        VAL  29  -2.815  21.894  -5.432
  232    HA   VAL  29           HA       VAL  29  -0.700  22.182  -4.640
  233    HB   VAL  29           HB       VAL  29  -2.010  22.375  -1.919
  234   1HG1  VAL  29          1HG1      VAL  29   0.409  23.575  -1.669
  235   2HG1  VAL  29          2HG1      VAL  29   0.799  22.248  -2.760
  236   3HG1  VAL  29          3HG1      VAL  29   0.066  21.913  -1.192
  237   1HG2  VAL  29          1HG2      VAL  29  -1.084  24.814  -2.314
  238   2HG2  VAL  29          2HG2      VAL  29  -2.659  24.319  -2.935
  239   3HG2  VAL  29          3HG2      VAL  29  -1.259  24.357  -4.008
  240    H    SER  30           H        SER  30  -2.618  20.211  -2.404
  241    HA   SER  30           HA       SER  30  -0.620  18.274  -1.927
  242   1HB   SER  30          1HB       SER  30  -2.531  16.899  -1.098
  243   2HB   SER  30          2HB       SER  30  -2.532  18.526  -0.416
  244    HG   SER  30           HG       SER  30  -4.001  18.997  -2.286
  245    H    SER  31           H        SER  31  -2.293  19.166  -4.586
  246    HA   SER  31           HA       SER  31  -3.179  16.978  -5.937
  247   1HB   SER  31          1HB       SER  31  -2.087  18.337  -7.965
  248   2HB   SER  31          2HB       SER  31  -3.527  18.908  -7.122
  249    HG   SER  31           HG       SER  31  -2.414  20.584  -6.546
  250    H    GLY  32           H        GLY  32  -2.312  15.201  -6.744
  251   1HA   GLY  32          1HA       GLY  32  -0.777  13.607  -7.316
  252   2HA   GLY  32          2HA       GLY  32   0.113  14.935  -8.038
  253    H    LYS  33           H        LYS  33  -0.202  15.518  -4.750
  254    HA   LYS  33           HA       LYS  33   2.550  15.206  -4.267
  255   1HB   LYS  33          1HB       LYS  33   0.194  15.576  -2.430
  256   2HB   LYS  33          2HB       LYS  33   1.836  15.419  -1.816
  257   1HG   LYS  33          1HG       LYS  33   0.997  17.493  -3.824
  258   2HG   LYS  33          2HG       LYS  33   1.026  17.763  -2.081
  259   1HD   LYS  33          1HD       LYS  33   3.432  17.191  -2.070
  260   2HD   LYS  33          2HD       LYS  33   3.373  17.037  -3.828
  261   1HE   LYS  33          1HE       LYS  33   2.698  19.531  -2.277
  262   2HE   LYS  33          2HE       LYS  33   4.233  19.227  -3.089
  263   1HZ   LYS  33          1HZ       LYS  33   3.369  19.800  -5.038
  264   2HZ   LYS  33          2HZ       LYS  33   2.041  20.414  -4.190
  265   3HZ   LYS  33          3HZ       LYS  33   1.989  18.845  -4.818
  266    H    ILE  34           H        ILE  34   0.113  12.934  -4.472
  267    HA   ILE  34           HA       ILE  34   1.760  10.943  -3.065
  268    HB   ILE  34           HB       ILE  34  -1.253  11.131  -3.153
  269   1HG1  ILE  34          1HG1      ILE  34  -0.295  10.701  -0.549
  270   2HG1  ILE  34          2HG1      ILE  34   0.784  11.901  -1.254
  271   1HG2  ILE  34          1HG2      ILE  34  -1.402   8.935  -2.891
  272   2HG2  ILE  34          2HG2      ILE  34  -0.341   9.013  -1.485
  273   3HG2  ILE  34          3HG2      ILE  34   0.345   8.800  -3.096
  274   1HD1  ILE  34          1HD1      ILE  34  -0.786  13.298  -0.442
  275   2HD1  ILE  34          2HD1      ILE  34  -2.073  12.097  -0.547
  276   3HD1  ILE  34          3HD1      ILE  34  -1.545  12.954  -1.996
  277    H    LYS  35           H        LYS  35   2.665   9.694  -4.559
  278    HA   LYS  35           HA       LYS  35   1.074   8.948  -6.924
  279   1HB   LYS  35          1HB       LYS  35   4.005   8.668  -7.087
  280   2HB   LYS  35          2HB       LYS  35   2.863   9.264  -8.282
  281   1HG   LYS  35          1HG       LYS  35   2.791  11.267  -6.459
  282   2HG   LYS  35          2HG       LYS  35   4.463  10.722  -6.305
  283   1HD   LYS  35          1HD       LYS  35   4.592  12.328  -7.979
  284   2HD   LYS  35          2HD       LYS  35   4.485  10.819  -8.889
  285   1HE   LYS  35          1HE       LYS  35   2.110  11.167  -9.235
  286   2HE   LYS  35          2HE       LYS  35   2.156  12.626  -8.247
  287   1HZ   LYS  35          1HZ       LYS  35   3.209  13.807  -9.875
  288   2HZ   LYS  35          2HZ       LYS  35   2.284  12.765 -10.832
  289   3HZ   LYS  35          3HZ       LYS  35   3.925  12.446 -10.580
  290    H    ARG  36           H        ARG  36   0.787   6.841  -7.364
  291    HA   ARG  36           HA       ARG  36   1.732   4.890  -5.446
  292   1HB   ARG  36          1HB       ARG  36  -0.037   4.653  -7.886
  293   2HB   ARG  36          2HB       ARG  36   0.379   3.296  -6.848
  294   1HG   ARG  36          1HG       ARG  36  -1.579   3.844  -5.877
  295   2HG   ARG  36          2HG       ARG  36  -0.550   4.973  -4.991
  296   1HD   ARG  36          1HD       ARG  36  -2.590   6.042  -5.859
  297   2HD   ARG  36          2HD       ARG  36  -1.120   6.750  -6.527
  298    HE   ARG  36           HE       ARG  36  -2.027   4.735  -8.255
  299   1HH1  ARG  36          1HH1      ARG  36  -2.921   7.909  -7.139
  300   2HH1  ARG  36          2HH1      ARG  36  -3.758   8.327  -8.596
  301   1HH2  ARG  36          1HH2      ARG  36  -3.125   5.274 -10.177
  302   2HH2  ARG  36          2HH2      ARG  36  -3.872   6.829 -10.325
  303    H    VAL  37           H        VAL  37   2.581   2.722  -6.409
  304    HA   VAL  37           HA       VAL  37   4.196   3.158  -8.788
  305    HB   VAL  37           HB       VAL  37   5.440   3.845  -6.596
  306   1HG1  VAL  37          1HG1      VAL  37   6.814   1.912  -5.749
  307   2HG1  VAL  37          2HG1      VAL  37   5.655   0.846  -6.540
  308   3HG1  VAL  37          3HG1      VAL  37   5.122   1.925  -5.252
  309   1HG2  VAL  37          1HG2      VAL  37   6.290   3.540  -9.000
  310   2HG2  VAL  37          2HG2      VAL  37   6.937   2.004  -8.425
  311   3HG2  VAL  37          3HG2      VAL  37   7.469   3.515  -7.688
  312    H    ASN  38           H        ASN  38   3.126   0.883  -6.286
  313    HA   ASN  38           HA       ASN  38   2.757  -1.370  -6.338
  314   1HB   ASN  38          1HB       ASN  38   1.213  -0.807  -8.141
  315   2HB   ASN  38          2HB       ASN  38   2.529  -0.845  -9.310
  316   1HD2  ASN  38          1HD2      ASN  38   0.352  -2.708  -7.385
  317   2HD2  ASN  38          2HD2      ASN  38   0.715  -4.245  -8.085
  318    H    VAL  39           H        VAL  39   4.560  -2.412  -5.678
  319    HA   VAL  39           HA       VAL  39   6.654  -2.916  -7.690
  320    HB   VAL  39           HB       VAL  39   7.270  -3.306  -4.816
  321   1HG1  VAL  39          1HG1      VAL  39   9.413  -2.235  -5.614
  322   2HG1  VAL  39          2HG1      VAL  39   8.731  -2.286  -7.239
  323   3HG1  VAL  39          3HG1      VAL  39   9.004  -3.784  -6.349
  324   1HG2  VAL  39          1HG2      VAL  39   7.565  -1.030  -4.305
  325   2HG2  VAL  39          2HG2      VAL  39   5.960  -1.133  -5.029
  326   3HG2  VAL  39          3HG2      VAL  39   7.319  -0.536  -5.981
  327    H    ASN  40           H        ASN  40   7.987  -4.903  -7.156
  328    HA   ASN  40           HA       ASN  40   6.191  -7.147  -6.506
  329   1HB   ASN  40          1HB       ASN  40   7.806  -6.639  -8.810
  330   2HB   ASN  40          2HB       ASN  40   8.466  -8.040  -7.972
  331   1HD2  ASN  40          1HD2      ASN  40   6.679  -7.377 -10.455
  332   2HD2  ASN  40          2HD2      ASN  40   5.485  -8.624 -10.387
  333    H    PHE  41           H        PHE  41   6.711  -8.234  -4.708
  334    HA   PHE  41           HA       PHE  41   9.489  -8.065  -3.745
  335   1HB   PHE  41          1HB       PHE  41   6.928  -8.373  -2.168
  336   2HB   PHE  41          2HB       PHE  41   8.542  -8.457  -1.471
  337    HD1  PHE  41           HD1      PHE  41   9.798  -6.231  -3.099
  338    HD2  PHE  41           HD2      PHE  41   6.089  -6.506  -1.032
  339    HE1  PHE  41           HE1      PHE  41   9.789  -3.791  -2.799
  340    HE2  PHE  41           HE2      PHE  41   6.074  -4.065  -0.730
  341    HZ   PHE  41           HZ       PHE  41   7.924  -2.703  -1.615
  342    H    ASP  42           H        ASP  42  10.601  -9.875  -3.378
  343    HA   ASP  42           HA       ASP  42   9.720 -12.347  -4.387
  344   1HB   ASP  42          1HB       ASP  42  12.071 -11.864  -4.333
  345   2HB   ASP  42          2HB       ASP  42  12.037 -11.613  -2.591
  346    H    GLU  43           H        GLU  43   9.410 -14.360  -3.210
  347    HA   GLU  43           HA       GLU  43   7.478 -14.238  -1.228
  348   1HB   GLU  43          1HB       GLU  43   8.880 -16.274  -2.631
  349   2HB   GLU  43          2HB       GLU  43   8.950 -16.673  -0.921
  350   1HG   GLU  43          1HG       GLU  43   6.387 -15.977  -2.316
  351   2HG   GLU  43          2HG       GLU  43   7.013 -17.622  -2.229
  352    H    GLU  44           H        GLU  44  10.971 -14.592  -0.944
  353    HA   GLU  44           HA       GLU  44  11.034 -14.987   1.861
  354   1HB   GLU  44          1HB       GLU  44  12.903 -15.642   0.460
  355   2HB   GLU  44          2HB       GLU  44  13.139 -13.980  -0.059
  356   1HG   GLU  44          1HG       GLU  44  14.682 -13.894   1.539
  357   2HG   GLU  44          2HG       GLU  44  13.322 -13.755   2.653
  358    H    LYS  45           H        LYS  45  11.159 -12.136  -0.198
  359    HA   LYS  45           HA       LYS  45  11.814 -10.308   1.885
  360   1HB   LYS  45          1HB       LYS  45  10.660  -9.921  -0.876
  361   2HB   LYS  45          2HB       LYS  45  11.040  -8.583   0.200
  362   1HG   LYS  45          1HG       LYS  45  13.235 -10.482  -0.158
  363   2HG   LYS  45          2HG       LYS  45  12.737  -9.656  -1.637
  364   1HD   LYS  45          1HD       LYS  45  12.785  -7.662   0.303
  365   2HD   LYS  45          2HD       LYS  45  14.211  -8.644   0.639
  366   1HE   LYS  45          1HE       LYS  45  13.487  -7.410  -2.017
  367   2HE   LYS  45          2HE       LYS  45  14.729  -6.830  -0.910
  368   1HZ   LYS  45          1HZ       LYS  45  15.823  -8.088  -2.553
  369   2HZ   LYS  45          2HZ       LYS  45  14.712  -9.359  -2.453
  370   3HZ   LYS  45          3HZ       LYS  45  15.789  -9.076  -1.180
  371    H    HIS  46           H        HIS  46   8.834 -11.636   0.654
  372    HA   HIS  46           HA       HIS  46   7.172  -9.674   1.958
  373   1HB   HIS  46          1HB       HIS  46   6.695 -11.152  -0.184
  374   2HB   HIS  46          2HB       HIS  46   6.075 -12.284   1.014
  375    HD1  HIS  46           HD1      HIS  46   3.690 -11.973   1.587
  376    HD2  HIS  46           HD2      HIS  46   5.404  -8.473   0.149
  377    HE1  HIS  46           HE1      HIS  46   1.818 -10.297   1.495
  378    HE2  HIS  46           HE2      HIS  46   2.901  -8.159   0.719
  379    H    THR  47           H        THR  47   8.179 -13.007   2.566
  380    HA   THR  47           HA       THR  47   6.489 -13.514   4.752
  381    HB   THR  47           HB       THR  47   9.275 -14.635   4.419
  382    HG1  THR  47           HG1      THR  47   7.267 -16.205   3.480
  383   1HG2  THR  47          1HG2      THR  47   8.743 -15.833   6.219
  384   2HG2  THR  47          2HG2      THR  47   7.401 -16.542   5.323
  385   3HG2  THR  47          3HG2      THR  47   7.148 -15.084   6.282
  386    H    ARG  48           H        ARG  48   9.740 -12.125   4.573
  387    HA   ARG  48           HA       ARG  48   9.929 -11.787   7.424
  388   1HB   ARG  48          1HB       ARG  48  11.807 -12.008   5.531
  389   2HB   ARG  48          2HB       ARG  48  11.702 -10.253   5.595
  390   1HG   ARG  48          1HG       ARG  48  11.952 -10.573   8.149
  391   2HG   ARG  48          2HG       ARG  48  12.559 -12.173   7.717
  392   1HD   ARG  48          1HD       ARG  48  13.660  -9.765   6.343
  393   2HD   ARG  48          2HD       ARG  48  14.199 -10.149   7.978
  394    HE   ARG  48           HE       ARG  48  14.847 -11.560   5.558
  395   1HH1  ARG  48          1HH1      ARG  48  14.588 -11.778   9.027
  396   2HH1  ARG  48          2HH1      ARG  48  15.718 -13.084   9.156
  397   1HH2  ARG  48          1HH2      ARG  48  16.333 -13.280   5.722
  398   2HH2  ARG  48          2HH2      ARG  48  16.708 -13.937   7.281
  399    H    PHE  49           H        PHE  49   8.489 -10.099   4.866
  400    HA   PHE  49           HA       PHE  49   8.735  -7.442   5.861
  401   1HB   PHE  49          1HB       PHE  49   7.795  -8.596   3.529
  402   2HB   PHE  49          2HB       PHE  49   6.330  -7.984   4.287
  403    HD1  PHE  49           HD1      PHE  49   9.818  -6.660   4.092
  404    HD2  PHE  49           HD2      PHE  49   5.692  -6.043   3.254
  405    HE1  PHE  49           HE1      PHE  49  10.332  -4.409   3.243
  406    HE2  PHE  49           HE2      PHE  49   6.198  -3.791   2.405
  407    HZ   PHE  49           HZ       PHE  49   8.521  -2.970   2.398
  408    H    LYS  50           H        LYS  50   6.182  -9.902   6.042
  409    HA   LYS  50           HA       LYS  50   4.463  -8.306   7.671
  410   1HB   LYS  50          1HB       LYS  50   4.445 -11.301   7.266
  411   2HB   LYS  50          2HB       LYS  50   3.127 -10.330   7.908
  412   1HG   LYS  50          1HG       LYS  50   3.598  -9.121   5.508
  413   2HG   LYS  50          2HG       LYS  50   3.931 -10.816   5.144
  414   1HD   LYS  50          1HD       LYS  50   1.468 -10.085   6.669
  415   2HD   LYS  50          2HD       LYS  50   1.504  -9.879   4.917
  416   1HE   LYS  50          1HE       LYS  50   0.925 -12.026   4.776
  417   2HE   LYS  50          2HE       LYS  50   2.564 -12.401   5.305
  418   1HZ   LYS  50          1HZ       LYS  50   0.384 -13.231   6.577
  419   2HZ   LYS  50          2HZ       LYS  50   0.665 -11.789   7.414
  420   3HZ   LYS  50          3HZ       LYS  50   1.867 -12.976   7.349
  421    H    ALA  51           H        ALA  51   6.907 -10.755   8.282
  422    HA   ALA  51           HA       ALA  51   6.333 -11.153  11.022
  423   1HB   ALA  51          1HB       ALA  51   7.637 -12.845  10.232
  424   2HB   ALA  51          2HB       ALA  51   8.889 -11.835  10.955
  425   3HB   ALA  51          3HB       ALA  51   8.605 -11.776   9.216
  426    H    ALA  52           H        ALA  52   8.811  -9.165   9.409
  427    HA   ALA  52           HA       ALA  52   9.841  -8.020  11.767
  428   1HB   ALA  52          1HB       ALA  52  11.212  -6.799  10.413
  429   2HB   ALA  52          2HB       ALA  52   9.949  -6.493   9.220
  430   3HB   ALA  52          3HB       ALA  52  10.737  -8.070   9.285
  431    H    CYS  53           H        CYS  53   7.378  -6.881   9.476
  432    HA   CYS  53           HA       CYS  53   6.967  -4.366  10.664
  433   1HB   CYS  53          1HB       CYS  53   5.289  -4.086   9.139
  434   2HB   CYS  53          2HB       CYS  53   6.108  -5.449   8.387
  435    HG   CYS  53           HG       CYS  53   4.318  -7.360   9.301
  436    H    ALA  54           H        ALA  54   5.588  -7.533  11.323
  437    HA   ALA  54           HA       ALA  54   3.552  -6.645  13.087
  438   1HB   ALA  54          1HB       ALA  54   4.632  -9.185  12.186
  439   2HB   ALA  54          2HB       ALA  54   2.989  -8.761  12.664
  440   3HB   ALA  54          3HB       ALA  54   4.174  -9.215  13.888
  441    H    ARG  55           H        ARG  55   6.948  -7.151  13.429
  442    HA   ARG  55           HA       ARG  55   6.925  -7.361  16.301
  443   1HB   ARG  55          1HB       ARG  55   9.084  -7.100  14.228
  444   2HB   ARG  55          2HB       ARG  55   9.452  -6.967  15.942
  445   1HG   ARG  55          1HG       ARG  55   8.715  -9.192  16.351
  446   2HG   ARG  55          2HG       ARG  55   8.060  -9.334  14.719
  447   1HD   ARG  55          1HD       ARG  55  10.221 -10.489  14.974
  448   2HD   ARG  55          2HD       ARG  55  10.279  -9.198  13.775
  449    HE   ARG  55           HE       ARG  55  11.170  -7.912  15.914
  450   1HH1  ARG  55          1HH1      ARG  55  11.967 -11.084  14.715
  451   2HH1  ARG  55          2HH1      ARG  55  13.580 -11.058  15.348
  452   1HH2  ARG  55          1HH2      ARG  55  13.290  -7.870  16.749
  453   2HH2  ARG  55          2HH2      ARG  55  14.330  -9.233  16.504
  454    H    LYS  56           H        LYS  56   7.680  -4.854  13.917
  455    HA   LYS  56           HA       LYS  56   8.268  -2.914  15.988
  456   1HB   LYS  56          1HB       LYS  56   8.038  -2.514  13.001
  457   2HB   LYS  56          2HB       LYS  56   8.732  -1.385  14.156
  458   1HG   LYS  56          1HG       LYS  56  10.643  -2.635  14.438
  459   2HG   LYS  56          2HG       LYS  56   9.865  -4.134  13.926
  460   1HD   LYS  56          1HD       LYS  56  10.839  -3.799  11.944
  461   2HD   LYS  56          2HD       LYS  56   9.660  -2.508  11.704
  462   1HE   LYS  56          1HE       LYS  56  12.028  -1.827  11.309
  463   2HE   LYS  56          2HE       LYS  56  11.188  -0.866  12.525
  464   1HZ   LYS  56          1HZ       LYS  56  12.826  -3.188  13.315
  465   2HZ   LYS  56          2HZ       LYS  56  12.379  -1.841  14.235
  466   3HZ   LYS  56          3HZ       LYS  56  13.549  -1.685  13.023
  467    H    GLY  57           H        GLY  57   5.475  -4.149  14.772
  468   1HA   GLY  57          1HA       GLY  57   3.284  -3.464  14.862
  469   2HA   GLY  57          2HA       GLY  57   3.828  -2.194  15.948
  470    H    THR  58           H        THR  58   4.540  -2.844  12.532
  471    HA   THR  58           HA       THR  58   3.439  -0.190  11.877
  472    HB   THR  58           HB       THR  58   5.775  -1.459  10.451
  473    HG1  THR  58           HG1      THR  58   6.444   0.677  11.962
  474   1HG2  THR  58          1HG2      THR  58   4.576   0.228   9.174
  475   2HG2  THR  58          2HG2      THR  58   6.153   0.846   9.666
  476   3HG2  THR  58          3HG2      THR  58   4.698   1.362  10.520
  477    H    SER  59           H        SER  59   2.245  -0.005  10.020
  478    HA   SER  59           HA       SER  59   0.982  -2.333   9.022
  479   1HB   SER  59          1HB       SER  59   0.865   0.122   7.365
  480   2HB   SER  59          2HB       SER  59  -0.444  -0.892   7.976
  481    HG   SER  59           HG       SER  59   0.400   0.117  10.115
  482    H    ILE  60           H        ILE  60   1.206  -3.409   7.073
  483    HA   ILE  60           HA       ILE  60   3.737  -3.756   6.027
  484    HB   ILE  60           HB       ILE  60   1.819  -5.320   5.732
  485   1HG1  ILE  60          1HG1      ILE  60   2.724  -4.954   2.961
  486   2HG1  ILE  60          2HG1      ILE  60   4.024  -4.939   4.147
  487   1HG2  ILE  60          1HG2      ILE  60   0.171  -5.007   4.091
  488   2HG2  ILE  60          2HG2      ILE  60   1.025  -3.641   3.374
  489   3HG2  ILE  60          3HG2      ILE  60   0.259  -3.471   4.953
  490   1HD1  ILE  60          1HD1      ILE  60   3.624  -7.168   3.234
  491   2HD1  ILE  60          2HD1      ILE  60   1.971  -7.117   3.847
  492   3HD1  ILE  60          3HD1      ILE  60   3.329  -7.106   4.973
  493    H    THR  61           H        THR  61   1.268  -1.458   5.078
  494    HA   THR  61           HA       THR  61   2.560  -0.663   2.647
  495    HB   THR  61           HB       THR  61   0.693   1.192   4.040
  496    HG1  THR  61           HG1      THR  61  -0.879  -0.449   2.798
  497   1HG2  THR  61          1HG2      THR  61   1.724   1.413   1.675
  498   2HG2  THR  61          2HG2      THR  61   0.005   1.742   1.885
  499   3HG2  THR  61          3HG2      THR  61   0.533   0.197   1.217
  500    H    ASP  62           H        ASP  62   2.447   0.555   5.961
  501    HA   ASP  62           HA       ASP  62   3.919   2.926   5.462
  502   1HB   ASP  62          1HB       ASP  62   2.448   2.409   7.486
  503   2HB   ASP  62          2HB       ASP  62   3.806   1.471   8.103
  504    H    VAL  63           H        VAL  63   4.807  -0.380   6.079
  505    HA   VAL  63           HA       VAL  63   7.473   0.004   6.892
  506    HB   VAL  63           HB       VAL  63   6.269  -2.314   5.369
  507   1HG1  VAL  63          1HG1      VAL  63   8.963  -1.770   5.813
  508   2HG1  VAL  63          2HG1      VAL  63   8.255  -3.317   5.348
  509   3HG1  VAL  63          3HG1      VAL  63   8.528  -2.949   7.051
  510   1HG2  VAL  63          1HG2      VAL  63   6.069  -1.445   8.112
  511   2HG2  VAL  63          2HG2      VAL  63   6.799  -3.048   8.003
  512   3HG2  VAL  63          3HG2      VAL  63   5.219  -2.748   7.279
  513    H    VAL  64           H        VAL  64   6.038  -0.491   3.684
  514    HA   VAL  64           HA       VAL  64   8.421  -0.476   2.208
  515    HB   VAL  64           HB       VAL  64   5.892   0.696   1.097
  516   1HG1  VAL  64          1HG1      VAL  64   6.981   0.465  -0.821
  517   2HG1  VAL  64          2HG1      VAL  64   7.133  -1.270  -0.541
  518   3HG1  VAL  64          3HG1      VAL  64   8.377  -0.169   0.050
  519   1HG2  VAL  64          1HG2      VAL  64   4.691  -1.134   1.478
  520   2HG2  VAL  64          2HG2      VAL  64   6.014  -1.785   2.444
  521   3HG2  VAL  64          3HG2      VAL  64   5.930  -2.132   0.717
  522    H    ASN  65           H        ASN  65   6.200   2.164   3.041
  523    HA   ASN  65           HA       ASN  65   7.563   4.221   1.709
  524   1HB   ASN  65          1HB       ASN  65   5.256   4.021   3.217
  525   2HB   ASN  65          2HB       ASN  65   6.286   5.047   4.209
  526   1HD2  ASN  65          1HD2      ASN  65   3.901   5.235   2.128
  527   2HD2  ASN  65          2HD2      ASN  65   4.287   6.699   1.295
  528    H    GLN  66           H        GLN  66   8.225   2.573   4.674
  529    HA   GLN  66           HA       GLN  66   9.905   4.576   5.827
  530   1HB   GLN  66          1HB       GLN  66   9.053   1.850   6.473
  531   2HB   GLN  66          2HB       GLN  66  10.709   2.198   6.952
  532   1HG   GLN  66          1HG       GLN  66   9.736   4.320   8.019
  533   2HG   GLN  66          2HG       GLN  66   8.177   3.513   7.848
  534   1HE2  GLN  66          1HE2      GLN  66   7.809   3.271  10.012
  535   2HE2  GLN  66          2HE2      GLN  66   8.736   2.220  11.022
  536    H    LEU  67           H        LEU  67  10.589   1.464   4.222
  537    HA   LEU  67           HA       LEU  67  13.385   1.762   4.218
  538   1HB   LEU  67          1HB       LEU  67  12.951   0.206   2.026
  539   2HB   LEU  67          2HB       LEU  67  13.048  -0.382   3.674
  540    HG   LEU  67           HG       LEU  67  10.366   0.400   3.259
  541   1HD1  LEU  67          1HD1      LEU  67  11.645  -0.686   0.854
  542   2HD1  LEU  67          2HD1      LEU  67  10.146   0.223   1.036
  543   3HD1  LEU  67          3HD1      LEU  67  10.170  -1.511   1.353
  544   1HD2  LEU  67          1HD2      LEU  67  10.224  -1.434   4.499
  545   2HD2  LEU  67          2HD2      LEU  67  11.900  -1.846   4.135
  546   3HD2  LEU  67          3HD2      LEU  67  10.604  -2.401   3.074
  547    H    VAL  68           H        VAL  68  10.901   2.887   2.015
  548    HA   VAL  68           HA       VAL  68  12.612   3.632  -0.117
  549    HB   VAL  68           HB       VAL  68   9.906   4.718   0.690
  550   1HG1  VAL  68          1HG1      VAL  68  10.569   6.452  -0.622
  551   2HG1  VAL  68          2HG1      VAL  68  10.038   5.351  -1.893
  552   3HG1  VAL  68          3HG1      VAL  68  11.752   5.481  -1.499
  553   1HG2  VAL  68          1HG2      VAL  68   9.122   3.389  -1.249
  554   2HG2  VAL  68          2HG2      VAL  68   9.807   2.402   0.043
  555   3HG2  VAL  68          3HG2      VAL  68  10.749   2.729  -1.413
  556    H    ASP  69           H        ASP  69  11.321   5.370   2.679
  557    HA   ASP  69           HA       ASP  69  12.471   7.877   2.103
  558   1HB   ASP  69          1HB       ASP  69  10.630   7.209   3.821
  559   2HB   ASP  69          2HB       ASP  69  11.984   6.914   4.906
  560    H    ASN  70           H        ASN  70  13.632   5.079   3.901
  561    HA   ASN  70           HA       ASN  70  15.938   6.271   5.001
  562   1HB   ASN  70          1HB       ASN  70  14.790   3.612   4.805
  563   2HB   ASN  70          2HB       ASN  70  16.539   3.569   4.617
  564   1HD2  ASN  70          1HD2      ASN  70  14.015   3.627   6.786
  565   2HD2  ASN  70          2HD2      ASN  70  14.902   4.014   8.217
  566    H    TRP  71           H        TRP  71  15.590   4.145   2.170
  567    HA   TRP  71           HA       TRP  71  18.266   4.342   1.333
  568   1HB   TRP  71          1HB       TRP  71  16.597   2.578   0.668
  569   2HB   TRP  71          2HB       TRP  71  15.878   3.761  -0.419
  570    HD1  TRP  71           HD1      TRP  71  19.140   1.769   0.068
  571    HE1  TRP  71           HE1      TRP  71  20.331   1.610  -2.208
  572    HE3  TRP  71           HE3      TRP  71  16.070   4.805  -2.666
  573    HZ2  TRP  71           HZ2      TRP  71  20.010   2.639  -4.818
  574    HZ3  TRP  71           HZ3      TRP  71  16.581   5.167  -5.045
  575    HH2  TRP  71           HH2      TRP  71  18.511   4.105  -6.097
  576    H    LEU  72           H        LEU  72  15.486   6.376   0.735
  577    HA   LEU  72           HA       LEU  72  16.763   7.795  -1.433
  578   1HB   LEU  72          1HB       LEU  72  14.120   7.535  -0.412
  579   2HB   LEU  72          2HB       LEU  72  14.534   9.238  -0.427
  580    HG   LEU  72           HG       LEU  72  15.207   8.938  -2.849
  581   1HD1  LEU  72          1HD1      LEU  72  14.838   6.241  -2.231
  582   2HD1  LEU  72          2HD1      LEU  72  15.147   6.944  -3.819
  583   3HD1  LEU  72          3HD1      LEU  72  13.488   6.673  -3.282
  584   1HD2  LEU  72          1HD2      LEU  72  13.245  10.035  -2.849
  585   2HD2  LEU  72          2HD2      LEU  72  12.507   8.927  -1.692
  586   3HD2  LEU  72          3HD2      LEU  72  12.593   8.492  -3.398
  587    H    LYS  73           H        LYS  73  16.925   7.964   1.934
  588    HA   LYS  73           HA       LYS  73  17.769  10.785   1.805
  589   1HB   LYS  73          1HB       LYS  73  16.544   9.170   4.020
  590   2HB   LYS  73          2HB       LYS  73  17.470  10.624   4.370
  591   1HG   LYS  73          1HG       LYS  73  15.911  12.014   3.425
  592   2HG   LYS  73          2HG       LYS  73  15.281  10.759   2.357
  593   1HD   LYS  73          1HD       LYS  73  13.616  10.488   3.809
  594   2HD   LYS  73          2HD       LYS  73  14.798   9.812   4.930
  595   1HE   LYS  73          1HE       LYS  73  14.599  11.562   6.286
  596   2HE   LYS  73          2HE       LYS  73  14.914  12.684   4.964
  597   1HZ   LYS  73          1HZ       LYS  73  12.717  12.952   6.088
  598   2HZ   LYS  73          2HZ       LYS  73  12.262  11.454   5.450
  599   3HZ   LYS  73          3HZ       LYS  73  12.628  12.737   4.412
  600    H    GLU  74           H        GLU  74  18.836   7.604   2.223
  601    HA   GLU  74           HA       GLU  74  21.244   8.423   3.676
  602   1HB   GLU  74          1HB       GLU  74  19.680   6.153   3.849
  603   2HB   GLU  74          2HB       GLU  74  21.057   5.611   2.898
  604   1HG   GLU  74          1HG       GLU  74  21.366   5.226   5.292
  605   2HG   GLU  74          2HG       GLU  74  22.581   6.319   4.630
  606    H    ASN  75           H        ASN  75  20.183   7.071   0.604
  607    HA   ASN  75           HA       ASN  75  22.905   6.914  -0.391
  608   1HB   ASN  75          1HB       ASN  75  22.010   5.288  -1.636
  609   2HB   ASN  75          2HB       ASN  75  20.401   5.698  -1.055
  610   1HD2  ASN  75          1HD2      ASN  75  19.014   6.737  -2.374
  611   2HD2  ASN  75          2HD2      ASN  75  19.370   7.184  -4.004
  612    H    GLU  76           H        GLU  76  20.171   9.046  -0.553
  613    HA   GLU  76           HA       GLU  76  21.295  10.570  -2.761
  614   1HB   GLU  76          1HB       GLU  76  18.700  10.372  -1.435
  615   2HB   GLU  76          2HB       GLU  76  19.169  12.030  -1.782
  616   1HG   GLU  76          1HG       GLU  76  19.320   9.909  -3.886
  617   2HG   GLU  76          2HG       GLU  76  17.807  10.741  -3.529
  618   1H    MET   1          1H        MET   1  -9.986 -59.734 -33.773
  619   2H    MET   1          2H        MET   1  -9.217 -60.103 -35.233
  620   3H    MET   1          3H        MET   1 -10.895 -60.260 -35.099
  621    HA   MET   1           HA       MET   1  -9.740 -57.644 -34.545
  622   1HB   MET   1          1HB       MET   1  -8.871 -58.917 -36.764
  623   2HB   MET   1          2HB       MET   1 -10.357 -58.208 -37.382
  624   1HG   MET   1          1HG       MET   1  -8.046 -56.753 -36.122
  625   2HG   MET   1          2HG       MET   1  -8.513 -56.738 -37.821
  626   1HE   MET   1          1HE       MET   1 -11.241 -54.681 -38.369
  627   2HE   MET   1          2HE       MET   1 -12.134 -55.799 -37.336
  628   3HE   MET   1          3HE       MET   1 -10.886 -56.407 -38.426
  629    H    SER   2           H        SER   2 -12.230 -59.822 -35.559
  630    HA   SER   2           HA       SER   2 -14.233 -58.163 -36.465
  631   1HB   SER   2          1HB       SER   2 -15.708 -59.849 -34.996
  632   2HB   SER   2          2HB       SER   2 -14.920 -60.356 -36.490
  633    HG   SER   2           HG       SER   2 -14.515 -61.241 -33.994
  634    H    LEU   3           H        LEU   3 -12.919 -58.561 -33.307
  635    HA   LEU   3           HA       LEU   3 -14.942 -56.948 -31.995
  636   1HB   LEU   3          1HB       LEU   3 -12.511 -57.362 -30.483
  637   2HB   LEU   3          2HB       LEU   3 -14.147 -57.876 -30.116
  638    HG   LEU   3           HG       LEU   3 -12.390 -59.388 -32.035
  639   1HD1  LEU   3          1HD1      LEU   3 -11.867 -60.906 -30.195
  640   2HD1  LEU   3          2HD1      LEU   3 -12.683 -59.821 -29.069
  641   3HD1  LEU   3          3HD1      LEU   3 -11.226 -59.288 -29.908
  642   1HD2  LEU   3          1HD2      LEU   3 -15.095 -59.634 -31.056
  643   2HD2  LEU   3          2HD2      LEU   3 -14.146 -61.079 -30.701
  644   3HD2  LEU   3          3HD2      LEU   3 -14.285 -60.501 -32.362
  645    H    GLU   4           H        GLU   4 -13.604 -55.863 -34.192
  646    HA   GLU   4           HA       GLU   4 -12.650 -54.005 -34.985
  647   1HB   GLU   4          1HB       GLU   4 -12.286 -52.398 -32.645
  648   2HB   GLU   4          2HB       GLU   4 -13.378 -52.159 -33.994
  649   1HG   GLU   4          1HG       GLU   4 -15.033 -52.411 -32.557
  650   2HG   GLU   4          2HG       GLU   4 -14.598 -54.118 -32.463
  651    H    LYS   5           H        LYS   5 -11.163 -55.490 -32.232
  652    HA   LYS   5           HA       LYS   5  -9.021 -55.773 -31.612
  653   1HB   LYS   5          1HB       LYS   5  -8.818 -55.249 -34.470
  654   2HB   LYS   5          2HB       LYS   5  -7.400 -54.699 -33.594
  655   1HG   LYS   5          1HG       LYS   5  -8.323 -57.421 -34.182
  656   2HG   LYS   5          2HG       LYS   5  -6.694 -56.801 -33.943
  657   1HD   LYS   5          1HD       LYS   5  -6.747 -57.961 -32.027
  658   2HD   LYS   5          2HD       LYS   5  -7.737 -56.635 -31.421
  659   1HE   LYS   5          1HE       LYS   5  -8.856 -59.091 -32.765
  660   2HE   LYS   5          2HE       LYS   5  -8.677 -58.925 -31.019
  661   1HZ   LYS   5          1HZ       LYS   5 -10.909 -58.366 -31.699
  662   2HZ   LYS   5          2HZ       LYS   5 -10.335 -57.199 -32.779
  663   3HZ   LYS   5          3HZ       LYS   5 -10.135 -56.980 -31.114
  664    H    ALA   6           H        ALA   6 -10.387 -52.869 -32.443
  665    HA   ALA   6           HA       ALA   6  -8.313 -51.205 -31.294
  666   1HB   ALA   6          1HB       ALA   6 -11.009 -50.202 -32.111
  667   2HB   ALA   6          2HB       ALA   6  -9.848 -50.648 -33.361
  668   3HB   ALA   6          3HB       ALA   6  -9.444 -49.394 -32.189
  669    H    HIS   7           H        HIS   7 -10.523 -53.293 -30.302
  670    HA   HIS   7           HA       HIS   7 -12.045 -51.961 -28.351
  671   1HB   HIS   7          1HB       HIS   7 -12.230 -54.225 -27.302
  672   2HB   HIS   7          2HB       HIS   7 -12.609 -54.229 -29.022
  673    HD1  HIS   7           HD1      HIS   7  -9.258 -54.112 -29.447
  674    HD2  HIS   7           HD2      HIS   7 -11.670 -57.023 -27.729
  675    HE1  HIS   7           HE1      HIS   7  -7.928 -56.240 -29.560
  676    HE2  HIS   7           HE2      HIS   7  -9.420 -57.996 -28.547
  677    H    THR   8           H        THR   8  -8.817 -53.156 -28.544
  678    HA   THR   8           HA       THR   8  -8.163 -52.924 -25.779
  679    HB   THR   8           HB       THR   8  -5.766 -52.752 -26.843
  680    HG1  THR   8           HG1      THR   8  -5.731 -52.872 -28.949
  681   1HG2  THR   8          1HG2      THR   8  -7.578 -55.143 -26.842
  682   2HG2  THR   8          2HG2      THR   8  -6.300 -54.720 -25.703
  683   3HG2  THR   8          3HG2      THR   8  -5.887 -55.271 -27.327
  684    H    SER   9           H        SER   9  -8.532 -50.812 -28.438
  685    HA   SER   9           HA       SER   9  -8.061 -48.603 -28.795
  686   1HB   SER   9          1HB       SER   9  -8.126 -47.578 -26.152
  687   2HB   SER   9          2HB       SER   9  -9.435 -47.572 -27.334
  688    HG   SER   9           HG       SER   9 -10.328 -49.257 -26.382
  689    H    VAL  10           H        VAL  10  -5.882 -50.172 -28.693
  690    HA   VAL  10           HA       VAL  10  -3.609 -49.970 -28.676
  691    HB   VAL  10           HB       VAL  10  -3.911 -47.457 -27.022
  692   1HG1  VAL  10          1HG1      VAL  10  -1.696 -48.056 -26.842
  693   2HG1  VAL  10          2HG1      VAL  10  -1.660 -47.049 -28.289
  694   3HG1  VAL  10          3HG1      VAL  10  -1.660 -48.806 -28.438
  695   1HG2  VAL  10          1HG2      VAL  10  -4.595 -46.338 -28.815
  696   2HG2  VAL  10          2HG2      VAL  10  -4.718 -47.862 -29.693
  697   3HG2  VAL  10          3HG2      VAL  10  -3.220 -46.932 -29.746
  698    H    LYS  11           H        LYS  11  -4.631 -51.755 -27.175
  699    HA   LYS  11           HA       LYS  11  -4.493 -52.999 -25.272
  700   1HB   LYS  11          1HB       LYS  11  -2.039 -52.641 -25.926
  701   2HB   LYS  11          2HB       LYS  11  -1.999 -51.427 -24.652
  702   1HG   LYS  11          1HG       LYS  11  -2.881 -54.247 -24.141
  703   2HG   LYS  11          2HG       LYS  11  -1.187 -53.759 -24.067
  704   1HD   LYS  11          1HD       LYS  11  -3.430 -52.571 -22.432
  705   2HD   LYS  11          2HD       LYS  11  -2.247 -53.744 -21.851
  706   1HE   LYS  11          1HE       LYS  11  -0.679 -52.179 -21.558
  707   2HE   LYS  11          2HE       LYS  11  -1.028 -51.417 -23.110
  708   1HZ   LYS  11          1HZ       LYS  11  -3.158 -50.904 -21.361
  709   2HZ   LYS  11          2HZ       LYS  11  -2.075 -49.803 -22.048
  710   3HZ   LYS  11          3HZ       LYS  11  -1.717 -50.521 -20.558
  711    H    LYS  12           H        LYS  12  -6.317 -52.089 -24.273
  712    HA   LYS  12           HA       LYS  12  -7.501 -50.712 -22.868
  713   1HB   LYS  12          1HB       LYS  12  -5.893 -52.384 -21.462
  714   2HB   LYS  12          2HB       LYS  12  -5.372 -50.827 -20.829
  715   1HG   LYS  12          1HG       LYS  12  -8.225 -51.773 -20.912
  716   2HG   LYS  12          2HG       LYS  12  -7.169 -51.863 -19.502
  717   1HD   LYS  12          1HD       LYS  12  -8.140 -49.873 -19.016
  718   2HD   LYS  12          2HD       LYS  12  -6.895 -49.259 -20.106
  719   1HE   LYS  12          1HE       LYS  12  -9.158 -50.113 -21.635
  720   2HE   LYS  12          2HE       LYS  12  -9.698 -49.033 -20.350
  721   1HZ   LYS  12          1HZ       LYS  12  -8.161 -48.449 -22.715
  722   2HZ   LYS  12          2HZ       LYS  12  -7.519 -47.763 -21.306
  723   3HZ   LYS  12          3HZ       LYS  12  -9.111 -47.424 -21.761
  724    H    MET  13           H        MET  13  -5.844 -49.333 -24.664
  725    HA   MET  13           HA       MET  13  -4.859 -47.333 -25.054
  726   1HB   MET  13          1HB       MET  13  -7.225 -46.969 -23.619
  727   2HB   MET  13          2HB       MET  13  -6.061 -45.884 -22.871
  728   1HG   MET  13          1HG       MET  13  -5.548 -45.312 -25.405
  729   2HG   MET  13          2HG       MET  13  -7.216 -45.854 -25.591
  730   1HE   MET  13          1HE       MET  13  -7.812 -44.390 -22.120
  731   2HE   MET  13          2HE       MET  13  -8.673 -45.323 -23.346
  732   3HE   MET  13          3HE       MET  13  -9.089 -43.631 -23.071
  733    H    THR  14           H        THR  14  -2.749 -47.838 -24.504
  734    HA   THR  14           HA       THR  14  -1.873 -47.448 -21.777
  735    HB   THR  14           HB       THR  14   0.206 -47.601 -23.849
  736    HG1  THR  14           HG1      THR  14  -0.371 -49.486 -24.700
  737   1HG2  THR  14          1HG2      THR  14  -0.309 -48.485 -21.129
  738   2HG2  THR  14          2HG2      THR  14   1.226 -48.196 -21.948
  739   3HG2  THR  14          3HG2      THR  14   0.417 -49.753 -22.115
  740    H    PHE  15           H        PHE  15  -3.007 -45.439 -23.815
  741    HA   PHE  15           HA       PHE  15  -1.484 -43.457 -24.716
  742   1HB   PHE  15          1HB       PHE  15  -3.244 -41.904 -24.185
  743   2HB   PHE  15          2HB       PHE  15  -4.002 -43.463 -24.510
  744    HD1  PHE  15           HD1      PHE  15  -3.502 -40.835 -22.091
  745    HD2  PHE  15           HD2      PHE  15  -4.748 -44.870 -22.579
  746    HE1  PHE  15           HE1      PHE  15  -4.581 -40.768 -19.880
  747    HE2  PHE  15           HE2      PHE  15  -5.832 -44.808 -20.375
  748    HZ   PHE  15           HZ       PHE  15  -5.748 -42.757 -19.019
  749    H    GLY  16           H        GLY  16  -2.191 -44.062 -21.355
  750   1HA   GLY  16          1HA       GLY  16   0.123 -43.323 -20.189
  751   2HA   GLY  16          2HA       GLY  16  -0.715 -41.791 -20.420
  752    H    GLU  17           H        GLU  17  -2.295 -44.859 -19.821
  753    HA   GLU  17           HA       GLU  17  -3.915 -43.860 -17.773
  754   1HB   GLU  17          1HB       GLU  17  -4.659 -46.069 -17.443
  755   2HB   GLU  17          2HB       GLU  17  -4.199 -46.024 -19.138
  756   1HG   GLU  17          1HG       GLU  17  -2.642 -47.209 -16.858
  757   2HG   GLU  17          2HG       GLU  17  -3.425 -48.066 -18.185
  758    H    ASN  18           H        ASN  18  -0.719 -45.061 -17.893
  759    HA   ASN  18           HA       ASN  18  -0.384 -45.298 -15.023
  760   1HB   ASN  18          1HB       ASN  18   2.108 -45.420 -15.823
  761   2HB   ASN  18          2HB       ASN  18   1.038 -46.782 -16.151
  762   1HD2  ASN  18          1HD2      ASN  18   2.340 -47.413 -17.879
  763   2HD2  ASN  18          2HD2      ASN  18   2.313 -46.578 -19.391
  764    H    ARG  19           H        ARG  19   0.174 -43.161 -17.683
  765    HA   ARG  19           HA       ARG  19   1.688 -41.213 -16.261
  766   1HB   ARG  19          1HB       ARG  19   0.654 -41.580 -18.957
  767   2HB   ARG  19          2HB       ARG  19   0.475 -39.921 -18.404
  768   1HG   ARG  19          1HG       ARG  19   2.548 -39.971 -19.466
  769   2HG   ARG  19          2HG       ARG  19   2.932 -40.054 -17.745
  770   1HD   ARG  19          1HD       ARG  19   2.814 -42.386 -19.657
  771   2HD   ARG  19          2HD       ARG  19   4.279 -41.635 -19.027
  772    HE   ARG  19           HE       ARG  19   2.754 -43.627 -17.759
  773   1HH1  ARG  19          1HH1      ARG  19   4.439 -40.663 -17.039
  774   2HH1  ARG  19          2HH1      ARG  19   4.745 -41.092 -15.390
  775   1HH2  ARG  19          1HH2      ARG  19   3.147 -44.190 -15.591
  776   2HH2  ARG  19          2HH2      ARG  19   4.015 -43.094 -14.569
  777    H    ASP  20           H        ASP  20  -1.423 -42.253 -16.050
  778    HA   ASP  20           HA       ASP  20  -3.034 -40.009 -15.855
  779   1HB   ASP  20          1HB       ASP  20  -4.484 -41.308 -14.542
  780   2HB   ASP  20          2HB       ASP  20  -3.592 -42.536 -15.439
  781    H    LEU  21           H        LEU  21  -0.617 -41.372 -13.783
  782    HA   LEU  21           HA       LEU  21  -0.960 -40.007 -11.442
  783   1HB   LEU  21          1HB       LEU  21   1.153 -40.674 -10.911
  784   2HB   LEU  21          2HB       LEU  21   0.901 -41.703 -12.305
  785    HG   LEU  21           HG       LEU  21   2.213 -39.032 -12.646
  786   1HD1  LEU  21          1HD1      LEU  21   4.075 -41.232 -12.379
  787   2HD1  LEU  21          2HD1      LEU  21   3.201 -40.911 -10.881
  788   3HD1  LEU  21          3HD1      LEU  21   4.115 -39.621 -11.662
  789   1HD2  LEU  21          1HD2      LEU  21   1.474 -41.048 -14.374
  790   2HD2  LEU  21          2HD2      LEU  21   3.200 -41.321 -14.128
  791   3HD2  LEU  21          3HD2      LEU  21   2.628 -39.757 -14.708
  792    H    GLU  22           H        GLU  22   0.772 -38.991 -14.363
  793    HA   GLU  22           HA       GLU  22   1.705 -36.935 -14.878
  794   1HB   GLU  22          1HB       GLU  22  -1.145 -37.049 -15.028
  795   2HB   GLU  22          2HB       GLU  22  -0.679 -35.418 -14.565
  796   1HG   GLU  22          1HG       GLU  22  -0.905 -36.019 -17.065
  797   2HG   GLU  22          2HG       GLU  22   0.452 -35.033 -16.525
  798    H    ARG  23           H        ARG  23   2.094 -37.534 -12.200
  799    HA   ARG  23           HA       ARG  23   1.281 -35.330 -10.612
  800   1HB   ARG  23          1HB       ARG  23   2.912 -37.764 -10.167
  801   2HB   ARG  23          2HB       ARG  23   3.102 -36.423  -9.044
  802   1HG   ARG  23          1HG       ARG  23   0.690 -38.101  -9.586
  803   2HG   ARG  23          2HG       ARG  23   1.458 -37.714  -8.048
  804   1HD   ARG  23          1HD       ARG  23  -0.359 -36.337  -7.903
  805   2HD   ARG  23          2HD       ARG  23   0.749 -35.249  -8.741
  806    HE   ARG  23           HE       ARG  23  -1.323 -36.842 -10.114
  807   1HH1  ARG  23          1HH1      ARG  23   0.500 -33.893  -9.722
  808   2HH1  ARG  23          2HH1      ARG  23  -0.254 -33.101 -11.065
  809   1HH2  ARG  23          1HH2      ARG  23  -2.298 -35.811 -11.891
  810   2HH2  ARG  23          2HH2      ARG  23  -1.842 -34.189 -12.296
  811    H    VAL  24           H        VAL  24   2.624 -34.522 -12.909
  812    HA   VAL  24           HA       VAL  24   5.285 -33.752 -12.391
  813    HB   VAL  24           HB       VAL  24   4.893 -32.004 -14.094
  814   1HG1  VAL  24          1HG1      VAL  24   4.488 -34.832 -14.453
  815   2HG1  VAL  24          2HG1      VAL  24   5.345 -33.681 -15.480
  816   3HG1  VAL  24          3HG1      VAL  24   3.608 -33.914 -15.676
  817   1HG2  VAL  24          1HG2      VAL  24   2.066 -32.965 -14.368
  818   2HG2  VAL  24          2HG2      VAL  24   2.803 -31.486 -14.981
  819   3HG2  VAL  24          3HG2      VAL  24   2.474 -31.657 -13.257
  820    H    VAL  25           H        VAL  25   2.278 -32.994 -11.130
  821    HA   VAL  25           HA       VAL  25   1.400 -31.161 -10.017
  822    HB   VAL  25           HB       VAL  25   2.684 -30.912  -7.819
  823   1HG1  VAL  25          1HG1      VAL  25   1.905 -33.729  -8.506
  824   2HG1  VAL  25          2HG1      VAL  25   0.725 -32.431  -8.324
  825   3HG1  VAL  25          3HG1      VAL  25   1.745 -32.891  -6.962
  826   1HG2  VAL  25          1HG2      VAL  25   4.778 -31.921  -9.126
  827   2HG2  VAL  25          2HG2      VAL  25   4.103 -33.420  -8.487
  828   3HG2  VAL  25          3HG2      VAL  25   4.555 -32.117  -7.388
  829    H    THR  26           H        THR  26   2.436 -29.964 -12.011
  830    HA   THR  26           HA       THR  26   4.600 -28.377 -11.988
  831    HB   THR  26           HB       THR  26   2.608 -26.586 -12.765
  832    HG1  THR  26           HG1      THR  26   0.906 -27.891 -12.823
  833   1HG2  THR  26          1HG2      THR  26   3.999 -28.706 -14.408
  834   2HG2  THR  26          2HG2      THR  26   4.670 -27.131 -13.984
  835   3HG2  THR  26          3HG2      THR  26   3.254 -27.232 -15.031
  836    H    ALA  27           H        ALA  27   1.743 -28.082 -10.032
  837    HA   ALA  27           HA       ALA  27   1.112 -26.210  -8.673
  838   1HB   ALA  27          1HB       ALA  27   3.040 -28.157  -7.539
  839   2HB   ALA  27          2HB       ALA  27   1.358 -27.843  -7.109
  840   3HB   ALA  27          3HB       ALA  27   2.628 -26.749  -6.559
  841    HA   PRO  28           HA       PRO  28   4.416 -23.331 -10.403
  842   1HB   PRO  28          1HB       PRO  28   2.114 -21.738  -9.333
  843   2HB   PRO  28          2HB       PRO  28   3.119 -21.438 -10.755
  844   1HG   PRO  28          1HG       PRO  28   0.672 -22.633 -10.877
  845   2HG   PRO  28          2HG       PRO  28   1.967 -22.928 -12.048
  846   1HD   PRO  28          1HD       PRO  28   0.838 -24.750 -10.107
  847   2HD   PRO  28          2HD       PRO  28   2.046 -25.081 -11.362
  848    H    VAL  29           H        VAL  29   5.718 -24.084  -8.569
  849    HA   VAL  29           HA       VAL  29   5.349 -22.882  -5.995
  850    HB   VAL  29           HB       VAL  29   7.771 -23.694  -5.678
  851   1HG1  VAL  29          1HG1      VAL  29   6.510 -25.205  -4.622
  852   2HG1  VAL  29          2HG1      VAL  29   6.691 -26.197  -6.069
  853   3HG1  VAL  29          3HG1      VAL  29   5.271 -25.169  -5.876
  854   1HG2  VAL  29          1HG2      VAL  29   8.604 -23.918  -7.845
  855   2HG2  VAL  29          2HG2      VAL  29   7.150 -24.733  -8.422
  856   3HG2  VAL  29          3HG2      VAL  29   8.273 -25.580  -7.358
  857    H    SER  30           H        SER  30   6.631 -22.007  -8.981
  858    HA   SER  30           HA       SER  30   8.486 -20.014  -8.036
  859   1HB   SER  30          1HB       SER  30   8.631 -19.424 -10.454
  860   2HB   SER  30          2HB       SER  30   8.929 -21.137 -10.151
  861    HG   SER  30           HG       SER  30   7.249 -21.597 -11.317
  862    H    SER  31           H        SER  31   5.162 -20.238  -8.998
  863    HA   SER  31           HA       SER  31   4.584 -17.618  -9.660
  864   1HB   SER  31          1HB       SER  31   2.295 -18.122  -9.171
  865   2HB   SER  31          2HB       SER  31   3.029 -19.599  -9.796
  866    HG   SER  31           HG       SER  31   1.986 -19.066  -7.320
  867    H    GLY  32           H        GLY  32   4.164 -19.112  -6.451
  868   1HA   GLY  32          1HA       GLY  32   3.501 -16.812  -5.057
  869   2HA   GLY  32          2HA       GLY  32   4.269 -18.221  -4.345
  870    H    LYS  33           H        LYS  33   6.637 -17.854  -6.145
  871    HA   LYS  33           HA       LYS  33   8.372 -16.631  -4.433
  872   1HB   LYS  33          1HB       LYS  33   8.569 -16.720  -7.441
  873   2HB   LYS  33          2HB       LYS  33   9.901 -16.351  -6.358
  874   1HG   LYS  33          1HG       LYS  33   8.363 -18.934  -6.311
  875   2HG   LYS  33          2HG       LYS  33   9.869 -18.687  -7.197
  876   1HD   LYS  33          1HD       LYS  33  10.995 -19.186  -5.350
  877   2HD   LYS  33          2HD       LYS  33  10.312 -17.753  -4.578
  878   1HE   LYS  33          1HE       LYS  33   9.368 -20.593  -4.469
  879   2HE   LYS  33          2HE       LYS  33   9.722 -19.488  -3.141
  880   1HZ   LYS  33          1HZ       LYS  33   7.332 -19.860  -3.470
  881   2HZ   LYS  33          2HZ       LYS  33   7.441 -19.193  -5.019
  882   3HZ   LYS  33          3HZ       LYS  33   7.758 -18.234  -3.663
  883    H    ILE  34           H        ILE  34   6.155 -15.007  -6.555
  884    HA   ILE  34           HA       ILE  34   7.435 -12.463  -5.798
  885    HB   ILE  34           HB       ILE  34   6.198 -11.614  -7.950
  886   1HG1  ILE  34          1HG1      ILE  34   6.931 -14.042  -9.327
  887   2HG1  ILE  34          2HG1      ILE  34   5.701 -14.377  -8.113
  888   1HG2  ILE  34          1HG2      ILE  34   8.252 -11.918  -9.209
  889   2HG2  ILE  34          2HG2      ILE  34   8.763 -13.189  -8.099
  890   3HG2  ILE  34          3HG2      ILE  34   8.612 -11.528  -7.527
  891   1HD1  ILE  34          1HD1      ILE  34   4.340 -13.846  -9.830
  892   2HD1  ILE  34          2HD1      ILE  34   5.535 -12.804 -10.602
  893   3HD1  ILE  34          3HD1      ILE  34   4.611 -12.214  -9.219
  894    H    LYS  35           H        LYS  35   6.183 -10.800  -5.136
  895    HA   LYS  35           HA       LYS  35   3.281 -11.233  -4.936
  896   1HB   LYS  35          1HB       LYS  35   5.242 -10.848  -2.782
  897   2HB   LYS  35          2HB       LYS  35   3.872  -9.751  -2.697
  898   1HG   LYS  35          1HG       LYS  35   3.216 -11.565  -1.408
  899   2HG   LYS  35          2HG       LYS  35   2.422 -11.846  -2.959
  900   1HD   LYS  35          1HD       LYS  35   3.985 -13.506  -3.570
  901   2HD   LYS  35          2HD       LYS  35   5.096 -13.043  -2.279
  902   1HE   LYS  35          1HE       LYS  35   4.183 -14.735  -1.132
  903   2HE   LYS  35          2HE       LYS  35   2.816 -13.648  -0.895
  904   1HZ   LYS  35          1HZ       LYS  35   1.547 -15.024  -2.047
  905   2HZ   LYS  35          2HZ       LYS  35   2.846 -16.093  -2.226
  906   3HZ   LYS  35          3HZ       LYS  35   2.563 -14.904  -3.396
  907    H    ARG  36           H        ARG  36   2.082  -9.177  -4.586
  908    HA   ARG  36           HA       ARG  36   3.529  -6.902  -5.778
  909   1HB   ARG  36          1HB       ARG  36   1.212  -6.253  -6.673
  910   2HB   ARG  36          2HB       ARG  36   2.052  -7.584  -7.461
  911   1HG   ARG  36          1HG       ARG  36   0.393  -8.507  -5.281
  912   2HG   ARG  36          2HG       ARG  36  -0.532  -7.603  -6.481
  913   1HD   ARG  36          1HD       ARG  36   1.419  -9.649  -7.414
  914   2HD   ARG  36          2HD       ARG  36  -0.118 -10.190  -6.740
  915    HE   ARG  36           HE       ARG  36  -1.239  -9.172  -8.533
  916   1HH1  ARG  36          1HH1      ARG  36   2.220  -8.802  -8.744
  917   2HH1  ARG  36          2HH1      ARG  36   2.197  -8.356 -10.418
  918   1HH2  ARG  36          1HH2      ARG  36  -1.277  -8.588 -10.730
  919   2HH2  ARG  36          2HH2      ARG  36   0.210  -8.234 -11.546
  920    H    VAL  37           H        VAL  37   3.407  -4.994  -4.782
  921    HA   VAL  37           HA       VAL  37   1.392  -4.608  -2.683
  922    HB   VAL  37           HB       VAL  37   4.347  -4.057  -2.353
  923   1HG1  VAL  37          1HG1      VAL  37   3.878  -2.683  -0.666
  924   2HG1  VAL  37          2HG1      VAL  37   2.737  -3.831   0.035
  925   3HG1  VAL  37          3HG1      VAL  37   2.200  -2.703  -1.210
  926   1HG2  VAL  37          1HG2      VAL  37   4.176  -5.707  -0.513
  927   2HG2  VAL  37          2HG2      VAL  37   3.862  -6.406  -2.101
  928   3HG2  VAL  37          3HG2      VAL  37   2.521  -6.050  -1.012
  929    H    ASN  38           H        ASN  38   0.279  -2.858  -3.216
  930    HA   ASN  38           HA       ASN  38   1.450  -0.814  -4.904
  931   1HB   ASN  38          1HB       ASN  38  -0.812  -1.490  -5.415
  932   2HB   ASN  38          2HB       ASN  38  -1.332  -1.153  -3.767
  933   1HD2  ASN  38          1HD2      ASN  38   0.114   0.405  -6.596
  934   2HD2  ASN  38          2HD2      ASN  38  -0.661   1.932  -6.366
  935    H    VAL  39           H        VAL  39   2.645   0.721  -4.001
  936    HA   VAL  39           HA       VAL  39   1.781   1.818  -1.404
  937    HB   VAL  39           HB       VAL  39   4.602   2.228  -2.142
  938   1HG1  VAL  39          1HG1      VAL  39   3.230   1.304   0.379
  939   2HG1  VAL  39          2HG1      VAL  39   3.666   2.967  -0.016
  940   3HG1  VAL  39          3HG1      VAL  39   4.927   1.760   0.235
  941   1HG2  VAL  39          1HG2      VAL  39   5.398   0.069  -1.810
  942   2HG2  VAL  39          2HG2      VAL  39   3.982  -0.185  -2.831
  943   3HG2  VAL  39          3HG2      VAL  39   3.884  -0.486  -1.096
  944    H    ASN  40           H        ASN  40   1.794   4.028  -1.142
  945    HA   ASN  40           HA       ASN  40   2.286   5.584  -3.592
  946   1HB   ASN  40          1HB       ASN  40   0.581   7.192  -2.657
  947   2HB   ASN  40          2HB       ASN  40  -0.055   5.631  -3.164
  948   1HD2  ASN  40          1HD2      ASN  40  -0.564   4.080  -1.542
  949   2HD2  ASN  40          2HD2      ASN  40  -0.973   4.592   0.056
  950    H    PHE  41           H        PHE  41   3.981   6.860  -3.460
  951    HA   PHE  41           HA       PHE  41   4.930   7.720  -0.827
  952   1HB   PHE  41          1HB       PHE  41   6.428   8.019  -3.421
  953   2HB   PHE  41          2HB       PHE  41   7.072   7.991  -1.785
  954    HD1  PHE  41           HD1      PHE  41   6.247   5.689  -0.508
  955    HD2  PHE  41           HD2      PHE  41   6.983   6.191  -4.668
  956    HE1  PHE  41           HE1      PHE  41   6.676   3.275  -0.718
  957    HE2  PHE  41           HE2      PHE  41   7.413   3.778  -4.887
  958    HZ   PHE  41           HZ       PHE  41   7.259   2.317  -2.910
  959    H    ASP  42           H        ASP  42   6.167   9.912  -1.000
  960    HA   ASP  42           HA       ASP  42   4.187  11.893  -1.659
  961   1HB   ASP  42          1HB       ASP  42   5.420  12.152   0.396
  962   2HB   ASP  42          2HB       ASP  42   6.956  12.073  -0.457
  963    H    GLU  43           H        GLU  43   4.646  13.799  -2.966
  964    HA   GLU  43           HA       GLU  43   5.486  13.241  -5.544
  965   1HB   GLU  43          1HB       GLU  43   4.554  15.523  -4.106
  966   2HB   GLU  43          2HB       GLU  43   5.953  16.009  -5.054
  967   1HG   GLU  43          1HG       GLU  43   3.645  14.498  -6.234
  968   2HG   GLU  43          2HG       GLU  43   3.690  16.257  -6.148
  969    H    GLU  44           H        GLU  44   7.276  14.688  -2.868
  970    HA   GLU  44           HA       GLU  44   9.647  15.242  -4.294
  971   1HB   GLU  44          1HB       GLU  44   8.947  16.132  -2.013
  972   2HB   GLU  44          2HB       GLU  44   9.479  14.591  -1.355
  973   1HG   GLU  44          1HG       GLU  44  11.606  15.213  -1.386
  974   2HG   GLU  44          2HG       GLU  44  11.494  15.771  -3.055
  975    H    LYS  45           H        LYS  45   8.470  12.418  -2.575
  976    HA   LYS  45           HA       LYS  45  10.867  10.935  -2.576
  977   1HB   LYS  45          1HB       LYS  45   8.421  10.567  -1.479
  978   2HB   LYS  45          2HB       LYS  45   8.323   9.446  -2.830
  979   1HG   LYS  45          1HG       LYS  45   9.951   8.075  -1.996
  980   2HG   LYS  45          2HG       LYS  45  10.736   9.375  -1.096
  981   1HD   LYS  45          1HD       LYS  45   8.078   9.006  -0.107
  982   2HD   LYS  45          2HD       LYS  45   8.912   7.451  -0.135
  983   1HE   LYS  45          1HE       LYS  45   9.973   8.027   1.728
  984   2HE   LYS  45          2HE       LYS  45  10.761   9.331   0.840
  985   1HZ   LYS  45          1HZ       LYS  45   9.693  10.708   2.190
  986   2HZ   LYS  45          2HZ       LYS  45   8.722   9.476   2.823
  987   3HZ   LYS  45          3HZ       LYS  45   8.254  10.278   1.409
  988    H    HIS  46           H        HIS  46   8.365  11.442  -4.957
  989    HA   HIS  46           HA       HIS  46   9.186   9.339  -6.710
  990   1HB   HIS  46          1HB       HIS  46   6.899  10.595  -6.579
  991   2HB   HIS  46          2HB       HIS  46   7.680  11.762  -7.641
  992    HD1  HIS  46           HD1      HIS  46   7.114  11.331  -9.996
  993    HD2  HIS  46           HD2      HIS  46   7.374   7.806  -7.812
  994    HE1  HIS  46           HE1      HIS  46   6.625   9.487 -11.635
  995    HE2  HIS  46           HE2      HIS  46   6.727   7.367 -10.278
  996    H    THR  47           H        THR  47   9.693  12.851  -6.617
  997    HA   THR  47           HA       THR  47  11.197  13.050  -8.984
  998    HB   THR  47           HB       THR  47  11.751  14.839  -6.642
  999    HG1  THR  47           HG1      THR  47   9.692  15.823  -7.980
 1000   1HG2  THR  47          1HG2      THR  47  12.968  15.503  -8.513
 1001   2HG2  THR  47          2HG2      THR  47  11.529  16.520  -8.599
 1002   3HG2  THR  47          3HG2      THR  47  11.664  15.094  -9.627
 1003    H    ARG  48           H        ARG  48  12.144  12.510  -5.622
 1004    HA   ARG  48           HA       ARG  48  14.942  12.507  -6.108
 1005   1HB   ARG  48          1HB       ARG  48  13.234  12.329  -3.862
 1006   2HB   ARG  48          2HB       ARG  48  14.243  10.889  -3.840
 1007   1HG   ARG  48          1HG       ARG  48  16.243  12.246  -3.900
 1008   2HG   ARG  48          2HG       ARG  48  15.268  13.713  -4.030
 1009   1HD   ARG  48          1HD       ARG  48  14.357  12.224  -1.786
 1010   2HD   ARG  48          2HD       ARG  48  16.114  12.348  -1.692
 1011    HE   ARG  48           HE       ARG  48  14.217  14.587  -1.707
 1012   1HH1  ARG  48          1HH1      ARG  48  17.460  13.370  -1.338
 1013   2HH1  ARG  48          2HH1      ARG  48  18.067  14.832  -0.636
 1014   1HH2  ARG  48          1HH2      ARG  48  15.008  16.515  -0.780
 1015   2HH2  ARG  48          2HH2      ARG  48  16.674  16.617  -0.317
 1016    H    PHE  49           H        PHE  49  12.420  10.105  -6.247
 1017    HA   PHE  49           HA       PHE  49  14.070   7.803  -6.275
 1018   1HB   PHE  49          1HB       PHE  49  11.345   8.277  -6.255
 1019   2HB   PHE  49          2HB       PHE  49  11.610   7.600  -7.853
 1020    HD1  PHE  49           HD1      PHE  49  14.116   6.202  -5.934
 1021    HD2  PHE  49           HD2      PHE  49   9.894   6.045  -6.450
 1022    HE1  PHE  49           HE1      PHE  49  14.086   3.938  -4.971
 1023    HE2  PHE  49           HE2      PHE  49   9.859   3.782  -5.488
 1024    HZ   PHE  49           HZ       PHE  49  11.956   2.727  -4.746
 1025    H    LYS  50           H        LYS  50  12.803   9.927  -8.783
 1026    HA   LYS  50           HA       LYS  50  13.650   8.437 -11.013
 1027   1HB   LYS  50          1HB       LYS  50  13.006  11.339 -10.575
 1028   2HB   LYS  50          2HB       LYS  50  13.615  10.779 -12.127
 1029   1HG   LYS  50          1HG       LYS  50  11.209   9.555 -10.815
 1030   2HG   LYS  50          2HG       LYS  50  11.104  10.963 -11.875
 1031   1HD   LYS  50          1HD       LYS  50  12.716   8.955 -13.120
 1032   2HD   LYS  50          2HD       LYS  50  11.188   8.240 -12.604
 1033   1HE   LYS  50          1HE       LYS  50  10.305   9.089 -14.465
 1034   2HE   LYS  50          2HE       LYS  50  10.445  10.669 -13.695
 1035   1HZ   LYS  50          1HZ       LYS  50  11.933  11.261 -15.204
 1036   2HZ   LYS  50          2HZ       LYS  50  11.721   9.782 -15.997
 1037   3HZ   LYS  50          3HZ       LYS  50  12.925   9.946 -14.821
 1038    H    ALA  51           H        ALA  51  15.215  10.999  -9.145
 1039    HA   ALA  51           HA       ALA  51  17.539  11.177 -10.752
 1040   1HB   ALA  51          1HB       ALA  51  16.956  12.993  -9.293
 1041   2HB   ALA  51          2HB       ALA  51  18.518  12.347  -8.789
 1042   3HB   ALA  51          3HB       ALA  51  17.062  11.946  -7.877
 1043    H    ALA  52           H        ALA  52  16.670   9.233  -7.949
 1044    HA   ALA  52           HA       ALA  52  19.280   8.147  -7.546
 1045   1HB   ALA  52          1HB       ALA  52  16.784   6.765  -6.648
 1046   2HB   ALA  52          2HB       ALA  52  17.277   8.284  -5.900
 1047   3HB   ALA  52          3HB       ALA  52  18.349   6.884  -5.843
 1048    H    CYS  53           H        CYS  53  16.515   7.315  -9.491
 1049    HA   CYS  53           HA       CYS  53  17.262   4.645 -10.101
 1050   1HB   CYS  53          1HB       CYS  53  15.397   6.639 -11.360
 1051   2HB   CYS  53          2HB       CYS  53  15.718   5.094 -12.139
 1052    HG   CYS  53           HG       CYS  53  13.849   3.884 -10.882
 1053    H    ALA  54           H        ALA  54  17.710   7.742 -11.760
 1054    HA   ALA  54           HA       ALA  54  19.128   6.632 -13.969
 1055   1HB   ALA  54          1HB       ALA  54  18.960   8.685 -14.837
 1056   2HB   ALA  54          2HB       ALA  54  19.661   9.444 -13.408
 1057   3HB   ALA  54          3HB       ALA  54  17.942   9.049 -13.443
 1058    H    ARG  55           H        ARG  55  20.030   7.934 -10.849
 1059    HA   ARG  55           HA       ARG  55  22.802   8.218 -11.367
 1060   1HB   ARG  55          1HB       ARG  55  21.149   8.933  -9.319
 1061   2HB   ARG  55          2HB       ARG  55  22.016   7.581  -8.602
 1062   1HG   ARG  55          1HG       ARG  55  24.076   8.928  -9.674
 1063   2HG   ARG  55          2HG       ARG  55  22.969  10.263  -9.347
 1064   1HD   ARG  55          1HD       ARG  55  22.750   8.938  -7.032
 1065   2HD   ARG  55          2HD       ARG  55  24.390   8.466  -7.477
 1066    HE   ARG  55           HE       ARG  55  25.071  10.571  -6.940
 1067   1HH1  ARG  55          1HH1      ARG  55  21.646  10.653  -7.577
 1068   2HH1  ARG  55          2HH1      ARG  55  21.476  12.319  -7.139
 1069   1HH2  ARG  55          1HH2      ARG  55  24.855  12.762  -6.362
 1070   2HH2  ARG  55          2HH2      ARG  55  23.299  13.518  -6.448
 1071    H    LYS  56           H        LYS  56  20.827   5.599 -10.071
 1072    HA   LYS  56           HA       LYS  56  23.158   3.891  -9.736
 1073   1HB   LYS  56          1HB       LYS  56  20.661   4.055  -8.485
 1074   2HB   LYS  56          2HB       LYS  56  20.603   2.561  -9.411
 1075   1HG   LYS  56          1HG       LYS  56  21.773   1.547  -7.836
 1076   2HG   LYS  56          2HG       LYS  56  23.114   2.658  -8.116
 1077   1HD   LYS  56          1HD       LYS  56  22.240   4.210  -6.505
 1078   2HD   LYS  56          2HD       LYS  56  20.768   3.255  -6.322
 1079   1HE   LYS  56          1HE       LYS  56  21.936   2.540  -4.492
 1080   2HE   LYS  56          2HE       LYS  56  22.479   1.360  -5.683
 1081   1HZ   LYS  56          1HZ       LYS  56  23.947   3.846  -4.997
 1082   2HZ   LYS  56          2HZ       LYS  56  24.480   2.609  -6.020
 1083   3HZ   LYS  56          3HZ       LYS  56  24.301   2.318  -4.363
 1084    H    GLY  57           H        GLY  57  20.964   4.688 -12.159
 1085   1HA   GLY  57          1HA       GLY  57  20.576   3.834 -14.253
 1086   2HA   GLY  57          2HA       GLY  57  22.059   2.917 -14.041
 1087    H    THR  58           H        THR  58  18.764   2.869 -12.678
 1088    HA   THR  58           HA       THR  58  18.453   0.117 -13.566
 1089    HB   THR  58           HB       THR  58  19.495   0.023 -11.282
 1090    HG1  THR  58           HG1      THR  58  18.136  -1.665 -12.108
 1091   1HG2  THR  58          1HG2      THR  58  17.347   1.857 -10.706
 1092   2HG2  THR  58          2HG2      THR  58  18.723   1.395  -9.704
 1093   3HG2  THR  58          3HG2      THR  58  17.245   0.435  -9.668
 1094    H    SER  59           H        SER  59  16.203  -0.695 -13.066
 1095    HA   SER  59           HA       SER  59  14.310   1.196 -14.005
 1096   1HB   SER  59          1HB       SER  59  13.126  -1.178 -12.802
 1097   2HB   SER  59          2HB       SER  59  13.090  -0.630 -14.478
 1098    HG   SER  59           HG       SER  59  14.445  -2.644 -13.507
 1099    H    ILE  60           H        ILE  60  12.253   1.708 -12.963
 1100    HA   ILE  60           HA       ILE  60  12.641   2.844 -10.397
 1101    HB   ILE  60           HB       ILE  60  11.114   3.801 -12.086
 1102   1HG1  ILE  60          1HG1      ILE  60   9.060   3.850 -10.329
 1103   2HG1  ILE  60          2HG1      ILE  60  10.334   3.224  -9.287
 1104   1HG2  ILE  60          1HG2      ILE  60   8.832   2.123 -11.474
 1105   2HG2  ILE  60          2HG2      ILE  60  10.122   1.224 -12.273
 1106   3HG2  ILE  60          3HG2      ILE  60   9.450   2.667 -13.034
 1107   1HD1  ILE  60          1HD1      ILE  60  10.254   5.599  -9.070
 1108   2HD1  ILE  60          2HD1      ILE  60  10.349   5.811 -10.819
 1109   3HD1  ILE  60          3HD1      ILE  60  11.731   5.168  -9.931
 1110    H    THR  61           H        THR  61  11.451  -0.217 -11.470
 1111    HA   THR  61           HA       THR  61  10.116  -0.830  -8.973
 1112    HB   THR  61           HB       THR  61  10.732  -3.054 -10.808
 1113    HG1  THR  61           HG1      THR  61   8.677  -1.496 -11.779
 1114   1HG2  THR  61          1HG2      THR  61   8.076  -3.048 -10.546
 1115   2HG2  THR  61          2HG2      THR  61   8.486  -2.063  -9.142
 1116   3HG2  THR  61          3HG2      THR  61   9.147  -3.690  -9.300
 1117    H    ASP  62           H        ASP  62  13.230  -1.270 -10.428
 1118    HA   ASP  62           HA       ASP  62  14.086  -3.403  -8.730
 1119   1HB   ASP  62          1HB       ASP  62  15.023  -2.537 -11.052
 1120   2HB   ASP  62          2HB       ASP  62  16.052  -1.559 -10.010
 1121    H    VAL  63           H        VAL  63  14.535   0.119  -8.726
 1122    HA   VAL  63           HA       VAL  63  16.300   0.325  -6.587
 1123    HB   VAL  63           HB       VAL  63  14.915   2.557  -6.159
 1124   1HG1  VAL  63          1HG1      VAL  63  16.620   3.554  -7.214
 1125   2HG1  VAL  63          2HG1      VAL  63  16.305   2.711  -8.731
 1126   3HG1  VAL  63          3HG1      VAL  63  17.218   1.912  -7.453
 1127   1HG2  VAL  63          1HG2      VAL  63  13.047   1.892  -7.600
 1128   2HG2  VAL  63          2HG2      VAL  63  14.148   1.809  -8.977
 1129   3HG2  VAL  63          3HG2      VAL  63  13.838   3.355  -8.185
 1130    H    VAL  64           H        VAL  64  12.764   0.101  -6.589
 1131    HA   VAL  64           HA       VAL  64  12.407   0.469  -3.816
 1132    HB   VAL  64           HB       VAL  64  10.611  -1.300  -5.455
 1133   1HG1  VAL  64          1HG1      VAL  64   9.946  -1.202  -3.202
 1134   2HG1  VAL  64          2HG1      VAL  64   8.895  -0.061  -4.041
 1135   3HG1  VAL  64          3HG1      VAL  64  10.263   0.529  -3.097
 1136   1HG2  VAL  64          1HG2      VAL  64  11.299   0.905  -6.625
 1137   2HG2  VAL  64          2HG2      VAL  64  10.281   1.674  -5.407
 1138   3HG2  VAL  64          3HG2      VAL  64   9.588   0.491  -6.517
 1139    H    ASN  65           H        ASN  65  13.069  -2.366  -5.793
 1140    HA   ASN  65           HA       ASN  65  12.747  -4.275  -3.711
 1141   1HB   ASN  65          1HB       ASN  65  12.681  -4.840  -6.133
 1142   2HB   ASN  65          2HB       ASN  65  14.404  -4.493  -6.236
 1143   1HD2  ASN  65          1HD2      ASN  65  15.037  -6.521  -6.799
 1144   2HD2  ASN  65          2HD2      ASN  65  14.924  -7.884  -5.743
 1145    H    GLN  66           H        GLN  66  15.177  -2.011  -4.488
 1146    HA   GLN  66           HA       GLN  66  17.331  -3.427  -3.189
 1147   1HB   GLN  66          1HB       GLN  66  17.025  -0.874  -4.657
 1148   2HB   GLN  66          2HB       GLN  66  18.283  -0.916  -3.427
 1149   1HG   GLN  66          1HG       GLN  66  18.835  -3.213  -4.655
 1150   2HG   GLN  66          2HG       GLN  66  18.092  -2.352  -6.002
 1151   1HE2  GLN  66          1HE2      GLN  66  19.764  -1.836  -7.245
 1152   2HE2  GLN  66          2HE2      GLN  66  21.147  -0.936  -6.735
 1153    H    LEU  67           H        LEU  67  15.305  -0.582  -2.464
 1154    HA   LEU  67           HA       LEU  67  16.488   0.004   0.019
 1155   1HB   LEU  67          1HB       LEU  67  13.916   0.789   0.418
 1156   2HB   LEU  67          2HB       LEU  67  15.140   1.751  -0.386
 1157    HG   LEU  67           HG       LEU  67  13.971   0.093  -2.359
 1158   1HD1  LEU  67          1HD1      LEU  67  11.937   1.518  -0.650
 1159   2HD1  LEU  67          2HD1      LEU  67  12.088  -0.227  -0.853
 1160   3HD1  LEU  67          3HD1      LEU  67  11.630   0.782  -2.223
 1161   1HD2  LEU  67          1HD2      LEU  67  12.975   2.563  -2.832
 1162   2HD2  LEU  67          2HD2      LEU  67  14.618   2.064  -3.235
 1163   3HD2  LEU  67          3HD2      LEU  67  14.308   2.950  -1.742
 1164    H    VAL  68           H        VAL  68  14.014  -2.267  -0.955
 1165    HA   VAL  68           HA       VAL  68  13.207  -3.018   1.677
 1166    HB   VAL  68           HB       VAL  68  12.997  -4.614  -0.889
 1167   1HG1  VAL  68          1HG1      VAL  68  12.731  -5.974   1.127
 1168   2HG1  VAL  68          2HG1      VAL  68  11.210  -5.823   0.247
 1169   3HG1  VAL  68          3HG1      VAL  68  11.483  -4.872   1.707
 1170   1HG2  VAL  68          1HG2      VAL  68  11.858  -2.209  -0.496
 1171   2HG2  VAL  68          2HG2      VAL  68  10.632  -3.253   0.223
 1172   3HG2  VAL  68          3HG2      VAL  68  11.123  -3.495  -1.454
 1173    H    ASP  69           H        ASP  69  15.737  -3.918  -0.521
 1174    HA   ASP  69           HA       ASP  69  16.517  -6.320   0.828
 1175   1HB   ASP  69          1HB       ASP  69  17.047  -5.243  -1.632
 1176   2HB   ASP  69          2HB       ASP  69  18.551  -4.919  -0.778
 1177    H    ASN  70           H        ASN  70  17.277  -2.936   1.073
 1178    HA   ASN  70           HA       ASN  70  19.576  -3.365   2.781
 1179   1HB   ASN  70          1HB       ASN  70  18.981  -1.386   1.064
 1180   2HB   ASN  70          2HB       ASN  70  18.344  -0.674   2.543
 1181   1HD2  ASN  70          1HD2      ASN  70  20.551   0.241   0.978
 1182   2HD2  ASN  70          2HD2      ASN  70  21.946   0.199   1.995
 1183    H    TRP  71           H        TRP  71  16.240  -3.263   3.180
 1184    HA   TRP  71           HA       TRP  71  16.452  -2.357   5.969
 1185   1HB   TRP  71          1HB       TRP  71  14.800  -1.144   4.662
 1186   2HB   TRP  71          2HB       TRP  71  14.041  -2.651   4.162
 1187    HD1  TRP  71           HD1      TRP  71  14.223  -0.212   7.072
 1188    HE1  TRP  71           HE1      TRP  71  12.404  -0.820   8.789
 1189    HE3  TRP  71           HE3      TRP  71  12.694  -4.670   5.092
 1190    HZ2  TRP  71           HZ2      TRP  71  10.564  -2.912   9.242
 1191    HZ3  TRP  71           HZ3      TRP  71  10.898  -5.911   6.227
 1192    HH2  TRP  71           HH2      TRP  71   9.856  -5.048   8.260
 1193    H    LEU  72           H        LEU  72  15.415  -5.016   3.931
 1194    HA   LEU  72           HA       LEU  72  14.274  -6.583   6.011
 1195   1HB   LEU  72          1HB       LEU  72  14.138  -6.662   3.335
 1196   2HB   LEU  72          2HB       LEU  72  15.345  -7.908   3.590
 1197    HG   LEU  72           HG       LEU  72  13.429  -8.641   5.392
 1198   1HD1  LEU  72          1HD1      LEU  72  11.824  -7.014   4.720
 1199   2HD1  LEU  72          2HD1      LEU  72  11.296  -8.574   4.090
 1200   3HD1  LEU  72          3HD1      LEU  72  12.057  -7.402   3.015
 1201   1HD2  LEU  72          1HD2      LEU  72  12.733 -10.262   3.547
 1202   2HD2  LEU  72          2HD2      LEU  72  14.434 -10.244   4.009
 1203   3HD2  LEU  72          3HD2      LEU  72  13.912  -9.428   2.535
 1204    H    LYS  73           H        LYS  73  17.474  -6.481   4.508
 1205    HA   LYS  73           HA       LYS  73  18.369  -8.707   6.162
 1206   1HB   LYS  73          1HB       LYS  73  20.196  -7.194   4.346
 1207   2HB   LYS  73          2HB       LYS  73  20.194  -8.903   4.756
 1208   1HG   LYS  73          1HG       LYS  73  17.758  -8.395   3.446
 1209   2HG   LYS  73          2HG       LYS  73  19.018  -7.583   2.514
 1210   1HD   LYS  73          1HD       LYS  73  19.580 -10.341   3.443
 1211   2HD   LYS  73          2HD       LYS  73  18.389 -10.149   2.155
 1212   1HE   LYS  73          1HE       LYS  73  21.150  -8.947   2.082
 1213   2HE   LYS  73          2HE       LYS  73  20.743 -10.511   1.375
 1214   1HZ   LYS  73          1HZ       LYS  73  19.600  -7.880   0.611
 1215   2HZ   LYS  73          2HZ       LYS  73  19.095  -9.367  -0.018
 1216   3HZ   LYS  73          3HZ       LYS  73  20.669  -8.819  -0.304
 1217    H    GLU  74           H        GLU  74  18.078  -5.453   6.626
 1218    HA   GLU  74           HA       GLU  74  20.504  -5.334   8.293
 1219   1HB   GLU  74          1HB       GLU  74  18.969  -3.236   6.815
 1220   2HB   GLU  74          2HB       GLU  74  19.895  -2.786   8.241
 1221   1HG   GLU  74          1HG       GLU  74  21.211  -4.379   6.099
 1222   2HG   GLU  74          2HG       GLU  74  20.952  -2.651   5.860
 1223    H    ASN  75           H        ASN  75  17.164  -4.079   8.266
 1224    HA   ASN  75           HA       ASN  75  17.089  -3.449  10.999
 1225   1HB   ASN  75          1HB       ASN  75  15.109  -2.580  10.429
 1226   2HB   ASN  75          2HB       ASN  75  15.365  -3.209   8.806
 1227   1HD2  ASN  75          1HD2      ASN  75  14.687  -5.507   8.488
 1228   2HD2  ASN  75          2HD2      ASN  75  13.224  -6.012   9.254
 1229    H    GLU  76           H        GLU  76  16.674  -6.463   9.334
 1230    HA   GLU  76           HA       GLU  76  15.546  -7.744  11.704
 1231   1HB   GLU  76          1HB       GLU  76  15.507  -8.268   8.862
 1232   2HB   GLU  76          2HB       GLU  76  16.030  -9.693   9.750
 1233   1HG   GLU  76          1HG       GLU  76  13.557  -8.152  10.470
 1234   2HG   GLU  76          2HG       GLU  76  13.555  -9.480   9.311
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1 -68.634   2.150  -2.361
    2   2H    MET   1          2H        MET   1 -67.342   1.512  -1.471
    3   3H    MET   1          3H        MET   1 -68.927   0.998  -1.153
    4    HA   MET   1           HA       MET   1 -67.337  -0.467  -2.561
    5   1HB   MET   1          1HB       MET   1 -70.000  -0.407  -2.119
    6   2HB   MET   1          2HB       MET   1 -69.986  -0.145  -3.859
    7   1HG   MET   1          1HG       MET   1 -68.711  -2.190  -4.174
    8   2HG   MET   1          2HG       MET   1 -68.669  -2.444  -2.429
    9   1HE   MET   1          1HE       MET   1 -69.198  -4.636  -3.687
   10   2HE   MET   1          2HE       MET   1 -70.810  -5.149  -4.183
   11   3HE   MET   1          3HE       MET   1 -70.388  -5.098  -2.471
   12    H    SER   2           H        SER   2 -66.232  -0.567  -4.399
   13    HA   SER   2           HA       SER   2 -65.393  -0.082  -6.449
   14   1HB   SER   2          1HB       SER   2 -67.877   1.568  -6.949
   15   2HB   SER   2          2HB       SER   2 -66.761   0.939  -8.161
   16    HG   SER   2           HG       SER   2 -68.801  -0.328  -6.778
   17    H    LEU   3           H        LEU   3 -67.113   2.987  -5.812
   18    HA   LEU   3           HA       LEU   3 -64.508   4.347  -5.844
   19   1HB   LEU   3          1HB       LEU   3 -67.026   5.042  -6.890
   20   2HB   LEU   3          2HB       LEU   3 -66.760   6.118  -5.532
   21    HG   LEU   3           HG       LEU   3 -64.675   5.757  -7.669
   22   1HD1  LEU   3          1HD1      LEU   3 -66.455   6.473  -8.980
   23   2HD1  LEU   3          2HD1      LEU   3 -65.661   7.979  -8.519
   24   3HD1  LEU   3          3HD1      LEU   3 -67.131   7.468  -7.690
   25   1HD2  LEU   3          1HD2      LEU   3 -63.948   6.806  -5.603
   26   2HD2  LEU   3          2HD2      LEU   3 -65.279   7.960  -5.700
   27   3HD2  LEU   3          3HD2      LEU   3 -63.996   7.992  -6.909
   28    H    GLU   4           H        GLU   4 -63.586   4.722  -3.964
   29    HA   GLU   4           HA       GLU   4 -65.105   4.477  -1.505
   30   1HB   GLU   4          1HB       GLU   4 -62.390   4.110  -2.301
   31   2HB   GLU   4          2HB       GLU   4 -62.422   5.324  -1.031
   32   1HG   GLU   4          1HG       GLU   4 -63.304   2.468  -0.928
   33   2HG   GLU   4          2HG       GLU   4 -62.143   3.312   0.095
   34    H    LYS   5           H        LYS   5 -64.876   6.101   0.209
   35    HA   LYS   5           HA       LYS   5 -65.266   8.795  -0.793
   36   1HB   LYS   5          1HB       LYS   5 -65.493   7.435   1.854
   37   2HB   LYS   5          2HB       LYS   5 -65.231   9.173   1.839
   38   1HG   LYS   5          1HG       LYS   5 -67.226   9.237   0.208
   39   2HG   LYS   5          2HG       LYS   5 -67.565   7.614   0.811
   40   1HD   LYS   5          1HD       LYS   5 -67.023   9.669   2.858
   41   2HD   LYS   5          2HD       LYS   5 -68.522   9.863   1.949
   42   1HE   LYS   5          1HE       LYS   5 -69.225   8.541   3.691
   43   2HE   LYS   5          2HE       LYS   5 -68.834   7.326   2.474
   44   1HZ   LYS   5          1HZ       LYS   5 -67.940   7.215   4.958
   45   2HZ   LYS   5          2HZ       LYS   5 -66.676   8.110   4.269
   46   3HZ   LYS   5          3HZ       LYS   5 -67.070   6.586   3.643
   47    H    ALA   6           H        ALA   6 -62.919   6.938   1.020
   48    HA   ALA   6           HA       ALA   6 -60.995   9.148   0.874
   49   1HB   ALA   6          1HB       ALA   6 -61.389   6.917   2.703
   50   2HB   ALA   6          2HB       ALA   6 -60.500   8.425   2.931
   51   3HB   ALA   6          3HB       ALA   6 -59.722   7.052   2.137
   52    H    HIS   7           H        HIS   7 -60.120   9.183  -1.088
   53    HA   HIS   7           HA       HIS   7 -58.791   6.776  -2.055
   54   1HB   HIS   7          1HB       HIS   7 -59.647   7.104  -4.365
   55   2HB   HIS   7          2HB       HIS   7 -60.909   6.658  -3.226
   56    HD1  HIS   7           HD1      HIS   7 -60.557   8.689  -6.016
   57    HD2  HIS   7           HD2      HIS   7 -62.093   9.382  -2.208
   58    HE1  HIS   7           HE1      HIS   7 -62.071  10.688  -6.240
   59    HE2  HIS   7           HE2      HIS   7 -62.974  11.106  -3.923
   60    H    THR   8           H        THR   8 -56.776   7.350  -2.239
   61    HA   THR   8           HA       THR   8 -56.089  10.134  -2.678
   62    HB   THR   8           HB       THR   8 -53.899   8.201  -2.347
   63    HG1  THR   8           HG1      THR   8 -55.961   8.495  -0.391
   64   1HG2  THR   8          1HG2      THR   8 -53.042   9.821  -0.890
   65   2HG2  THR   8          2HG2      THR   8 -54.637  10.493  -0.553
   66   3HG2  THR   8          3HG2      THR   8 -53.881  10.763  -2.124
   67    H    SER   9           H        SER   9 -56.002   7.100  -4.346
   68    HA   SER   9           HA       SER   9 -55.306   6.464  -6.408
   69   1HB   SER   9          1HB       SER   9 -55.259   9.293  -7.374
   70   2HB   SER   9          2HB       SER   9 -55.934   7.854  -8.137
   71    HG   SER   9           HG       SER   9 -57.058   9.592  -6.268
   72    H    VAL  10           H        VAL  10 -53.727   8.291  -8.231
   73    HA   VAL  10           HA       VAL  10 -51.122   7.785  -7.006
   74    HB   VAL  10           HB       VAL  10 -50.400   8.676  -9.406
   75   1HG1  VAL  10          1HG1      VAL  10 -50.239   6.349  -8.224
   76   2HG1  VAL  10          2HG1      VAL  10 -49.962   6.490  -9.957
   77   3HG1  VAL  10          3HG1      VAL  10 -51.517   5.913  -9.358
   78   1HG2  VAL  10          1HG2      VAL  10 -53.160   7.561  -9.896
   79   2HG2  VAL  10          2HG2      VAL  10 -51.972   7.968 -11.137
   80   3HG2  VAL  10          3HG2      VAL  10 -52.664   9.238 -10.127
   81    H    LYS  11           H        LYS  11 -50.078   9.358  -6.017
   82    HA   LYS  11           HA       LYS  11 -50.596  12.137  -6.852
   83   1HB   LYS  11          1HB       LYS  11 -50.337  11.059  -4.041
   84   2HB   LYS  11          2HB       LYS  11 -50.284  12.770  -4.436
   85   1HG   LYS  11          1HG       LYS  11 -52.606  10.966  -5.071
   86   2HG   LYS  11          2HG       LYS  11 -52.486  11.960  -3.619
   87   1HD   LYS  11          1HD       LYS  11 -52.839  13.905  -4.755
   88   2HD   LYS  11          2HD       LYS  11 -52.082  13.305  -6.233
   89   1HE   LYS  11          1HE       LYS  11 -54.237  13.269  -6.939
   90   2HE   LYS  11          2HE       LYS  11 -54.197  11.684  -6.170
   91   1HZ   LYS  11          1HZ       LYS  11 -55.601  14.092  -5.376
   92   2HZ   LYS  11          2HZ       LYS  11 -54.869  13.237  -4.108
   93   3HZ   LYS  11          3HZ       LYS  11 -55.998  12.467  -5.111
   94    H    LYS  12           H        LYS  12 -48.855  13.565  -6.674
   95    HA   LYS  12           HA       LYS  12 -46.238  12.255  -6.698
   96   1HB   LYS  12          1HB       LYS  12 -47.435  14.475  -8.083
   97   2HB   LYS  12          2HB       LYS  12 -45.975  15.008  -7.262
   98   1HG   LYS  12          1HG       LYS  12 -44.637  13.450  -8.428
   99   2HG   LYS  12          2HG       LYS  12 -46.051  12.591  -9.040
  100   1HD   LYS  12          1HD       LYS  12 -45.851  15.466  -9.709
  101   2HD   LYS  12          2HD       LYS  12 -44.689  14.389 -10.486
  102   1HE   LYS  12          1HE       LYS  12 -46.328  13.209 -11.605
  103   2HE   LYS  12          2HE       LYS  12 -47.586  13.660 -10.455
  104   1HZ   LYS  12          1HZ       LYS  12 -48.120  14.981 -12.220
  105   2HZ   LYS  12          2HZ       LYS  12 -46.512  15.170 -12.729
  106   3HZ   LYS  12          3HZ       LYS  12 -47.086  16.037 -11.388
  107    H    MET  13           H        MET  13 -44.483  13.051  -5.465
  108    HA   MET  13           HA       MET  13 -45.240  14.781  -3.204
  109   1HB   MET  13          1HB       MET  13 -44.793  12.145  -2.880
  110   2HB   MET  13          2HB       MET  13 -43.141  12.734  -2.747
  111   1HG   MET  13          1HG       MET  13 -43.701  12.904  -0.574
  112   2HG   MET  13          2HG       MET  13 -44.340  14.459  -1.102
  113   1HE   MET  13          1HE       MET  13 -47.907  14.251  -1.344
  114   2HE   MET  13          2HE       MET  13 -46.381  15.129  -1.423
  115   3HE   MET  13          3HE       MET  13 -47.177  14.882   0.129
  116    H    THR  14           H        THR  14 -44.299  16.065  -5.216
  117    HA   THR  14           HA       THR  14 -41.454  16.113  -5.432
  118    HB   THR  14           HB       THR  14 -42.969  18.467  -6.350
  119    HG1  THR  14           HG1      THR  14 -44.211  17.377  -7.799
  120   1HG2  THR  14          1HG2      THR  14 -41.512  18.406  -8.115
  121   2HG2  THR  14          2HG2      THR  14 -41.453  16.643  -8.143
  122   3HG2  THR  14          3HG2      THR  14 -40.544  17.536  -6.922
  123    H    PHE  15           H        PHE  15 -40.009  17.335  -4.373
  124    HA   PHE  15           HA       PHE  15 -40.810  18.676  -1.986
  125   1HB   PHE  15          1HB       PHE  15 -38.720  17.581  -1.896
  126   2HB   PHE  15          2HB       PHE  15 -38.183  18.293  -3.409
  127    HD1  PHE  15           HD1      PHE  15 -36.746  20.082  -3.369
  128    HD2  PHE  15           HD2      PHE  15 -39.117  19.254   0.066
  129    HE1  PHE  15           HE1      PHE  15 -35.542  21.823  -2.123
  130    HE2  PHE  15           HE2      PHE  15 -37.921  21.001   1.317
  131    HZ   PHE  15           HZ       PHE  15 -36.129  22.291   0.222
  132    H    GLY  16           H        GLY  16 -39.803  19.673  -5.185
  133   1HA   GLY  16          1HA       GLY  16 -41.118  21.860  -5.699
  134   2HA   GLY  16          2HA       GLY  16 -40.096  22.496  -4.416
  135    H    GLU  17           H        GLU  17 -37.699  21.324  -4.927
  136    HA   GLU  17           HA       GLU  17 -37.007  21.584  -7.704
  137   1HB   GLU  17          1HB       GLU  17 -36.815  23.879  -6.023
  138   2HB   GLU  17          2HB       GLU  17 -35.182  23.332  -6.378
  139   1HG   GLU  17          1HG       GLU  17 -36.251  23.206  -8.839
  140   2HG   GLU  17          2HG       GLU  17 -37.222  24.507  -8.152
  141    H    ASN  18           H        ASN  18 -34.988  20.726  -8.179
  142    HA   ASN  18           HA       ASN  18 -33.844  18.945  -6.212
  143   1HB   ASN  18          1HB       ASN  18 -33.895  18.218  -8.529
  144   2HB   ASN  18          2HB       ASN  18 -33.039  19.664  -9.045
  145   1HD2  ASN  18          1HD2      ASN  18 -31.430  18.456 -10.018
  146   2HD2  ASN  18          2HD2      ASN  18 -30.223  17.606  -9.103
  147    H    ARG  19           H        ARG  19 -33.116  21.958  -7.819
  148    HA   ARG  19           HA       ARG  19 -31.664  23.651  -7.407
  149   1HB   ARG  19          1HB       ARG  19 -33.098  23.253  -5.194
  150   2HB   ARG  19          2HB       ARG  19 -31.503  22.923  -4.531
  151   1HG   ARG  19          1HG       ARG  19 -30.724  25.098  -5.176
  152   2HG   ARG  19          2HG       ARG  19 -32.239  25.431  -6.018
  153   1HD   ARG  19          1HD       ARG  19 -33.242  26.083  -4.136
  154   2HD   ARG  19          2HD       ARG  19 -32.684  24.656  -3.262
  155    HE   ARG  19           HE       ARG  19 -31.074  25.940  -2.304
  156   1HH1  ARG  19          1HH1      ARG  19 -32.210  27.584  -5.179
  157   2HH1  ARG  19          2HH1      ARG  19 -31.102  28.917  -5.024
  158   1HH2  ARG  19          1HH2      ARG  19 -29.619  27.693  -2.069
  159   2HH2  ARG  19          2HH2      ARG  19 -29.614  28.979  -3.247
  160    H    ASP  20           H        ASP  20 -30.177  21.980  -8.551
  161    HA   ASP  20           HA       ASP  20 -27.990  21.010  -6.913
  162   1HB   ASP  20          1HB       ASP  20 -28.980  20.078  -9.210
  163   2HB   ASP  20          2HB       ASP  20 -27.763  21.161  -9.884
  164    H    LEU  21           H        LEU  21 -27.952  23.421  -6.198
  165    HA   LEU  21           HA       LEU  21 -26.126  24.939  -7.941
  166   1HB   LEU  21          1HB       LEU  21 -28.589  25.673  -7.053
  167   2HB   LEU  21          2HB       LEU  21 -27.572  26.353  -5.799
  168    HG   LEU  21           HG       LEU  21 -26.352  27.117  -8.196
  169   1HD1  LEU  21          1HD1      LEU  21 -28.015  28.038  -9.576
  170   2HD1  LEU  21          2HD1      LEU  21 -29.280  27.761  -8.380
  171   3HD1  LEU  21          3HD1      LEU  21 -28.560  26.397  -9.232
  172   1HD2  LEU  21          1HD2      LEU  21 -26.291  28.983  -6.997
  173   2HD2  LEU  21          2HD2      LEU  21 -27.404  28.259  -5.834
  174   3HD2  LEU  21          3HD2      LEU  21 -28.031  29.192  -7.193
  175    H    GLU  22           H        GLU  22 -25.859  22.976  -5.477
  176    HA   GLU  22           HA       GLU  22 -24.296  24.704  -3.728
  177   1HB   GLU  22          1HB       GLU  22 -25.835  22.317  -3.377
  178   2HB   GLU  22          2HB       GLU  22 -24.183  22.014  -2.854
  179   1HG   GLU  22          1HG       GLU  22 -25.769  24.394  -1.940
  180   2HG   GLU  22          2HG       GLU  22 -25.777  22.846  -1.093
  181    H    ARG  23           H        ARG  23 -22.125  24.311  -3.216
  182    HA   ARG  23           HA       ARG  23 -20.670  22.388  -4.862
  183   1HB   ARG  23          1HB       ARG  23 -20.678  25.264  -5.299
  184   2HB   ARG  23          2HB       ARG  23 -19.061  24.663  -4.964
  185   1HG   ARG  23          1HG       ARG  23 -18.974  24.230  -7.147
  186   2HG   ARG  23          2HG       ARG  23 -19.981  22.833  -6.767
  187   1HD   ARG  23          1HD       ARG  23 -20.946  24.059  -8.610
  188   2HD   ARG  23          2HD       ARG  23 -21.988  24.192  -7.194
  189    HE   ARG  23           HE       ARG  23 -20.098  26.362  -7.531
  190   1HH1  ARG  23          1HH1      ARG  23 -23.306  25.172  -8.316
  191   2HH1  ARG  23          2HH1      ARG  23 -23.974  26.765  -8.513
  192   1HH2  ARG  23          1HH2      ARG  23 -20.989  28.449  -7.816
  193   2HH2  ARG  23          2HH2      ARG  23 -22.672  28.619  -8.225
  194    H    VAL  24           H        VAL  24 -18.652  21.800  -4.001
  195    HA   VAL  24           HA       VAL  24 -18.425  22.252  -1.148
  196    HB   VAL  24           HB       VAL  24 -16.532  20.661  -2.881
  197   1HG1  VAL  24          1HG1      VAL  24 -15.720  21.161  -0.641
  198   2HG1  VAL  24          2HG1      VAL  24 -16.088  19.444  -0.801
  199   3HG1  VAL  24          3HG1      VAL  24 -17.202  20.506   0.057
  200   1HG2  VAL  24          1HG2      VAL  24 -18.023  19.031  -3.132
  201   2HG2  VAL  24          2HG2      VAL  24 -19.251  20.155  -2.551
  202   3HG2  VAL  24          3HG2      VAL  24 -18.443  19.071  -1.420
  203    H    VAL  25           H        VAL  25 -17.949  24.513  -1.234
  204    HA   VAL  25           HA       VAL  25 -15.423  25.337  -2.400
  205    HB   VAL  25           HB       VAL  25 -17.464  26.884  -0.786
  206   1HG1  VAL  25          1HG1      VAL  25 -14.758  27.551  -1.570
  207   2HG1  VAL  25          2HG1      VAL  25 -15.865  28.405  -0.494
  208   3HG1  VAL  25          3HG1      VAL  25 -15.933  28.687  -2.235
  209   1HG2  VAL  25          1HG2      VAL  25 -18.066  26.036  -3.121
  210   2HG2  VAL  25          2HG2      VAL  25 -16.869  27.186  -3.714
  211   3HG2  VAL  25          3HG2      VAL  25 -18.269  27.759  -2.809
  212    H    THR  26           H        THR  26 -16.837  24.692   0.736
  213    HA   THR  26           HA       THR  26 -14.501  25.527   2.206
  214    HB   THR  26           HB       THR  26 -16.247  23.870   3.764
  215    HG1  THR  26           HG1      THR  26 -17.801  25.987   2.886
  216   1HG2  THR  26          1HG2      THR  26 -16.500  25.848   5.088
  217   2HG2  THR  26          2HG2      THR  26 -16.010  26.879   3.746
  218   3HG2  THR  26          3HG2      THR  26 -14.834  25.809   4.509
  219    H    ALA  27           H        ALA  27 -13.354  23.917   0.590
  220    HA   ALA  27           HA       ALA  27 -13.221  21.261   1.850
  221   1HB   ALA  27          1HB       ALA  27 -13.802  20.953  -0.406
  222   2HB   ALA  27          2HB       ALA  27 -12.073  20.617  -0.332
  223   3HB   ALA  27          3HB       ALA  27 -12.644  22.164  -0.955
  224    HA   PRO  28           HA       PRO  28  -9.299  22.887   3.317
  225   1HB   PRO  28          1HB       PRO  28  -8.758  20.823   4.989
  226   2HB   PRO  28          2HB       PRO  28  -9.898  22.111   5.395
  227   1HG   PRO  28          1HG       PRO  28 -10.449  19.353   4.369
  228   2HG   PRO  28          2HG       PRO  28 -11.286  20.268   5.639
  229   1HD   PRO  28          1HD       PRO  28 -12.246  20.045   3.111
  230   2HD   PRO  28          2HD       PRO  28 -12.534  21.468   4.130
  231    H    VAL  29           H        VAL  29  -7.250  22.572   2.636
  232    HA   VAL  29           HA       VAL  29  -6.713  20.645   0.624
  233    HB   VAL  29           HB       VAL  29  -5.593  22.790   0.575
  234   1HG1  VAL  29          1HG1      VAL  29  -5.488  22.849   3.171
  235   2HG1  VAL  29          2HG1      VAL  29  -4.251  23.677   2.227
  236   3HG1  VAL  29          3HG1      VAL  29  -3.908  22.103   2.944
  237   1HG2  VAL  29          1HG2      VAL  29  -4.441  20.539  -0.120
  238   2HG2  VAL  29          2HG2      VAL  29  -3.332  20.957   1.188
  239   3HG2  VAL  29          3HG2      VAL  29  -3.555  22.065  -0.168
  240    H    SER  30           H        SER  30  -5.884  18.654   0.757
  241    HA   SER  30           HA       SER  30  -5.130  17.698   3.438
  242   1HB   SER  30          1HB       SER  30  -5.965  15.760   1.350
  243   2HB   SER  30          2HB       SER  30  -6.325  15.780   3.077
  244    HG   SER  30           HG       SER  30  -7.633  17.054   0.948
  245    H    SER  31           H        SER  31  -3.446  18.873   1.257
  246    HA   SER  31           HA       SER  31  -1.403  18.592   0.311
  247   1HB   SER  31          1HB       SER  31  -1.024  16.231   2.151
  248   2HB   SER  31          2HB       SER  31   0.202  17.332   1.526
  249    HG   SER  31           HG       SER  31  -1.701  18.693   2.891
  250    H    GLY  32           H        GLY  32  -2.684  17.899  -1.595
  251   1HA   GLY  32          1HA       GLY  32  -2.819  15.061  -2.164
  252   2HA   GLY  32          2HA       GLY  32  -3.314  16.370  -3.229
  253    H    LYS  33           H        LYS  33  -0.253  15.440  -1.701
  254    HA   LYS  33           HA       LYS  33   0.994  15.527  -4.367
  255   1HB   LYS  33          1HB       LYS  33   3.114  15.798  -2.690
  256   2HB   LYS  33          2HB       LYS  33   2.265  17.147  -3.428
  257   1HG   LYS  33          1HG       LYS  33   1.028  17.568  -1.453
  258   2HG   LYS  33          2HG       LYS  33   1.538  16.042  -0.731
  259   1HD   LYS  33          1HD       LYS  33   3.891  16.897  -0.803
  260   2HD   LYS  33          2HD       LYS  33   3.238  18.460  -1.293
  261   1HE   LYS  33          1HE       LYS  33   3.180  18.886   0.912
  262   2HE   LYS  33          2HE       LYS  33   1.717  17.902   0.890
  263   1HZ   LYS  33          1HZ       LYS  33   3.666  16.053   1.127
  264   2HZ   LYS  33          2HZ       LYS  33   2.779  16.693   2.420
  265   3HZ   LYS  33          3HZ       LYS  33   4.300  17.337   2.035
  266    H    ILE  34           H        ILE  34  -0.080  13.258  -4.054
  267    HA   ILE  34           HA       ILE  34   1.863  11.439  -2.795
  268    HB   ILE  34           HB       ILE  34  -0.962  10.649  -3.390
  269   1HG1  ILE  34          1HG1      ILE  34  -0.663  11.497  -0.646
  270   2HG1  ILE  34          2HG1      ILE  34  -0.342  12.837  -1.742
  271   1HG2  ILE  34          1HG2      ILE  34   1.028   9.850  -1.268
  272   2HG2  ILE  34          2HG2      ILE  34   0.576   8.918  -2.696
  273   3HG2  ILE  34          3HG2      ILE  34  -0.608   9.203  -1.420
  274   1HD1  ILE  34          1HD1      ILE  34  -2.715  12.585  -0.962
  275   2HD1  ILE  34          2HD1      ILE  34  -2.797  11.121  -1.938
  276   3HD1  ILE  34          3HD1      ILE  34  -2.490  12.677  -2.707
  277    H    LYS  35           H        LYS  35   2.545   9.671  -3.909
  278    HA   LYS  35           HA       LYS  35   1.683   9.412  -6.716
  279   1HB   LYS  35          1HB       LYS  35   4.472   8.798  -5.745
  280   2HB   LYS  35          2HB       LYS  35   3.918   9.029  -7.400
  281   1HG   LYS  35          1HG       LYS  35   3.500  11.356  -5.689
  282   2HG   LYS  35          2HG       LYS  35   5.195  10.897  -5.881
  283   1HD   LYS  35          1HD       LYS  35   4.831  12.355  -7.655
  284   2HD   LYS  35          2HD       LYS  35   4.643  10.764  -8.394
  285   1HE   LYS  35          1HE       LYS  35   2.362  10.987  -8.608
  286   2HE   LYS  35          2HE       LYS  35   2.244  12.150  -7.287
  287   1HZ   LYS  35          1HZ       LYS  35   1.889  13.238  -9.398
  288   2HZ   LYS  35          2HZ       LYS  35   3.374  12.671  -9.986
  289   3HZ   LYS  35          3HZ       LYS  35   3.338  13.794  -8.712
  290    H    ARG  36           H        ARG  36   1.862   7.228  -7.583
  291    HA   ARG  36           HA       ARG  36   1.648   5.207  -5.443
  292   1HB   ARG  36          1HB       ARG  36   0.169   5.422  -8.067
  293   2HB   ARG  36          2HB       ARG  36   0.126   3.994  -7.039
  294   1HG   ARG  36          1HG       ARG  36  -0.922   5.217  -5.274
  295   2HG   ARG  36          2HG       ARG  36  -0.722   6.737  -6.148
  296   1HD   ARG  36          1HD       ARG  36  -2.842   6.332  -6.792
  297   2HD   ARG  36          2HD       ARG  36  -2.060   5.303  -7.992
  298    HE   ARG  36           HE       ARG  36  -3.154   4.311  -5.431
  299   1HH1  ARG  36          1HH1      ARG  36  -2.527   3.941  -8.859
  300   2HH1  ARG  36          2HH1      ARG  36  -3.274   2.375  -8.956
  301   1HH2  ARG  36          1HH2      ARG  36  -4.111   2.230  -5.557
  302   2HH2  ARG  36          2HH2      ARG  36  -4.163   1.402  -7.093
  303    H    VAL  37           H        VAL  37   2.850   3.416  -5.568
  304    HA   VAL  37           HA       VAL  37   4.160   2.734  -8.099
  305    HB   VAL  37           HB       VAL  37   5.496   3.752  -5.709
  306   1HG1  VAL  37          1HG1      VAL  37   5.851   1.284  -5.402
  307   2HG1  VAL  37          2HG1      VAL  37   7.322   2.245  -5.565
  308   3HG1  VAL  37          3HG1      VAL  37   6.732   1.294  -6.931
  309   1HG2  VAL  37          1HG2      VAL  37   6.933   3.134  -8.228
  310   2HG2  VAL  37          2HG2      VAL  37   6.979   4.579  -7.218
  311   3HG2  VAL  37          3HG2      VAL  37   5.613   4.303  -8.300
  312    H    ASN  38           H        ASN  38   4.062   0.614  -8.515
  313    HA   ASN  38           HA       ASN  38   3.214  -1.161  -6.322
  314   1HB   ASN  38          1HB       ASN  38   1.621  -0.952  -8.222
  315   2HB   ASN  38          2HB       ASN  38   2.866  -1.565  -9.305
  316   1HD2  ASN  38          1HD2      ASN  38   0.335  -2.368  -7.233
  317   2HD2  ASN  38          2HD2      ASN  38   0.584  -4.085  -7.172
  318    H    VAL  39           H        VAL  39   4.497  -2.790  -5.725
  319    HA   VAL  39           HA       VAL  39   6.868  -3.324  -7.402
  320    HB   VAL  39           HB       VAL  39   7.196  -3.884  -4.550
  321   1HG1  VAL  39          1HG1      VAL  39   8.876  -2.140  -6.328
  322   2HG1  VAL  39          2HG1      VAL  39   8.925  -3.900  -6.415
  323   3HG1  VAL  39          3HG1      VAL  39   9.371  -3.078  -4.920
  324   1HG2  VAL  39          1HG2      VAL  39   7.023  -0.995  -5.393
  325   2HG2  VAL  39          2HG2      VAL  39   7.395  -1.622  -3.787
  326   3HG2  VAL  39          3HG2      VAL  39   5.781  -1.833  -4.468
  327    H    ASN  40           H        ASN  40   7.755  -5.410  -7.345
  328    HA   ASN  40           HA       ASN  40   5.952  -7.523  -6.359
  329   1HB   ASN  40          1HB       ASN  40   6.276  -7.197  -8.920
  330   2HB   ASN  40          2HB       ASN  40   7.868  -7.895  -8.650
  331   1HD2  ASN  40          1HD2      ASN  40   7.208  -9.578 -10.064
  332   2HD2  ASN  40          2HD2      ASN  40   6.216 -10.874  -9.476
  333    H    PHE  41           H        PHE  41   6.839  -8.374  -4.588
  334    HA   PHE  41           HA       PHE  41   9.771  -8.419  -4.348
  335   1HB   PHE  41          1HB       PHE  41   7.672  -8.793  -2.205
  336   2HB   PHE  41          2HB       PHE  41   9.404  -8.660  -1.945
  337    HD1  PHE  41           HD1      PHE  41  10.465  -6.436  -2.973
  338    HD2  PHE  41           HD2      PHE  41   6.395  -6.950  -1.838
  339    HE1  PHE  41           HE1      PHE  41  10.226  -3.999  -2.725
  340    HE2  PHE  41           HE2      PHE  41   6.152  -4.516  -1.586
  341    HZ   PHE  41           HZ       PHE  41   8.068  -3.037  -2.028
  342    H    ASP  42           H        ASP  42  10.855 -10.218  -3.548
  343    HA   ASP  42           HA       ASP  42  10.082 -12.793  -4.388
  344   1HB   ASP  42          1HB       ASP  42  12.420 -11.989  -3.822
  345   2HB   ASP  42          2HB       ASP  42  11.980 -12.113  -2.128
  346    H    GLU  43           H        GLU  43   9.309 -14.566  -3.190
  347    HA   GLU  43           HA       GLU  43   7.296 -14.081  -1.292
  348   1HB   GLU  43          1HB       GLU  43   8.551 -16.394  -2.534
  349   2HB   GLU  43          2HB       GLU  43   8.151 -16.697  -0.848
  350   1HG   GLU  43          1HG       GLU  43   6.066 -15.426  -2.507
  351   2HG   GLU  43          2HG       GLU  43   6.446 -17.113  -2.848
  352    H    GLU  44           H        GLU  44  10.681 -14.894  -1.004
  353    HA   GLU  44           HA       GLU  44  10.925 -15.326   1.732
  354   1HB   GLU  44          1HB       GLU  44  12.642 -15.348  -0.299
  355   2HB   GLU  44          2HB       GLU  44  12.994 -13.734   0.305
  356   1HG   GLU  44          1HG       GLU  44  14.439 -15.628   1.166
  357   2HG   GLU  44          2HG       GLU  44  13.738 -14.555   2.373
  358    H    LYS  45           H        LYS  45  11.393 -12.285  -0.060
  359    HA   LYS  45           HA       LYS  45  11.765 -10.644   2.168
  360   1HB   LYS  45          1HB       LYS  45  10.754 -10.029  -0.605
  361   2HB   LYS  45          2HB       LYS  45  11.039  -8.785   0.602
  362   1HG   LYS  45          1HG       LYS  45  13.393  -9.457   0.722
  363   2HG   LYS  45          2HG       LYS  45  13.096 -10.659  -0.538
  364   1HD   LYS  45          1HD       LYS  45  13.069  -9.119  -2.171
  365   2HD   LYS  45          2HD       LYS  45  12.164  -7.963  -1.192
  366   1HE   LYS  45          1HE       LYS  45  14.007  -6.831  -0.724
  367   2HE   LYS  45          2HE       LYS  45  14.807  -8.289  -0.132
  368   1HZ   LYS  45          1HZ       LYS  45  16.132  -7.584  -1.895
  369   2HZ   LYS  45          2HZ       LYS  45  14.802  -7.173  -2.869
  370   3HZ   LYS  45          3HZ       LYS  45  15.180  -8.801  -2.595
  371    H    HIS  46           H        HIS  46   8.820 -11.623   0.478
  372    HA   HIS  46           HA       HIS  46   7.190  -9.734   1.850
  373   1HB   HIS  46          1HB       HIS  46   6.721 -11.041  -0.370
  374   2HB   HIS  46          2HB       HIS  46   6.005 -12.229   0.717
  375    HD1  HIS  46           HD1      HIS  46   3.727 -11.690   1.699
  376    HD2  HIS  46           HD2      HIS  46   5.426  -8.489  -0.341
  377    HE1  HIS  46           HE1      HIS  46   1.932  -9.935   1.576
  378    HE2  HIS  46           HE2      HIS  46   2.896  -8.137   0.100
  379    H    THR  47           H        THR  47   8.014 -13.103   2.443
  380    HA   THR  47           HA       THR  47   6.192 -13.495   4.583
  381    HB   THR  47           HB       THR  47   8.843 -14.875   4.107
  382    HG1  THR  47           HG1      THR  47   7.829 -16.088   2.662
  383   1HG2  THR  47          1HG2      THR  47   7.681 -15.116   6.375
  384   2HG2  THR  47          2HG2      THR  47   8.090 -16.600   5.514
  385   3HG2  THR  47          3HG2      THR  47   6.431 -16.002   5.502
  386    H    ARG  48           H        ARG  48   9.560 -12.411   4.402
  387    HA   ARG  48           HA       ARG  48   9.868 -12.046   7.220
  388   1HB   ARG  48          1HB       ARG  48  11.519 -11.850   4.931
  389   2HB   ARG  48          2HB       ARG  48  11.570 -10.283   5.731
  390   1HG   ARG  48          1HG       ARG  48  11.907 -11.798   7.871
  391   2HG   ARG  48          2HG       ARG  48  12.530 -12.927   6.668
  392   1HD   ARG  48          1HD       ARG  48  13.602 -10.361   6.113
  393   2HD   ARG  48          2HD       ARG  48  13.814 -10.679   7.835
  394    HE   ARG  48           HE       ARG  48  14.863 -12.356   5.634
  395   1HH1  ARG  48          1HH1      ARG  48  14.840 -11.399   9.004
  396   2HH1  ARG  48          2HH1      ARG  48  16.339 -12.208   9.374
  397   1HH2  ARG  48          1HH2      ARG  48  16.804 -13.471   6.137
  398   2HH2  ARG  48          2HH2      ARG  48  17.447 -13.388   7.750
  399    H    PHE  49           H        PHE  49   8.657 -10.097   4.589
  400    HA   PHE  49           HA       PHE  49   8.661  -7.558   5.752
  401   1HB   PHE  49          1HB       PHE  49   7.437  -8.846   3.499
  402   2HB   PHE  49          2HB       PHE  49   6.231  -7.860   4.314
  403    HD1  PHE  49           HD1      PHE  49   9.357  -6.435   4.920
  404    HD2  PHE  49           HD2      PHE  49   6.421  -6.875   1.877
  405    HE1  PHE  49           HE1      PHE  49  10.235  -4.436   3.790
  406    HE2  PHE  49           HE2      PHE  49   7.287  -4.874   0.740
  407    HZ   PHE  49           HZ       PHE  49   9.199  -3.651   1.696
  408    H    LYS  50           H        LYS  50   6.134 -10.033   5.746
  409    HA   LYS  50           HA       LYS  50   4.309  -8.702   7.402
  410   1HB   LYS  50          1HB       LYS  50   4.706 -11.682   7.069
  411   2HB   LYS  50          2HB       LYS  50   3.262 -10.895   7.691
  412   1HG   LYS  50          1HG       LYS  50   4.307 -10.327   4.937
  413   2HG   LYS  50          2HG       LYS  50   3.229 -11.684   5.269
  414   1HD   LYS  50          1HD       LYS  50   2.471  -8.979   6.259
  415   2HD   LYS  50          2HD       LYS  50   2.287  -9.333   4.540
  416   1HE   LYS  50          1HE       LYS  50   0.243 -10.021   5.274
  417   2HE   LYS  50          2HE       LYS  50   1.144 -11.521   5.486
  418   1HZ   LYS  50          1HZ       LYS  50   1.163  -9.683   7.745
  419   2HZ   LYS  50          2HZ       LYS  50   1.047 -11.375   7.719
  420   3HZ   LYS  50          3HZ       LYS  50  -0.323 -10.428   7.397
  421    H    ALA  51           H        ALA  51   6.882 -11.009   8.145
  422    HA   ALA  51           HA       ALA  51   6.342 -11.229  10.905
  423   1HB   ALA  51          1HB       ALA  51   7.682 -12.929  10.180
  424   2HB   ALA  51          2HB       ALA  51   8.897 -11.865  10.885
  425   3HB   ALA  51          3HB       ALA  51   8.646 -11.880   9.139
  426    H    ALA  52           H        ALA  52   8.698  -9.220   9.135
  427    HA   ALA  52           HA       ALA  52   9.759  -7.991  11.432
  428   1HB   ALA  52          1HB       ALA  52  10.922  -8.064   9.281
  429   2HB   ALA  52          2HB       ALA  52  10.804  -6.421   9.911
  430   3HB   ALA  52          3HB       ALA  52   9.734  -6.945   8.610
  431    H    CYS  53           H        CYS  53   7.276  -6.850   9.121
  432    HA   CYS  53           HA       CYS  53   6.906  -4.343  10.275
  433   1HB   CYS  53          1HB       CYS  53   5.001  -4.121   8.920
  434   2HB   CYS  53          2HB       CYS  53   6.048  -5.211   8.024
  435    HG   CYS  53           HG       CYS  53   3.025  -5.772   9.394
  436    H    ALA  54           H        ALA  54   5.386  -7.450  11.009
  437    HA   ALA  54           HA       ALA  54   3.487  -6.447  12.862
  438   1HB   ALA  54          1HB       ALA  54   2.907  -8.553  12.193
  439   2HB   ALA  54          2HB       ALA  54   3.722  -8.944  13.708
  440   3HB   ALA  54          3HB       ALA  54   4.577  -9.125  12.176
  441    H    ARG  55           H        ARG  55   6.809  -7.575  13.159
  442    HA   ARG  55           HA       ARG  55   6.915  -7.593  15.985
  443   1HB   ARG  55          1HB       ARG  55   8.535  -8.752  14.490
  444   2HB   ARG  55          2HB       ARG  55   9.192  -7.184  14.040
  445   1HG   ARG  55          1HG       ARG  55   9.606  -6.856  16.546
  446   2HG   ARG  55          2HG       ARG  55   9.340  -8.595  16.678
  447   1HD   ARG  55          1HD       ARG  55  11.245  -9.110  15.511
  448   2HD   ARG  55          2HD       ARG  55  11.238  -7.593  14.617
  449    HE   ARG  55           HE       ARG  55  11.959  -6.526  16.752
  450   1HH1  ARG  55          1HH1      ARG  55  12.559  -9.932  16.165
  451   2HH1  ARG  55          2HH1      ARG  55  13.956  -9.993  17.208
  452   1HH2  ARG  55          1HH2      ARG  55  13.745  -6.627  18.182
  453   2HH2  ARG  55          2HH2      ARG  55  14.597  -8.136  18.391
  454    H    LYS  56           H        LYS  56   7.302  -5.079  13.600
  455    HA   LYS  56           HA       LYS  56   8.349  -3.194  15.547
  456   1HB   LYS  56          1HB       LYS  56   7.679  -2.931  12.614
  457   2HB   LYS  56          2HB       LYS  56   8.306  -1.613  13.594
  458   1HG   LYS  56          1HG       LYS  56  10.394  -2.594  13.805
  459   2HG   LYS  56          2HG       LYS  56   9.784  -4.204  13.422
  460   1HD   LYS  56          1HD       LYS  56  10.209  -3.909  11.257
  461   2HD   LYS  56          2HD       LYS  56   9.286  -2.408  11.234
  462   1HE   LYS  56          1HE       LYS  56  11.822  -2.392  10.628
  463   2HE   LYS  56          2HE       LYS  56  11.140  -1.100  11.616
  464   1HZ   LYS  56          1HZ       LYS  56  12.089  -1.958  13.536
  465   2HZ   LYS  56          2HZ       LYS  56  13.308  -2.178  12.381
  466   3HZ   LYS  56          3HZ       LYS  56  12.348  -3.493  12.863
  467    H    GLY  57           H        GLY  57   5.318  -4.185  14.346
  468   1HA   GLY  57          1HA       GLY  57   3.182  -3.440  14.883
  469   2HA   GLY  57          2HA       GLY  57   3.907  -2.169  15.865
  470    H    THR  58           H        THR  58   4.007  -3.107  12.452
  471    HA   THR  58           HA       THR  58   3.215  -0.385  11.681
  472    HB   THR  58           HB       THR  58   5.638  -1.839  10.597
  473    HG1  THR  58           HG1      THR  58   5.340  -0.349  12.818
  474   1HG2  THR  58          1HG2      THR  58   5.592  -0.378   8.930
  475   2HG2  THR  58          2HG2      THR  58   5.678   0.950  10.088
  476   3HG2  THR  58          3HG2      THR  58   4.110   0.326   9.575
  477    H    SER  59           H        SER  59   1.971  -0.304   9.844
  478    HA   SER  59           HA       SER  59   0.934  -2.695   8.716
  479   1HB   SER  59          1HB       SER  59   0.675  -0.366   6.996
  480   2HB   SER  59          2HB       SER  59  -0.579  -1.288   7.824
  481    HG   SER  59           HG       SER  59  -0.042   1.089   8.392
  482    H    ILE  60           H        ILE  60   1.468  -3.768   6.852
  483    HA   ILE  60           HA       ILE  60   4.112  -3.784   6.044
  484    HB   ILE  60           HB       ILE  60   2.618  -5.673   5.667
  485   1HG1  ILE  60          1HG1      ILE  60   3.444  -4.954   2.896
  486   2HG1  ILE  60          2HG1      ILE  60   4.692  -5.004   4.137
  487   1HG2  ILE  60          1HG2      ILE  60   1.016  -3.721   4.307
  488   2HG2  ILE  60          2HG2      ILE  60   0.599  -5.361   4.807
  489   3HG2  ILE  60          3HG2      ILE  60   1.354  -5.079   3.237
  490   1HD1  ILE  60          1HD1      ILE  60   4.196  -7.300   4.613
  491   2HD1  ILE  60          2HD1      ILE  60   4.457  -7.109   2.880
  492   3HD1  ILE  60          3HD1      ILE  60   2.818  -7.270   3.512
  493    H    THR  61           H        THR  61   1.424  -1.936   4.744
  494    HA   THR  61           HA       THR  61   2.705  -1.021   2.407
  495    HB   THR  61           HB       THR  61   0.826   0.885   3.476
  496    HG1  THR  61           HG1      THR  61  -0.933  -0.533   3.730
  497   1HG2  THR  61          1HG2      THR  61  -0.495  -0.154   1.461
  498   2HG2  THR  61          2HG2      THR  61   1.048  -0.931   1.116
  499   3HG2  THR  61          3HG2      THR  61   0.940   0.827   1.170
  500    H    ASP  62           H        ASP  62   2.442   0.284   5.689
  501    HA   ASP  62           HA       ASP  62   3.836   2.712   5.111
  502   1HB   ASP  62          1HB       ASP  62   2.225   2.057   7.123
  503   2HB   ASP  62          2HB       ASP  62   3.751   1.623   7.886
  504    H    VAL  63           H        VAL  63   4.732  -0.500   6.058
  505    HA   VAL  63           HA       VAL  63   7.354   0.006   6.975
  506    HB   VAL  63           HB       VAL  63   5.751  -2.322   6.310
  507   1HG1  VAL  63          1HG1      VAL  63   8.606  -3.013   6.029
  508   2HG1  VAL  63          2HG1      VAL  63   7.836  -2.277   4.623
  509   3HG1  VAL  63          3HG1      VAL  63   7.178  -3.761   5.313
  510   1HG2  VAL  63          1HG2      VAL  63   6.242  -2.194   8.520
  511   2HG2  VAL  63          2HG2      VAL  63   7.841  -1.504   8.242
  512   3HG2  VAL  63          3HG2      VAL  63   7.573  -3.232   8.006
  513    H    VAL  64           H        VAL  64   6.027  -0.597   3.740
  514    HA   VAL  64           HA       VAL  64   8.556  -0.573   2.429
  515    HB   VAL  64           HB       VAL  64   6.002   0.258   1.082
  516   1HG1  VAL  64          1HG1      VAL  64   7.575   0.386  -0.537
  517   2HG1  VAL  64          2HG1      VAL  64   7.282  -1.350  -0.640
  518   3HG1  VAL  64          3HG1      VAL  64   8.661  -0.742   0.277
  519   1HG2  VAL  64          1HG2      VAL  64   6.496  -2.560   0.817
  520   2HG2  VAL  64          2HG2      VAL  64   5.035  -1.728   1.350
  521   3HG2  VAL  64          3HG2      VAL  64   6.293  -2.135   2.517
  522    H    ASN  65           H        ASN  65   6.091   1.870   3.104
  523    HA   ASN  65           HA       ASN  65   7.279   4.042   1.789
  524   1HB   ASN  65          1HB       ASN  65   5.032   3.662   3.331
  525   2HB   ASN  65          2HB       ASN  65   6.012   4.720   4.340
  526   1HD2  ASN  65          1HD2      ASN  65   3.510   5.223   2.951
  527   2HD2  ASN  65          2HD2      ASN  65   3.805   6.559   1.888
  528    H    GLN  66           H        GLN  66   7.956   2.548   4.869
  529    HA   GLN  66           HA       GLN  66   9.607   4.604   5.917
  530   1HB   GLN  66          1HB       GLN  66   8.541   2.903   7.325
  531   2HB   GLN  66          2HB       GLN  66   9.520   1.654   6.567
  532   1HG   GLN  66          1HG       GLN  66  11.544   2.836   7.423
  533   2HG   GLN  66          2HG       GLN  66  10.466   3.901   8.322
  534   1HE2  GLN  66          1HE2      GLN  66   8.885   2.773   9.743
  535   2HE2  GLN  66          2HE2      GLN  66   9.442   1.381  10.620
  536    H    LEU  67           H        LEU  67  10.340   1.552   4.206
  537    HA   LEU  67           HA       LEU  67  13.150   1.962   4.326
  538   1HB   LEU  67          1HB       LEU  67  13.164   0.225   2.432
  539   2HB   LEU  67          2HB       LEU  67  12.628  -0.262   4.027
  540    HG   LEU  67           HG       LEU  67  10.269   0.457   2.855
  541   1HD1  LEU  67          1HD1      LEU  67  11.534   0.757   0.702
  542   2HD1  LEU  67          2HD1      LEU  67  10.177  -0.368   0.642
  543   3HD1  LEU  67          3HD1      LEU  67  11.829  -0.984   0.728
  544   1HD2  LEU  67          1HD2      LEU  67   9.946  -1.542   3.759
  545   2HD2  LEU  67          2HD2      LEU  67  11.656  -1.950   3.627
  546   3HD2  LEU  67          3HD2      LEU  67  10.573  -2.240   2.265
  547    H    VAL  68           H        VAL  68  10.672   2.814   1.983
  548    HA   VAL  68           HA       VAL  68  12.331   3.569  -0.162
  549    HB   VAL  68           HB       VAL  68   9.687   4.786   0.677
  550   1HG1  VAL  68          1HG1      VAL  68  11.545   5.557  -1.349
  551   2HG1  VAL  68          2HG1      VAL  68   9.974   6.258  -0.957
  552   3HG1  VAL  68          3HG1      VAL  68  10.082   4.932  -2.115
  553   1HG2  VAL  68          1HG2      VAL  68   8.869   2.794   0.090
  554   2HG2  VAL  68          2HG2      VAL  68  10.394   2.283  -0.633
  555   3HG2  VAL  68          3HG2      VAL  68   9.256   3.256  -1.566
  556    H    ASP  69           H        ASP  69  10.934   5.486   2.462
  557    HA   ASP  69           HA       ASP  69  12.229   7.909   1.867
  558   1HB   ASP  69          1HB       ASP  69  10.280   7.802   3.314
  559   2HB   ASP  69          2HB       ASP  69  11.163   6.827   4.483
  560    H    ASN  70           H        ASN  70  13.150   5.164   3.883
  561    HA   ASN  70           HA       ASN  70  15.382   6.277   5.142
  562   1HB   ASN  70          1HB       ASN  70  14.248   3.629   4.766
  563   2HB   ASN  70          2HB       ASN  70  16.008   3.590   4.781
  564   1HD2  ASN  70          1HD2      ASN  70  13.151   4.104   6.594
  565   2HD2  ASN  70          2HD2      ASN  70  13.902   4.272   8.151
  566    H    TRP  71           H        TRP  71  15.465   3.989   2.402
  567    HA   TRP  71           HA       TRP  71  18.193   4.288   1.869
  568   1HB   TRP  71          1HB       TRP  71  16.683   2.449   1.045
  569   2HB   TRP  71          2HB       TRP  71  16.060   3.573  -0.153
  570    HD1  TRP  71           HD1      TRP  71  19.210   1.560   0.712
  571    HE1  TRP  71           HE1      TRP  71  20.699   1.414  -1.388
  572    HE3  TRP  71           HE3      TRP  71  16.608   4.712  -2.371
  573    HZ2  TRP  71           HZ2      TRP  71  20.743   2.456  -3.997
  574    HZ3  TRP  71           HZ3      TRP  71  17.436   5.060  -4.660
  575    HH2  TRP  71           HH2      TRP  71  19.458   3.959  -5.451
  576    H    LEU  72           H        LEU  72  15.402   5.992   0.552
  577    HA   LEU  72           HA       LEU  72  16.853   7.411  -1.421
  578   1HB   LEU  72          1HB       LEU  72  14.212   7.000  -0.832
  579   2HB   LEU  72          2HB       LEU  72  14.420   8.698  -0.437
  580    HG   LEU  72           HG       LEU  72  15.256   9.134  -2.699
  581   1HD1  LEU  72          1HD1      LEU  72  15.470   6.270  -2.757
  582   2HD1  LEU  72          2HD1      LEU  72  16.123   7.466  -3.878
  583   3HD1  LEU  72          3HD1      LEU  72  14.489   6.845  -4.107
  584   1HD2  LEU  72          1HD2      LEU  72  13.148   9.525  -3.254
  585   2HD2  LEU  72          2HD2      LEU  72  12.626   8.450  -1.957
  586   3HD2  LEU  72          3HD2      LEU  72  12.889   7.810  -3.579
  587    H    LYS  73           H        LYS  73  16.357   7.996   1.978
  588    HA   LYS  73           HA       LYS  73  17.251  10.757   1.666
  589   1HB   LYS  73          1HB       LYS  73  16.108   9.209   3.968
  590   2HB   LYS  73          2HB       LYS  73  16.921  10.747   4.230
  591   1HG   LYS  73          1HG       LYS  73  15.186  11.306   2.172
  592   2HG   LYS  73          2HG       LYS  73  14.268  10.185   3.181
  593   1HD   LYS  73          1HD       LYS  73  15.664  12.658   4.203
  594   2HD   LYS  73          2HD       LYS  73  13.952  12.582   3.780
  595   1HE   LYS  73          1HE       LYS  73  14.878  10.482   5.613
  596   2HE   LYS  73          2HE       LYS  73  14.951  12.119   6.261
  597   1HZ   LYS  73          1HZ       LYS  73  12.840  11.274   6.800
  598   2HZ   LYS  73          2HZ       LYS  73  12.577  10.674   5.235
  599   3HZ   LYS  73          3HZ       LYS  73  12.576  12.347   5.513
  600    H    GLU  74           H        GLU  74  18.407   7.668   2.808
  601    HA   GLU  74           HA       GLU  74  20.716   8.866   4.078
  602   1HB   GLU  74          1HB       GLU  74  19.598   6.107   3.883
  603   2HB   GLU  74          2HB       GLU  74  21.287   6.310   4.325
  604   1HG   GLU  74          1HG       GLU  74  20.113   8.099   5.976
  605   2HG   GLU  74          2HG       GLU  74  18.852   6.872   5.855
  606    H    ASN  75           H        ASN  75  20.068   6.900   1.198
  607    HA   ASN  75           HA       ASN  75  22.889   6.794   0.535
  608   1HB   ASN  75          1HB       ASN  75  21.961   4.839  -0.196
  609   2HB   ASN  75          2HB       ASN  75  20.395   5.573  -0.522
  610   1HD2  ASN  75          1HD2      ASN  75  19.898   6.097  -2.551
  611   2HD2  ASN  75          2HD2      ASN  75  20.978   6.003  -3.899
  612    H    GLU  76           H        GLU  76  20.022   8.541  -0.487
  613    HA   GLU  76           HA       GLU  76  21.462   9.836  -2.648
  614   1HB   GLU  76          1HB       GLU  76  18.637   9.649  -1.786
  615   2HB   GLU  76          2HB       GLU  76  19.108  11.157  -2.558
  616   1HG   GLU  76          1HG       GLU  76  19.313   8.383  -3.706
  617   2HG   GLU  76          2HG       GLU  76  18.222   9.673  -4.212
  618   1H    MET   1          1H        MET   1 -29.384 -15.771 -64.936
  619   2H    MET   1          2H        MET   1 -30.385 -14.977 -66.049
  620   3H    MET   1          3H        MET   1 -28.745 -14.566 -65.941
  621    HA   MET   1           HA       MET   1 -29.338 -15.982 -67.886
  622   1HB   MET   1          1HB       MET   1 -27.137 -16.010 -66.153
  623   2HB   MET   1          2HB       MET   1 -27.497 -17.705 -66.443
  624   1HG   MET   1          1HG       MET   1 -27.178 -15.706 -68.658
  625   2HG   MET   1          2HG       MET   1 -25.836 -16.639 -68.001
  626   1HE   MET   1          1HE       MET   1 -27.463 -16.078 -70.650
  627   2HE   MET   1          2HE       MET   1 -28.490 -17.384 -71.238
  628   3HE   MET   1          3HE       MET   1 -26.749 -17.447 -71.499
  629    H    SER   2           H        SER   2 -29.703 -18.188 -68.579
  630    HA   SER   2           HA       SER   2 -31.768 -19.508 -67.153
  631   1HB   SER   2          1HB       SER   2 -30.579 -21.302 -68.997
  632   2HB   SER   2          2HB       SER   2 -32.037 -20.333 -69.226
  633    HG   SER   2           HG       SER   2 -29.868 -20.101 -70.593
  634    H    LEU   3           H        LEU   3 -28.316 -19.935 -67.462
  635    HA   LEU   3           HA       LEU   3 -28.295 -21.493 -65.025
  636   1HB   LEU   3          1HB       LEU   3 -26.494 -22.996 -66.187
  637   2HB   LEU   3          2HB       LEU   3 -28.196 -23.390 -66.316
  638    HG   LEU   3           HG       LEU   3 -27.657 -21.718 -68.502
  639   1HD1  LEU   3          1HD1      LEU   3 -25.731 -22.440 -69.525
  640   2HD1  LEU   3          2HD1      LEU   3 -25.668 -23.934 -68.592
  641   3HD1  LEU   3          3HD1      LEU   3 -25.226 -22.402 -67.837
  642   1HD2  LEU   3          1HD2      LEU   3 -29.172 -23.750 -68.211
  643   2HD2  LEU   3          2HD2      LEU   3 -27.744 -24.714 -68.599
  644   3HD2  LEU   3          3HD2      LEU   3 -28.367 -23.551 -69.772
  645    H    GLU   4           H        GLU   4 -26.924 -20.455 -63.763
  646    HA   GLU   4           HA       GLU   4 -25.117 -18.522 -64.848
  647   1HB   GLU   4          1HB       GLU   4 -26.439 -18.590 -62.554
  648   2HB   GLU   4          2HB       GLU   4 -24.974 -19.380 -61.993
  649   1HG   GLU   4          1HG       GLU   4 -24.679 -17.113 -61.507
  650   2HG   GLU   4          2HG       GLU   4 -23.708 -17.411 -62.949
  651    H    LYS   5           H        LYS   5 -23.020 -18.689 -65.265
  652    HA   LYS   5           HA       LYS   5 -21.736 -21.244 -65.177
  653   1HB   LYS   5          1HB       LYS   5 -21.399 -19.099 -66.754
  654   2HB   LYS   5          2HB       LYS   5 -20.131 -18.774 -65.580
  655   1HG   LYS   5          1HG       LYS   5 -18.936 -20.664 -66.149
  656   2HG   LYS   5          2HG       LYS   5 -20.338 -21.460 -66.863
  657   1HD   LYS   5          1HD       LYS   5 -20.056 -20.447 -68.860
  658   2HD   LYS   5          2HD       LYS   5 -19.546 -18.923 -68.126
  659   1HE   LYS   5          1HE       LYS   5 -17.437 -19.412 -68.599
  660   2HE   LYS   5          2HE       LYS   5 -17.547 -20.838 -67.566
  661   1HZ   LYS   5          1HZ       LYS   5 -18.642 -21.884 -69.654
  662   2HZ   LYS   5          2HZ       LYS   5 -16.953 -21.740 -69.570
  663   3HZ   LYS   5          3HZ       LYS   5 -17.855 -20.628 -70.483
  664    H    ALA   6           H        ALA   6 -20.101 -21.942 -63.874
  665    HA   ALA   6           HA       ALA   6 -18.794 -22.167 -62.025
  666   1HB   ALA   6          1HB       ALA   6 -19.027 -19.380 -61.089
  667   2HB   ALA   6          2HB       ALA   6 -18.285 -19.609 -62.676
  668   3HB   ALA   6          3HB       ALA   6 -17.607 -20.411 -61.256
  669    H    HIS   7           H        HIS   7 -18.980 -21.188 -59.472
  670    HA   HIS   7           HA       HIS   7 -21.650 -20.897 -58.547
  671   1HB   HIS   7          1HB       HIS   7 -21.996 -23.071 -57.519
  672   2HB   HIS   7          2HB       HIS   7 -21.769 -23.273 -59.252
  673    HD1  HIS   7           HD1      HIS   7 -20.550 -24.445 -56.028
  674    HD2  HIS   7           HD2      HIS   7 -19.087 -24.256 -59.922
  675    HE1  HIS   7           HE1      HIS   7 -18.581 -26.010 -56.094
  676    HE2  HIS   7           HE2      HIS   7 -17.763 -25.952 -58.477
  677    H    THR   8           H        THR   8 -21.724 -20.378 -56.390
  678    HA   THR   8           HA       THR   8 -19.152 -19.891 -55.136
  679    HB   THR   8           HB       THR   8 -21.297 -19.172 -53.416
  680    HG1  THR   8           HG1      THR   8 -22.024 -17.643 -55.434
  681   1HG2  THR   8          1HG2      THR   8 -20.566 -16.829 -54.166
  682   2HG2  THR   8          2HG2      THR   8 -19.377 -17.658 -55.169
  683   3HG2  THR   8          3HG2      THR   8 -19.346 -17.860 -53.418
  684    H    SER   9           H        SER   9 -22.254 -21.269 -54.112
  685    HA   SER   9           HA       SER   9 -22.851 -22.955 -52.746
  686   1HB   SER   9          1HB       SER   9 -20.098 -24.081 -53.293
  687   2HB   SER   9          2HB       SER   9 -21.530 -24.973 -52.780
  688    HG   SER   9           HG       SER   9 -22.509 -24.152 -54.800
  689    H    VAL  10           H        VAL  10 -23.146 -22.635 -50.675
  690    HA   VAL  10           HA       VAL  10 -21.000 -21.666 -48.976
  691    HB   VAL  10           HB       VAL  10 -23.625 -22.447 -47.809
  692   1HG1  VAL  10          1HG1      VAL  10 -23.265 -20.548 -46.415
  693   2HG1  VAL  10          2HG1      VAL  10 -21.982 -19.946 -47.463
  694   3HG1  VAL  10          3HG1      VAL  10 -21.736 -21.419 -46.525
  695   1HG2  VAL  10          1HG2      VAL  10 -24.738 -21.385 -49.463
  696   2HG2  VAL  10          2HG2      VAL  10 -23.319 -20.481 -49.989
  697   3HG2  VAL  10          3HG2      VAL  10 -24.236 -19.941 -48.582
  698    H    LYS  11           H        LYS  11 -19.811 -23.704 -49.444
  699    HA   LYS  11           HA       LYS  11 -20.728 -26.106 -48.145
  700   1HB   LYS  11          1HB       LYS  11 -18.349 -26.882 -48.670
  701   2HB   LYS  11          2HB       LYS  11 -19.388 -26.511 -50.037
  702   1HG   LYS  11          1HG       LYS  11 -17.883 -24.185 -49.202
  703   2HG   LYS  11          2HG       LYS  11 -16.827 -25.549 -49.572
  704   1HD   LYS  11          1HD       LYS  11 -18.236 -25.790 -51.710
  705   2HD   LYS  11          2HD       LYS  11 -18.800 -24.156 -51.351
  706   1HE   LYS  11          1HE       LYS  11 -15.922 -24.365 -51.133
  707   2HE   LYS  11          2HE       LYS  11 -16.485 -24.865 -52.727
  708   1HZ   LYS  11          1HZ       LYS  11 -16.921 -22.253 -51.383
  709   2HZ   LYS  11          2HZ       LYS  11 -17.777 -22.724 -52.768
  710   3HZ   LYS  11          3HZ       LYS  11 -16.091 -22.555 -52.829
  711    H    LYS  12           H        LYS  12 -20.583 -26.492 -46.058
  712    HA   LYS  12           HA       LYS  12 -19.286 -24.724 -44.261
  713   1HB   LYS  12          1HB       LYS  12 -21.310 -26.165 -43.772
  714   2HB   LYS  12          2HB       LYS  12 -20.218 -27.539 -43.672
  715   1HG   LYS  12          1HG       LYS  12 -19.086 -26.581 -41.790
  716   2HG   LYS  12          2HG       LYS  12 -20.008 -25.085 -41.943
  717   1HD   LYS  12          1HD       LYS  12 -20.855 -26.536 -40.142
  718   2HD   LYS  12          2HD       LYS  12 -22.057 -26.254 -41.405
  719   1HE   LYS  12          1HE       LYS  12 -21.899 -28.414 -42.219
  720   2HE   LYS  12          2HE       LYS  12 -20.286 -28.659 -41.548
  721   1HZ   LYS  12          1HZ       LYS  12 -21.321 -28.633 -39.317
  722   2HZ   LYS  12          2HZ       LYS  12 -21.842 -29.922 -40.282
  723   3HZ   LYS  12          3HZ       LYS  12 -22.849 -28.578 -40.052
  724    H    MET  13           H        MET  13 -17.426 -25.020 -43.004
  725    HA   MET  13           HA       MET  13 -15.627 -27.154 -43.956
  726   1HB   MET  13          1HB       MET  13 -15.097 -24.704 -44.606
  727   2HB   MET  13          2HB       MET  13 -14.643 -24.513 -42.917
  728   1HG   MET  13          1HG       MET  13 -12.758 -25.729 -43.138
  729   2HG   MET  13          2HG       MET  13 -13.469 -26.819 -44.326
  730   1HE   MET  13          1HE       MET  13 -11.671 -22.687 -45.063
  731   2HE   MET  13          2HE       MET  13 -12.472 -23.277 -43.609
  732   3HE   MET  13          3HE       MET  13 -13.432 -22.722 -44.979
  733    H    THR  14           H        THR  14 -15.794 -28.614 -42.370
  734    HA   THR  14           HA       THR  14 -16.005 -27.869 -39.603
  735    HB   THR  14           HB       THR  14 -15.630 -30.436 -39.358
  736    HG1  THR  14           HG1      THR  14 -15.692 -31.580 -41.184
  737   1HG2  THR  14          1HG2      THR  14 -17.761 -29.221 -39.020
  738   2HG2  THR  14          2HG2      THR  14 -17.992 -30.819 -39.729
  739   3HG2  THR  14          3HG2      THR  14 -18.093 -29.381 -40.745
  740    H    PHE  15           H        PHE  15 -14.423 -27.765 -38.096
  741    HA   PHE  15           HA       PHE  15 -11.706 -27.715 -38.947
  742   1HB   PHE  15          1HB       PHE  15 -12.943 -26.442 -36.994
  743   2HB   PHE  15          2HB       PHE  15 -12.459 -27.849 -36.054
  744    HD1  PHE  15           HD1      PHE  15 -10.559 -27.568 -34.828
  745    HD2  PHE  15           HD2      PHE  15 -10.886 -25.609 -38.591
  746    HE1  PHE  15           HE1      PHE  15  -8.329 -26.588 -34.510
  747    HE2  PHE  15           HE2      PHE  15  -8.655 -24.632 -38.283
  748    HZ   PHE  15           HZ       PHE  15  -7.368 -25.115 -36.237
  749    H    GLY  16           H        GLY  16 -13.255 -29.657 -36.398
  750   1HA   GLY  16          1HA       GLY  16 -13.078 -31.911 -35.940
  751   2HA   GLY  16          2HA       GLY  16 -12.148 -32.105 -37.419
  752    H    GLU  17           H        GLU  17  -9.936 -30.786 -37.163
  753    HA   GLU  17           HA       GLU  17  -8.528 -32.175 -35.070
  754   1HB   GLU  17          1HB       GLU  17  -7.211 -30.139 -36.822
  755   2HB   GLU  17          2HB       GLU  17  -6.580 -31.663 -36.216
  756   1HG   GLU  17          1HG       GLU  17  -8.610 -31.316 -38.413
  757   2HG   GLU  17          2HG       GLU  17  -6.917 -31.766 -38.608
  758    H    ASN  18           H        ASN  18  -9.968 -30.832 -33.541
  759    HA   ASN  18           HA       ASN  18  -9.157 -28.124 -33.031
  760   1HB   ASN  18          1HB       ASN  18 -11.320 -29.722 -32.311
  761   2HB   ASN  18          2HB       ASN  18 -10.448 -29.497 -30.798
  762   1HD2  ASN  18          1HD2      ASN  18 -13.047 -28.488 -31.782
  763   2HD2  ASN  18          2HD2      ASN  18 -12.974 -26.761 -31.586
  764    H    ARG  19           H        ARG  19  -8.374 -31.304 -31.830
  765    HA   ARG  19           HA       ARG  19  -6.799 -32.110 -30.420
  766   1HB   ARG  19          1HB       ARG  19  -5.542 -30.057 -31.960
  767   2HB   ARG  19          2HB       ARG  19  -4.882 -30.015 -30.329
  768   1HG   ARG  19          1HG       ARG  19  -4.865 -32.295 -32.279
  769   2HG   ARG  19          2HG       ARG  19  -3.492 -31.456 -31.558
  770   1HD   ARG  19          1HD       ARG  19  -4.805 -32.360 -29.346
  771   2HD   ARG  19          2HD       ARG  19  -5.137 -33.648 -30.504
  772    HE   ARG  19           HE       ARG  19  -2.400 -32.733 -29.863
  773   1HH1  ARG  19          1HH1      ARG  19  -4.754 -35.286 -30.347
  774   2HH1  ARG  19          2HH1      ARG  19  -3.581 -36.565 -30.221
  775   1HH2  ARG  19          1HH2      ARG  19  -0.839 -34.415 -29.775
  776   2HH2  ARG  19          2HH2      ARG  19  -1.351 -36.069 -29.962
  777    H    ASP  20           H        ASP  20  -8.915 -30.737 -29.212
  778    HA   ASP  20           HA       ASP  20  -7.861 -29.060 -27.103
  779   1HB   ASP  20          1HB       ASP  20 -10.141 -28.686 -27.926
  780   2HB   ASP  20          2HB       ASP  20 -10.590 -30.323 -27.458
  781    H    LEU  21           H        LEU  21  -8.582 -32.391 -27.665
  782    HA   LEU  21           HA       LEU  21  -8.409 -33.198 -24.908
  783   1HB   LEU  21          1HB       LEU  21  -8.879 -34.493 -27.508
  784   2HB   LEU  21          2HB       LEU  21  -8.019 -35.479 -26.342
  785    HG   LEU  21           HG       LEU  21  -9.919 -34.922 -24.716
  786   1HD1  LEU  21          1HD1      LEU  21 -10.762 -33.403 -26.976
  787   2HD1  LEU  21          2HD1      LEU  21 -11.513 -33.540 -25.385
  788   3HD1  LEU  21          3HD1      LEU  21 -11.945 -34.676 -26.665
  789   1HD2  LEU  21          1HD2      LEU  21 -10.646 -36.977 -25.174
  790   2HD2  LEU  21          2HD2      LEU  21  -9.541 -36.964 -26.551
  791   3HD2  LEU  21          3HD2      LEU  21 -11.228 -36.496 -26.769
  792    H    GLU  22           H        GLU  22  -6.309 -31.803 -24.992
  793    HA   GLU  22           HA       GLU  22  -4.088 -33.685 -24.974
  794   1HB   GLU  22          1HB       GLU  22  -4.244 -32.276 -27.200
  795   2HB   GLU  22          2HB       GLU  22  -3.601 -30.988 -26.192
  796   1HG   GLU  22          1HG       GLU  22  -1.788 -32.718 -25.562
  797   2HG   GLU  22          2HG       GLU  22  -2.331 -33.561 -27.014
  798    H    ARG  23           H        ARG  23  -3.058 -33.455 -23.088
  799    HA   ARG  23           HA       ARG  23  -3.371 -30.885 -21.676
  800   1HB   ARG  23          1HB       ARG  23  -4.753 -32.788 -20.779
  801   2HB   ARG  23          2HB       ARG  23  -3.250 -33.608 -20.379
  802   1HG   ARG  23          1HG       ARG  23  -3.000 -32.431 -18.514
  803   2HG   ARG  23          2HG       ARG  23  -3.300 -30.906 -19.347
  804   1HD   ARG  23          1HD       ARG  23  -5.709 -31.301 -19.201
  805   2HD   ARG  23          2HD       ARG  23  -5.409 -32.833 -18.378
  806    HE   ARG  23           HE       ARG  23  -4.483 -31.541 -16.520
  807   1HH1  ARG  23          1HH1      ARG  23  -6.333 -29.772 -18.908
  808   2HH1  ARG  23          2HH1      ARG  23  -6.803 -28.511 -17.802
  809   1HH2  ARG  23          1HH2      ARG  23  -5.086 -29.863 -15.057
  810   2HH2  ARG  23          2HH2      ARG  23  -6.120 -28.574 -15.620
  811    H    VAL  24           H        VAL  24  -1.418 -29.974 -21.988
  812    HA   VAL  24           HA       VAL  24   0.869 -31.415 -20.828
  813    HB   VAL  24           HB       VAL  24   2.056 -29.575 -22.502
  814   1HG1  VAL  24          1HG1      VAL  24   1.541 -32.502 -23.000
  815   2HG1  VAL  24          2HG1      VAL  24   2.852 -31.817 -22.038
  816   3HG1  VAL  24          3HG1      VAL  24   2.793 -31.531 -23.779
  817   1HG2  VAL  24          1HG2      VAL  24  -0.410 -29.620 -23.540
  818   2HG2  VAL  24          2HG2      VAL  24   0.285 -30.998 -24.393
  819   3HG2  VAL  24          3HG2      VAL  24   1.042 -29.411 -24.517
  820    H    VAL  25           H        VAL  25   1.886 -30.342 -19.259
  821    HA   VAL  25           HA       VAL  25   0.774 -27.806 -18.434
  822    HB   VAL  25           HB       VAL  25   2.970 -29.426 -17.132
  823   1HG1  VAL  25          1HG1      VAL  25   1.212 -27.605 -15.589
  824   2HG1  VAL  25          2HG1      VAL  25   2.438 -26.860 -16.614
  825   3HG1  VAL  25          3HG1      VAL  25   2.915 -28.002 -15.360
  826   1HG2  VAL  25          1HG2      VAL  25   0.676 -30.529 -17.453
  827   2HG2  VAL  25          2HG2      VAL  25   0.095 -29.356 -16.271
  828   3HG2  VAL  25          3HG2      VAL  25   1.355 -30.506 -15.827
  829    H    THR  26           H        THR  26   1.476 -26.376 -20.000
  830    HA   THR  26           HA       THR  26   4.344 -25.960 -20.350
  831    HB   THR  26           HB       THR  26   2.464 -24.014 -21.534
  832    HG1  THR  26           HG1      THR  26   2.512 -26.729 -22.429
  833   1HG2  THR  26          1HG2      THR  26   4.529 -25.727 -22.895
  834   2HG2  THR  26          2HG2      THR  26   4.956 -24.272 -21.995
  835   3HG2  THR  26          3HG2      THR  26   3.899 -24.159 -23.401
  836    H    ALA  27           H        ALA  27   4.729 -25.352 -18.143
  837    HA   ALA  27           HA       ALA  27   3.809 -22.628 -17.516
  838   1HB   ALA  27          1HB       ALA  27   4.518 -24.097 -15.154
  839   2HB   ALA  27          2HB       ALA  27   3.297 -24.975 -16.074
  840   3HB   ALA  27          3HB       ALA  27   2.993 -23.314 -15.567
  841    HA   PRO  28           HA       PRO  28   8.166 -21.783 -17.419
  842   1HB   PRO  28          1HB       PRO  28   7.485 -19.168 -16.347
  843   2HB   PRO  28          2HB       PRO  28   8.099 -19.581 -17.949
  844   1HG   PRO  28          1HG       PRO  28   5.576 -18.668 -17.521
  845   2HG   PRO  28          2HG       PRO  28   6.001 -19.758 -18.855
  846   1HD   PRO  28          1HD       PRO  28   4.724 -20.391 -16.215
  847   2HD   PRO  28          2HD       PRO  28   4.343 -21.019 -17.834
  848    H    VAL  29           H        VAL  29   9.484 -20.206 -15.707
  849    HA   VAL  29           HA       VAL  29   9.168 -21.627 -13.174
  850    HB   VAL  29           HB       VAL  29  11.376 -21.503 -14.437
  851   1HG1  VAL  29          1HG1      VAL  29  11.447 -18.727 -13.271
  852   2HG1  VAL  29          2HG1      VAL  29  11.317 -19.120 -14.985
  853   3HG1  VAL  29          3HG1      VAL  29  12.774 -19.549 -14.088
  854   1HG2  VAL  29          1HG2      VAL  29  11.011 -20.921 -11.538
  855   2HG2  VAL  29          2HG2      VAL  29  12.641 -20.971 -12.213
  856   3HG2  VAL  29          3HG2      VAL  29  11.594 -22.385 -12.334
  857    H    SER  30           H        SER  30   7.503 -19.307 -14.121
  858    HA   SER  30           HA       SER  30   8.131 -17.074 -12.471
  859   1HB   SER  30          1HB       SER  30   5.350 -17.138 -13.100
  860   2HB   SER  30          2HB       SER  30   6.612 -16.155 -13.847
  861    HG   SER  30           HG       SER  30   5.787 -17.361 -15.480
  862    H    SER  31           H        SER  31   5.654 -19.622 -12.282
  863    HA   SER  31           HA       SER  31   4.367 -20.409 -10.594
  864   1HB   SER  31          1HB       SER  31   6.440 -19.815  -8.550
  865   2HB   SER  31          2HB       SER  31   5.590 -21.322  -8.896
  866    HG   SER  31           HG       SER  31   7.021 -21.812 -10.442
  867    H    GLY  32           H        GLY  32   4.956 -19.369  -7.712
  868   1HA   GLY  32          1HA       GLY  32   3.623 -16.750  -7.977
  869   2HA   GLY  32          2HA       GLY  32   2.961 -17.973  -6.900
  870    H    LYS  33           H        LYS  33   6.371 -17.521  -7.406
  871    HA   LYS  33           HA       LYS  33   6.768 -17.168  -4.575
  872   1HB   LYS  33          1HB       LYS  33   9.237 -17.114  -5.342
  873   2HB   LYS  33          2HB       LYS  33   8.337 -18.616  -5.492
  874   1HG   LYS  33          1HG       LYS  33   8.514 -18.636  -7.720
  875   2HG   LYS  33          2HG       LYS  33   8.183 -16.909  -7.857
  876   1HD   LYS  33          1HD       LYS  33  10.462 -17.590  -8.631
  877   2HD   LYS  33          2HD       LYS  33  10.454 -16.357  -7.371
  878   1HE   LYS  33          1HE       LYS  33  12.170 -18.021  -6.934
  879   2HE   LYS  33          2HE       LYS  33  10.923 -18.069  -5.692
  880   1HZ   LYS  33          1HZ       LYS  33  11.851 -20.211  -7.034
  881   2HZ   LYS  33          2HZ       LYS  33  10.437 -19.852  -7.901
  882   3HZ   LYS  33          3HZ       LYS  33  10.358 -20.141  -6.231
  883    H    ILE  34           H        ILE  34   5.599 -14.966  -6.279
  884    HA   ILE  34           HA       ILE  34   7.311 -12.857  -5.210
  885    HB   ILE  34           HB       ILE  34   6.362 -11.728  -7.557
  886   1HG1  ILE  34          1HG1      ILE  34   7.693 -13.504  -9.108
  887   2HG1  ILE  34          2HG1      ILE  34   6.951 -14.602  -7.952
  888   1HG2  ILE  34          1HG2      ILE  34   9.010 -12.675  -6.577
  889   2HG2  ILE  34          2HG2      ILE  34   8.427 -11.031  -6.842
  890   3HG2  ILE  34          3HG2      ILE  34   8.871 -12.043  -8.217
  891   1HD1  ILE  34          1HD1      ILE  34   5.049 -14.484  -9.052
  892   2HD1  ILE  34          2HD1      ILE  34   5.796 -13.394 -10.221
  893   3HD1  ILE  34          3HD1      ILE  34   4.988 -12.740  -8.795
  894    H    LYS  35           H        LYS  35   6.177 -11.331  -4.203
  895    HA   LYS  35           HA       LYS  35   3.247 -11.350  -4.552
  896   1HB   LYS  35          1HB       LYS  35   4.703 -10.513  -2.049
  897   2HB   LYS  35          2HB       LYS  35   2.997 -10.900  -2.231
  898   1HG   LYS  35          1HG       LYS  35   5.013 -13.009  -2.814
  899   2HG   LYS  35          2HG       LYS  35   4.664 -12.596  -1.133
  900   1HD   LYS  35          1HD       LYS  35   2.930 -13.985  -1.271
  901   2HD   LYS  35          2HD       LYS  35   2.168 -12.791  -2.325
  902   1HE   LYS  35          1HE       LYS  35   2.244 -14.233  -4.011
  903   2HE   LYS  35          2HE       LYS  35   4.002 -14.291  -3.883
  904   1HZ   LYS  35          1HZ       LYS  35   3.693 -15.992  -2.112
  905   2HZ   LYS  35          2HZ       LYS  35   3.179 -16.490  -3.652
  906   3HZ   LYS  35          3HZ       LYS  35   2.040 -16.019  -2.489
  907    H    ARG  36           H        ARG  36   2.195  -9.428  -4.812
  908    HA   ARG  36           HA       ARG  36   3.947  -7.108  -5.239
  909   1HB   ARG  36          1HB       ARG  36   1.545  -8.173  -6.601
  910   2HB   ARG  36          2HB       ARG  36   1.673  -6.422  -6.504
  911   1HG   ARG  36          1HG       ARG  36   3.756  -6.441  -7.665
  912   2HG   ARG  36          2HG       ARG  36   3.837  -8.204  -7.592
  913   1HD   ARG  36          1HD       ARG  36   3.125  -7.526  -9.793
  914   2HD   ARG  36          2HD       ARG  36   1.788  -8.321  -8.960
  915    HE   ARG  36           HE       ARG  36   2.019  -5.384  -9.147
  916   1HH1  ARG  36          1HH1      ARG  36   0.155  -8.346  -9.389
  917   2HH1  ARG  36          2HH1      ARG  36  -1.331  -7.523  -9.747
  918   1HH2  ARG  36          1HH2      ARG  36   0.046  -4.313  -9.589
  919   2HH2  ARG  36          2HH2      ARG  36  -1.404  -5.242  -9.839
  920    H    VAL  37           H        VAL  37   3.332  -5.050  -4.609
  921    HA   VAL  37           HA       VAL  37   0.922  -4.652  -3.061
  922    HB   VAL  37           HB       VAL  37   2.809  -5.466  -1.469
  923   1HG1  VAL  37          1HG1      VAL  37   4.031  -3.105  -2.545
  924   2HG1  VAL  37          2HG1      VAL  37   4.700  -4.306  -1.441
  925   3HG1  VAL  37          3HG1      VAL  37   3.804  -2.928  -0.804
  926   1HG2  VAL  37          1HG2      VAL  37   0.892  -3.239  -1.145
  927   2HG2  VAL  37          2HG2      VAL  37   2.096  -3.445   0.131
  928   3HG2  VAL  37          3HG2      VAL  37   1.013  -4.774  -0.282
  929    H    ASN  38           H        ASN  38   0.373  -2.427  -2.864
  930    HA   ASN  38           HA       ASN  38   1.923  -0.682  -4.662
  931   1HB   ASN  38          1HB       ASN  38  -0.354  -1.005  -5.435
  932   2HB   ASN  38          2HB       ASN  38  -0.988  -0.567  -3.851
  933   1HD2  ASN  38          1HD2      ASN  38  -1.492   1.496  -3.495
  934   2HD2  ASN  38          2HD2      ASN  38  -1.051   2.821  -4.519
  935    H    VAL  39           H        VAL  39   2.978   0.968  -3.805
  936    HA   VAL  39           HA       VAL  39   2.290   1.770  -1.053
  937    HB   VAL  39           HB       VAL  39   4.899   2.590  -2.188
  938   1HG1  VAL  39          1HG1      VAL  39   5.653   2.184   0.082
  939   2HG1  VAL  39          2HG1      VAL  39   4.102   1.452   0.490
  940   3HG1  VAL  39          3HG1      VAL  39   4.188   3.167   0.092
  941   1HG2  VAL  39          1HG2      VAL  39   5.468   0.530  -2.851
  942   2HG2  VAL  39          2HG2      VAL  39   4.081  -0.209  -2.050
  943   3HG2  VAL  39          3HG2      VAL  39   5.545   0.143  -1.133
  944    H    ASN  40           H        ASN  40   2.365   3.985  -0.519
  945    HA   ASN  40           HA       ASN  40   1.873   5.749  -2.817
  946   1HB   ASN  40          1HB       ASN  40   1.101   6.164   0.083
  947   2HB   ASN  40          2HB       ASN  40   0.660   7.201  -1.268
  948   1HD2  ASN  40          1HD2      ASN  40   0.135   4.135   0.290
  949   2HD2  ASN  40          2HD2      ASN  40  -1.356   3.758  -0.513
  950    H    PHE  41           H        PHE  41   3.447   7.091  -3.320
  951    HA   PHE  41           HA       PHE  41   5.509   7.694  -1.310
  952   1HB   PHE  41          1HB       PHE  41   5.500   7.858  -4.331
  953   2HB   PHE  41          2HB       PHE  41   6.807   8.494  -3.344
  954    HD1  PHE  41           HD1      PHE  41   5.571   5.597  -1.790
  955    HD2  PHE  41           HD2      PHE  41   7.978   6.890  -5.051
  956    HE1  PHE  41           HE1      PHE  41   6.670   3.399  -1.847
  957    HE2  PHE  41           HE2      PHE  41   9.078   4.692  -5.118
  958    HZ   PHE  41           HZ       PHE  41   8.426   2.944  -3.512
  959    H    ASP  42           H        ASP  42   6.443   9.932  -1.460
  960    HA   ASP  42           HA       ASP  42   4.281  11.880  -1.778
  961   1HB   ASP  42          1HB       ASP  42   5.204  13.052  -0.080
  962   2HB   ASP  42          2HB       ASP  42   6.112  11.583   0.243
  963    H    GLU  43           H        GLU  43   4.991  14.039  -2.712
  964    HA   GLU  43           HA       GLU  43   5.650  13.732  -5.372
  965   1HB   GLU  43          1HB       GLU  43   5.238  15.953  -3.540
  966   2HB   GLU  43          2HB       GLU  43   6.425  16.337  -4.780
  967   1HG   GLU  43          1HG       GLU  43   3.576  15.466  -5.181
  968   2HG   GLU  43          2HG       GLU  43   4.290  17.034  -5.551
  969    H    GLU  44           H        GLU  44   7.756  14.837  -2.734
  970    HA   GLU  44           HA       GLU  44  10.092  15.201  -4.285
  971   1HB   GLU  44          1HB       GLU  44   9.333  15.275  -1.508
  972   2HB   GLU  44          2HB       GLU  44  10.852  14.407  -1.695
  973   1HG   GLU  44          1HG       GLU  44  10.530  17.009  -3.090
  974   2HG   GLU  44          2HG       GLU  44  10.781  17.012  -1.344
  975    H    LYS  45           H        LYS  45   8.821  12.471  -2.456
  976    HA   LYS  45           HA       LYS  45  10.990  10.746  -2.660
  977   1HB   LYS  45          1HB       LYS  45   8.471  10.638  -1.563
  978   2HB   LYS  45          2HB       LYS  45   8.384   9.422  -2.832
  979   1HG   LYS  45          1HG       LYS  45   9.248   8.052  -1.302
  980   2HG   LYS  45          2HG       LYS  45  10.780   8.845  -1.672
  981   1HD   LYS  45          1HD       LYS  45   8.945  10.018   0.378
  982   2HD   LYS  45          2HD       LYS  45   9.980   8.653   0.801
  983   1HE   LYS  45          1HE       LYS  45  11.622  10.099   1.173
  984   2HE   LYS  45          2HE       LYS  45  11.642  10.438  -0.558
  985   1HZ   LYS  45          1HZ       LYS  45  10.423  11.971   1.626
  986   2HZ   LYS  45          2HZ       LYS  45   9.688  12.037   0.097
  987   3HZ   LYS  45          3HZ       LYS  45  11.307  12.517   0.285
  988    H    HIS  46           H        HIS  46   8.563  11.576  -5.033
  989    HA   HIS  46           HA       HIS  46   9.222   9.328  -6.732
  990   1HB   HIS  46          1HB       HIS  46   6.965  10.646  -6.612
  991   2HB   HIS  46          2HB       HIS  46   7.760  11.733  -7.748
  992    HD1  HIS  46           HD1      HIS  46   6.590  11.172  -9.893
  993    HD2  HIS  46           HD2      HIS  46   7.961   7.791  -7.891
  994    HE1  HIS  46           HE1      HIS  46   6.183   9.243 -11.456
  995    HE2  HIS  46           HE2      HIS  46   6.822   7.192 -10.142
  996    H    THR  47           H        THR  47   9.950  12.802  -6.646
  997    HA   THR  47           HA       THR  47  11.412  12.839  -9.076
  998    HB   THR  47           HB       THR  47  12.397  14.758  -7.140
  999    HG1  THR  47           HG1      THR  47  10.538  15.585  -6.426
 1000   1HG2  THR  47          1HG2      THR  47  12.421  14.968  -9.626
 1001   2HG2  THR  47          2HG2      THR  47  11.685  16.346  -8.806
 1002   3HG2  THR  47          3HG2      THR  47  10.666  15.134  -9.585
 1003    H    ARG  48           H        ARG  48  12.377  12.468  -5.681
 1004    HA   ARG  48           HA       ARG  48  15.157  12.220  -6.177
 1005   1HB   ARG  48          1HB       ARG  48  13.593  12.371  -3.926
 1006   2HB   ARG  48          2HB       ARG  48  14.130  10.696  -3.898
 1007   1HG   ARG  48          1HG       ARG  48  16.366  11.278  -3.708
 1008   2HG   ARG  48          2HG       ARG  48  16.090  12.914  -4.315
 1009   1HD   ARG  48          1HD       ARG  48  14.759  12.057  -1.790
 1010   2HD   ARG  48          2HD       ARG  48  16.475  12.456  -1.756
 1011    HE   ARG  48           HE       ARG  48  14.308  14.310  -2.532
 1012   1HH1  ARG  48          1HH1      ARG  48  17.528  13.707  -1.278
 1013   2HH1  ARG  48          2HH1      ARG  48  17.886  15.393  -1.058
 1014   1HH2  ARG  48          1HH2      ARG  48  14.756  16.516  -2.203
 1015   2HH2  ARG  48          2HH2      ARG  48  16.318  16.995  -1.585
 1016    H    PHE  49           H        PHE  49  12.486   9.944  -6.157
 1017    HA   PHE  49           HA       PHE  49  14.041   7.580  -6.306
 1018   1HB   PHE  49          1HB       PHE  49  11.371   8.095  -6.041
 1019   2HB   PHE  49          2HB       PHE  49  11.454   7.548  -7.713
 1020    HD1  PHE  49           HD1      PHE  49  12.061   6.604  -4.215
 1021    HD2  PHE  49           HD2      PHE  49  11.928   5.295  -8.257
 1022    HE1  PHE  49           HE1      PHE  49  12.159   4.268  -3.456
 1023    HE2  PHE  49           HE2      PHE  49  12.012   2.960  -7.508
 1024    HZ   PHE  49           HZ       PHE  49  12.136   2.444  -5.109
 1025    H    LYS  50           H        LYS  50  12.625   9.708  -8.746
 1026    HA   LYS  50           HA       LYS  50  13.420   8.224 -11.011
 1027   1HB   LYS  50          1HB       LYS  50  12.664  11.088 -10.533
 1028   2HB   LYS  50          2HB       LYS  50  13.309  10.604 -12.096
 1029   1HG   LYS  50          1HG       LYS  50  10.804   9.619 -10.758
 1030   2HG   LYS  50          2HG       LYS  50  10.944  10.562 -12.245
 1031   1HD   LYS  50          1HD       LYS  50  12.472   8.102 -12.382
 1032   2HD   LYS  50          2HD       LYS  50  10.766   7.798 -12.042
 1033   1HE   LYS  50          1HE       LYS  50  10.190   8.282 -14.133
 1034   2HE   LYS  50          2HE       LYS  50  11.055   9.818 -14.072
 1035   1HZ   LYS  50          1HZ       LYS  50  11.762   7.988 -15.746
 1036   2HZ   LYS  50          2HZ       LYS  50  12.574   7.322 -14.418
 1037   3HZ   LYS  50          3HZ       LYS  50  12.948   8.890 -14.941
 1038    H    ALA  51           H        ALA  51  15.004  10.694  -9.079
 1039    HA   ALA  51           HA       ALA  51  17.320  10.982 -10.694
 1040   1HB   ALA  51          1HB       ALA  51  17.051  11.415  -7.722
 1041   2HB   ALA  51          2HB       ALA  51  16.622  12.602  -8.957
 1042   3HB   ALA  51          3HB       ALA  51  18.298  12.078  -8.780
 1043    H    ALA  52           H        ALA  52  16.539   8.966  -7.879
 1044    HA   ALA  52           HA       ALA  52  19.033   7.702  -7.617
 1045   1HB   ALA  52          1HB       ALA  52  17.551   5.832  -6.580
 1046   2HB   ALA  52          2HB       ALA  52  16.251   7.006  -6.782
 1047   3HB   ALA  52          3HB       ALA  52  17.654   7.405  -5.788
 1048    H    CYS  53           H        CYS  53  16.186   6.878  -9.555
 1049    HA   CYS  53           HA       CYS  53  17.036   4.385 -10.514
 1050   1HB   CYS  53          1HB       CYS  53  15.348   6.469 -11.918
 1051   2HB   CYS  53          2HB       CYS  53  15.485   4.783 -12.400
 1052    HG   CYS  53           HG       CYS  53  14.239   5.778  -9.376
 1053    H    ALA  54           H        ALA  54  17.624   7.656 -11.711
 1054    HA   ALA  54           HA       ALA  54  19.101   6.788 -14.005
 1055   1HB   ALA  54          1HB       ALA  54  17.960   8.887 -14.106
 1056   2HB   ALA  54          2HB       ALA  54  19.694   9.198 -14.202
 1057   3HB   ALA  54          3HB       ALA  54  18.828   9.484 -12.691
 1058    H    ARG  55           H        ARG  55  19.944   8.009 -10.791
 1059    HA   ARG  55           HA       ARG  55  22.722   8.194 -11.242
 1060   1HB   ARG  55          1HB       ARG  55  21.007   8.049  -8.790
 1061   2HB   ARG  55          2HB       ARG  55  22.757   7.955  -8.639
 1062   1HG   ARG  55          1HG       ARG  55  22.936  10.108  -9.847
 1063   2HG   ARG  55          2HG       ARG  55  21.175  10.206  -9.860
 1064   1HD   ARG  55          1HD       ARG  55  21.252  11.165  -7.860
 1065   2HD   ARG  55          2HD       ARG  55  21.925   9.672  -7.203
 1066    HE   ARG  55           HE       ARG  55  23.818  11.493  -8.451
 1067   1HH1  ARG  55          1HH1      ARG  55  22.285  10.457  -5.477
 1068   2HH1  ARG  55          2HH1      ARG  55  23.592  11.007  -4.461
 1069   1HH2  ARG  55          1HH2      ARG  55  25.540  12.204  -7.140
 1070   2HH2  ARG  55          2HH2      ARG  55  25.437  12.032  -5.409
 1071    H    LYS  56           H        LYS  56  20.748   5.613  -9.816
 1072    HA   LYS  56           HA       LYS  56  22.970   3.840  -9.433
 1073   1HB   LYS  56          1HB       LYS  56  19.984   3.564  -9.283
 1074   2HB   LYS  56          2HB       LYS  56  21.000   2.129  -9.262
 1075   1HG   LYS  56          1HG       LYS  56  21.249   4.421  -7.325
 1076   2HG   LYS  56          2HG       LYS  56  20.362   2.927  -7.012
 1077   1HD   LYS  56          1HD       LYS  56  22.398   1.633  -7.265
 1078   2HD   LYS  56          2HD       LYS  56  23.302   3.093  -7.674
 1079   1HE   LYS  56          1HE       LYS  56  21.963   3.540  -5.210
 1080   2HE   LYS  56          2HE       LYS  56  22.780   1.980  -5.112
 1081   1HZ   LYS  56          1HZ       LYS  56  23.958   4.641  -5.627
 1082   2HZ   LYS  56          2HZ       LYS  56  24.789   3.216  -6.025
 1083   3HZ   LYS  56          3HZ       LYS  56  24.359   3.526  -4.414
 1084    H    GLY  57           H        GLY  57  20.508   4.320 -11.908
 1085   1HA   GLY  57          1HA       GLY  57  20.737   3.829 -14.186
 1086   2HA   GLY  57          2HA       GLY  57  22.165   2.871 -13.814
 1087    H    THR  58           H        THR  58  18.662   2.876 -13.197
 1088    HA   THR  58           HA       THR  58  18.352   0.215 -14.204
 1089    HB   THR  58           HB       THR  58  19.403  -0.139 -11.936
 1090    HG1  THR  58           HG1      THR  58  17.738  -1.736 -11.326
 1091   1HG2  THR  58          1HG2      THR  58  18.366   0.424  -9.965
 1092   2HG2  THR  58          2HG2      THR  58  16.761   0.460 -10.694
 1093   3HG2  THR  58          3HG2      THR  58  17.887   1.787 -10.975
 1094    H    SER  59           H        SER  59  16.023  -0.584 -13.200
 1095    HA   SER  59           HA       SER  59  14.192   1.461 -14.129
 1096   1HB   SER  59          1HB       SER  59  12.766  -0.844 -13.372
 1097   2HB   SER  59          2HB       SER  59  13.220  -0.358 -15.006
 1098    HG   SER  59           HG       SER  59  14.139  -2.405 -13.529
 1099    H    ILE  60           H        ILE  60  12.277   2.040 -12.970
 1100    HA   ILE  60           HA       ILE  60  12.761   2.956 -10.424
 1101    HB   ILE  60           HB       ILE  60  11.056   3.978 -11.743
 1102   1HG1  ILE  60          1HG1      ILE  60   9.197   2.924  -9.739
 1103   2HG1  ILE  60          2HG1      ILE  60  10.752   3.407  -9.068
 1104   1HG2  ILE  60          1HG2      ILE  60   8.901   2.881 -12.224
 1105   2HG2  ILE  60          2HG2      ILE  60   9.546   1.377 -11.571
 1106   3HG2  ILE  60          3HG2      ILE  60  10.263   2.091 -13.014
 1107   1HD1  ILE  60          1HD1      ILE  60   9.740   5.388 -10.906
 1108   2HD1  ILE  60          2HD1      ILE  60  10.232   5.552  -9.221
 1109   3HD1  ILE  60          3HD1      ILE  60   8.589   5.045  -9.612
 1110    H    THR  61           H        THR  61  10.940   0.033 -11.318
 1111    HA   THR  61           HA       THR  61  10.119  -0.620  -8.726
 1112    HB   THR  61           HB       THR  61  10.594  -2.802 -10.694
 1113    HG1  THR  61           HG1      THR  61   8.523  -0.858 -11.030
 1114   1HG2  THR  61          1HG2      THR  61   9.096  -2.491  -8.378
 1115   2HG2  THR  61          2HG2      THR  61   8.933  -3.791  -9.557
 1116   3HG2  THR  61          3HG2      THR  61   7.905  -2.364  -9.672
 1117    H    ASP  62           H        ASP  62  13.105  -1.284 -10.427
 1118    HA   ASP  62           HA       ASP  62  14.059  -3.298  -8.653
 1119   1HB   ASP  62          1HB       ASP  62  14.929  -2.976 -10.957
 1120   2HB   ASP  62          2HB       ASP  62  15.649  -1.453 -10.448
 1121    H    VAL  63           H        VAL  63  14.217   0.202  -8.727
 1122    HA   VAL  63           HA       VAL  63  16.125   0.517  -6.641
 1123    HB   VAL  63           HB       VAL  63  13.921   2.488  -7.196
 1124   1HG1  VAL  63          1HG1      VAL  63  15.222   4.025  -6.149
 1125   2HG1  VAL  63          2HG1      VAL  63  16.726   3.276  -6.684
 1126   3HG1  VAL  63          3HG1      VAL  63  15.828   2.581  -5.335
 1127   1HG2  VAL  63          1HG2      VAL  63  15.944   1.559  -9.035
 1128   2HG2  VAL  63          2HG2      VAL  63  16.125   3.278  -8.695
 1129   3HG2  VAL  63          3HG2      VAL  63  14.594   2.656  -9.313
 1130    H    VAL  64           H        VAL  64  12.603   0.190  -6.718
 1131    HA   VAL  64           HA       VAL  64  12.163   0.749  -3.989
 1132    HB   VAL  64           HB       VAL  64  10.445  -1.259  -5.394
 1133   1HG1  VAL  64          1HG1      VAL  64  10.251  -0.093  -2.979
 1134   2HG1  VAL  64          2HG1      VAL  64   8.854  -0.617  -3.920
 1135   3HG1  VAL  64          3HG1      VAL  64   9.355   1.072  -3.953
 1136   1HG2  VAL  64          1HG2      VAL  64   9.178   0.797  -6.291
 1137   2HG2  VAL  64          2HG2      VAL  64  10.599   0.236  -7.172
 1138   3HG2  VAL  64          3HG2      VAL  64  10.716   1.636  -6.107
 1139    H    ASN  65           H        ASN  65  12.946  -2.193  -5.733
 1140    HA   ASN  65           HA       ASN  65  12.763  -3.944  -3.500
 1141   1HB   ASN  65          1HB       ASN  65  13.037  -4.325  -6.175
 1142   2HB   ASN  65          2HB       ASN  65  14.681  -4.643  -5.632
 1143   1HD2  ASN  65          1HD2      ASN  65  12.123  -6.220  -6.534
 1144   2HD2  ASN  65          2HD2      ASN  65  12.131  -7.566  -5.441
 1145    H    GLN  66           H        GLN  66  15.208  -1.777  -4.688
 1146    HA   GLN  66           HA       GLN  66  17.419  -2.857  -3.257
 1147   1HB   GLN  66          1HB       GLN  66  16.831  -0.284  -4.647
 1148   2HB   GLN  66          2HB       GLN  66  18.194  -0.341  -3.537
 1149   1HG   GLN  66          1HG       GLN  66  17.881  -2.383  -5.697
 1150   2HG   GLN  66          2HG       GLN  66  18.605  -0.808  -6.024
 1151   1HE2  GLN  66          1HE2      GLN  66  19.688  -3.582  -6.007
 1152   2HE2  GLN  66          2HE2      GLN  66  21.089  -3.498  -4.983
 1153    H    LEU  67           H        LEU  67  15.050  -0.305  -2.517
 1154    HA   LEU  67           HA       LEU  67  16.192   0.461  -0.043
 1155   1HB   LEU  67          1HB       LEU  67  13.281   0.592  -0.099
 1156   2HB   LEU  67          2HB       LEU  67  14.455   1.863   0.161
 1157    HG   LEU  67           HG       LEU  67  14.231   0.950  -2.631
 1158   1HD1  LEU  67          1HD1      LEU  67  11.869   1.530  -1.103
 1159   2HD1  LEU  67          2HD1      LEU  67  12.024   1.044  -2.791
 1160   3HD1  LEU  67          3HD1      LEU  67  12.118   2.749  -2.351
 1161   1HD2  LEU  67          1HD2      LEU  67  14.356   3.312  -3.070
 1162   2HD2  LEU  67          2HD2      LEU  67  15.577   2.889  -1.870
 1163   3HD2  LEU  67          3HD2      LEU  67  14.084   3.681  -1.369
 1164    H    VAL  68           H        VAL  68  13.784  -1.959  -0.959
 1165    HA   VAL  68           HA       VAL  68  13.177  -2.851   1.657
 1166    HB   VAL  68           HB       VAL  68  13.052  -4.488  -0.881
 1167   1HG1  VAL  68          1HG1      VAL  68  11.034  -5.399   0.587
 1168   2HG1  VAL  68          2HG1      VAL  68  12.074  -4.852   1.902
 1169   3HG1  VAL  68          3HG1      VAL  68  12.668  -6.045   0.744
 1170   1HG2  VAL  68          1HG2      VAL  68  11.830  -2.217  -0.815
 1171   2HG2  VAL  68          2HG2      VAL  68  10.747  -3.013   0.327
 1172   3HG2  VAL  68          3HG2      VAL  68  10.930  -3.650  -1.307
 1173    H    ASP  69           H        ASP  69  15.670  -3.727  -0.664
 1174    HA   ASP  69           HA       ASP  69  16.653  -6.062   0.484
 1175   1HB   ASP  69          1HB       ASP  69  17.743  -3.961  -1.284
 1176   2HB   ASP  69          2HB       ASP  69  18.949  -4.836  -0.347
 1177    H    ASN  70           H        ASN  70  17.810  -2.764   0.966
 1178    HA   ASN  70           HA       ASN  70  19.584  -3.382   3.053
 1179   1HB   ASN  70          1HB       ASN  70  18.293  -0.803   2.167
 1180   2HB   ASN  70          2HB       ASN  70  19.438  -0.870   3.505
 1181   1HD2  ASN  70          1HD2      ASN  70  19.034  -1.518   0.066
 1182   2HD2  ASN  70          2HD2      ASN  70  20.710  -1.402  -0.340
 1183    H    TRP  71           H        TRP  71  16.209  -2.337   3.072
 1184    HA   TRP  71           HA       TRP  71  15.959  -1.960   5.855
 1185   1HB   TRP  71          1HB       TRP  71  14.311  -1.201   4.136
 1186   2HB   TRP  71          2HB       TRP  71  13.810  -2.875   3.935
 1187    HD1  TRP  71           HD1      TRP  71  13.594   0.036   6.383
 1188    HE1  TRP  71           HE1      TRP  71  11.752  -0.442   8.111
 1189    HE3  TRP  71           HE3      TRP  71  12.513  -4.785   5.070
 1190    HZ2  TRP  71           HZ2      TRP  71  10.066  -2.584   8.820
 1191    HZ3  TRP  71           HZ3      TRP  71  10.749  -5.968   6.310
 1192    HH2  TRP  71           HH2      TRP  71   9.543  -4.886   8.150
 1193    H    LEU  72           H        LEU  72  14.851  -4.695   3.884
 1194    HA   LEU  72           HA       LEU  72  13.942  -6.257   5.957
 1195   1HB   LEU  72          1HB       LEU  72  13.883  -6.446   3.299
 1196   2HB   LEU  72          2HB       LEU  72  15.125  -7.641   3.620
 1197    HG   LEU  72           HG       LEU  72  13.086  -8.259   5.418
 1198   1HD1  LEU  72          1HD1      LEU  72  11.957  -6.743   3.343
 1199   2HD1  LEU  72          2HD1      LEU  72  11.119  -7.707   4.561
 1200   3HD1  LEU  72          3HD1      LEU  72  11.551  -8.426   3.009
 1201   1HD2  LEU  72          1HD2      LEU  72  13.276 -10.295   4.476
 1202   2HD2  LEU  72          2HD2      LEU  72  14.662  -9.564   3.667
 1203   3HD2  LEU  72          3HD2      LEU  72  13.112  -9.672   2.837
 1204    H    LYS  73           H        LYS  73  17.168  -6.281   4.494
 1205    HA   LYS  73           HA       LYS  73  17.920  -8.543   6.096
 1206   1HB   LYS  73          1HB       LYS  73  19.639  -6.860   4.269
 1207   2HB   LYS  73          2HB       LYS  73  20.012  -8.471   4.878
 1208   1HG   LYS  73          1HG       LYS  73  18.520  -9.502   3.461
 1209   2HG   LYS  73          2HG       LYS  73  17.497  -8.070   3.334
 1210   1HD   LYS  73          1HD       LYS  73  18.679  -7.212   1.619
 1211   2HD   LYS  73          2HD       LYS  73  20.225  -7.763   2.269
 1212   1HE   LYS  73          1HE       LYS  73  19.978  -9.899   1.352
 1213   2HE   LYS  73          2HE       LYS  73  18.246  -9.689   1.107
 1214   1HZ   LYS  73          1HZ       LYS  73  20.267  -8.076  -0.345
 1215   2HZ   LYS  73          2HZ       LYS  73  18.616  -8.251  -0.705
 1216   3HZ   LYS  73          3HZ       LYS  73  19.681  -9.554  -0.937
 1217    H    GLU  74           H        GLU  74  18.281  -5.082   6.381
 1218    HA   GLU  74           HA       GLU  74  20.357  -5.413   8.405
 1219   1HB   GLU  74          1HB       GLU  74  19.194  -3.067   6.972
 1220   2HB   GLU  74          2HB       GLU  74  20.020  -2.810   8.503
 1221   1HG   GLU  74          1HG       GLU  74  21.271  -4.280   6.200
 1222   2HG   GLU  74          2HG       GLU  74  21.406  -2.534   6.415
 1223    H    ASN  75           H        ASN  75  16.977  -4.379   8.189
 1224    HA   ASN  75           HA       ASN  75  16.776  -3.517  10.873
 1225   1HB   ASN  75          1HB       ASN  75  14.691  -2.892  10.309
 1226   2HB   ASN  75          2HB       ASN  75  15.154  -3.349   8.675
 1227   1HD2  ASN  75          1HD2      ASN  75  14.480  -5.400   7.880
 1228   2HD2  ASN  75          2HD2      ASN  75  13.114  -6.204   8.568
 1229    H    GLU  76           H        GLU  76  16.688  -6.648   9.450
 1230    HA   GLU  76           HA       GLU  76  15.665  -7.795  11.949
 1231   1HB   GLU  76          1HB       GLU  76  15.505  -8.585   9.107
 1232   2HB   GLU  76          2HB       GLU  76  15.753  -9.901  10.246
 1233   1HG   GLU  76          1HG       GLU  76  13.713  -8.209  11.272
 1234   2HG   GLU  76          2HG       GLU  76  13.348  -8.565   9.583
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1 -14.416  50.972 -76.070
    2   2H    MET   1          2H        MET   1 -15.908  51.775 -76.089
    3   3H    MET   1          3H        MET   1 -15.015  51.613 -77.522
    4    HA   MET   1           HA       MET   1 -17.031  50.044 -76.958
    5   1HB   MET   1          1HB       MET   1 -15.223  50.165 -78.889
    6   2HB   MET   1          2HB       MET   1 -14.593  48.730 -78.091
    7   1HG   MET   1          1HG       MET   1 -17.326  48.279 -78.313
    8   2HG   MET   1          2HG       MET   1 -16.859  49.020 -79.843
    9   1HE   MET   1          1HE       MET   1 -15.321  46.394 -81.811
   10   2HE   MET   1          2HE       MET   1 -14.419  47.797 -81.242
   11   3HE   MET   1          3HE       MET   1 -16.127  47.954 -81.651
   12    H    SER   2           H        SER   2 -16.741  49.934 -74.496
   13    HA   SER   2           HA       SER   2 -15.627  47.293 -73.842
   14   1HB   SER   2          1HB       SER   2 -15.420  48.889 -71.516
   15   2HB   SER   2          2HB       SER   2 -14.108  48.214 -72.479
   16    HG   SER   2           HG       SER   2 -15.335  50.759 -72.707
   17    H    LEU   3           H        LEU   3 -17.072  45.996 -72.927
   18    HA   LEU   3           HA       LEU   3 -19.716  46.876 -72.380
   19   1HB   LEU   3          1HB       LEU   3 -18.708  44.300 -71.268
   20   2HB   LEU   3          2HB       LEU   3 -20.256  44.665 -72.007
   21    HG   LEU   3           HG       LEU   3 -17.843  44.734 -73.747
   22   1HD1  LEU   3          1HD1      LEU   3 -17.783  42.657 -72.236
   23   2HD1  LEU   3          2HD1      LEU   3 -17.670  42.422 -73.981
   24   3HD1  LEU   3          3HD1      LEU   3 -19.196  42.129 -73.147
   25   1HD2  LEU   3          1HD2      LEU   3 -19.603  43.557 -75.222
   26   2HD2  LEU   3          2HD2      LEU   3 -19.781  45.281 -74.890
   27   3HD2  LEU   3          3HD2      LEU   3 -20.754  44.107 -74.005
   28    H    GLU   4           H        GLU   4 -16.930  46.156 -70.383
   29    HA   GLU   4           HA       GLU   4 -16.452  46.460 -68.194
   30   1HB   GLU   4          1HB       GLU   4 -18.530  48.624 -68.539
   31   2HB   GLU   4          2HB       GLU   4 -17.574  48.427 -67.076
   32   1HG   GLU   4          1HG       GLU   4 -16.353  48.814 -69.793
   33   2HG   GLU   4          2HG       GLU   4 -16.750  50.148 -68.710
   34    H    LYS   5           H        LYS   5 -18.017  44.314 -68.600
   35    HA   LYS   5           HA       LYS   5 -20.355  44.358 -66.930
   36   1HB   LYS   5          1HB       LYS   5 -18.853  42.233 -68.422
   37   2HB   LYS   5          2HB       LYS   5 -20.071  41.779 -67.237
   38   1HG   LYS   5          1HG       LYS   5 -21.797  42.530 -68.509
   39   2HG   LYS   5          2HG       LYS   5 -20.827  43.793 -69.273
   40   1HD   LYS   5          1HD       LYS   5 -20.326  42.478 -71.002
   41   2HD   LYS   5          2HD       LYS   5 -19.854  41.149 -69.941
   42   1HE   LYS   5          1HE       LYS   5 -21.636  40.229 -71.073
   43   2HE   LYS   5          2HE       LYS   5 -22.420  40.855 -69.622
   44   1HZ   LYS   5          1HZ       LYS   5 -22.537  41.860 -72.379
   45   2HZ   LYS   5          2HZ       LYS   5 -22.737  42.954 -71.098
   46   3HZ   LYS   5          3HZ       LYS   5 -23.789  41.635 -71.257
   47    H    ALA   6           H        ALA   6 -17.089  43.005 -66.659
   48    HA   ALA   6           HA       ALA   6 -17.571  42.373 -63.847
   49   1HB   ALA   6          1HB       ALA   6 -14.892  41.945 -65.018
   50   2HB   ALA   6          2HB       ALA   6 -16.207  40.974 -65.686
   51   3HB   ALA   6          3HB       ALA   6 -15.850  40.909 -63.960
   52    H    HIS   7           H        HIS   7 -17.178  43.867 -62.367
   53    HA   HIS   7           HA       HIS   7 -14.933  45.714 -62.760
   54   1HB   HIS   7          1HB       HIS   7 -17.653  46.440 -63.084
   55   2HB   HIS   7          2HB       HIS   7 -17.102  47.156 -61.571
   56    HD1  HIS   7           HD1      HIS   7 -16.426  49.490 -61.992
   57    HD2  HIS   7           HD2      HIS   7 -15.358  46.969 -65.122
   58    HE1  HIS   7           HE1      HIS   7 -15.199  50.940 -63.642
   59    HE2  HIS   7           HE2      HIS   7 -14.771  49.440 -65.628
   60    H    THR   8           H        THR   8 -14.658  43.660 -61.129
   61    HA   THR   8           HA       THR   8 -15.444  44.437 -58.436
   62    HB   THR   8           HB       THR   8 -13.616  42.139 -59.043
   63    HG1  THR   8           HG1      THR   8 -16.430  42.283 -59.481
   64   1HG2  THR   8          1HG2      THR   8 -14.488  43.014 -56.698
   65   2HG2  THR   8          2HG2      THR   8 -14.314  41.293 -57.032
   66   3HG2  THR   8          3HG2      THR   8 -15.902  42.052 -57.136
   67    H    SER   9           H        SER   9 -14.146  46.473 -58.868
   68    HA   SER   9           HA       SER   9 -11.292  46.269 -58.841
   69   1HB   SER   9          1HB       SER   9 -12.443  48.835 -58.010
   70   2HB   SER   9          2HB       SER   9 -11.375  48.464 -59.366
   71    HG   SER   9           HG       SER   9 -13.213  47.673 -60.492
   72    H    VAL  10           H        VAL  10 -13.612  45.872 -56.489
   73    HA   VAL  10           HA       VAL  10 -12.219  47.009 -54.254
   74    HB   VAL  10           HB       VAL  10 -13.799  45.336 -52.981
   75   1HG1  VAL  10          1HG1      VAL  10 -14.724  47.770 -54.495
   76   2HG1  VAL  10          2HG1      VAL  10 -14.111  47.694 -52.843
   77   3HG1  VAL  10          3HG1      VAL  10 -15.675  46.981 -53.236
   78   1HG2  VAL  10          1HG2      VAL  10 -14.660  43.920 -54.582
   79   2HG2  VAL  10          2HG2      VAL  10 -14.764  45.191 -55.803
   80   3HG2  VAL  10          3HG2      VAL  10 -15.935  45.138 -54.483
   81    H    LYS  11           H        LYS  11 -10.172  46.236 -54.100
   82    HA   LYS  11           HA       LYS  11  -9.867  43.320 -53.816
   83   1HB   LYS  11          1HB       LYS  11  -8.802  44.235 -55.856
   84   2HB   LYS  11          2HB       LYS  11  -7.830  45.301 -54.853
   85   1HG   LYS  11          1HG       LYS  11  -7.356  42.798 -53.790
   86   2HG   LYS  11          2HG       LYS  11  -7.437  42.513 -55.531
   87   1HD   LYS  11          1HD       LYS  11  -5.358  43.287 -55.707
   88   2HD   LYS  11          2HD       LYS  11  -5.940  44.868 -55.180
   89   1HE   LYS  11          1HE       LYS  11  -5.620  44.145 -52.830
   90   2HE   LYS  11          2HE       LYS  11  -4.924  42.638 -53.420
   91   1HZ   LYS  11          1HZ       LYS  11  -3.105  43.780 -54.347
   92   2HZ   LYS  11          2HZ       LYS  11  -3.301  44.429 -52.792
   93   3HZ   LYS  11          3HZ       LYS  11  -3.833  45.297 -54.146
   94    H    LYS  12           H        LYS  12  -9.786  42.958 -51.693
   95    HA   LYS  12           HA       LYS  12  -8.033  44.686 -50.080
   96   1HB   LYS  12          1HB       LYS  12 -10.624  44.257 -49.596
   97   2HB   LYS  12          2HB       LYS  12  -9.974  42.841 -48.779
   98   1HG   LYS  12          1HG       LYS  12  -8.871  44.091 -47.194
   99   2HG   LYS  12          2HG       LYS  12  -8.816  45.530 -48.216
  100   1HD   LYS  12          1HD       LYS  12 -10.868  46.220 -47.580
  101   2HD   LYS  12          2HD       LYS  12 -11.512  44.578 -47.511
  102   1HE   LYS  12          1HE       LYS  12  -9.573  44.835 -45.457
  103   2HE   LYS  12          2HE       LYS  12 -10.633  46.242 -45.374
  104   1HZ   LYS  12          1HZ       LYS  12 -12.538  44.800 -45.253
  105   2HZ   LYS  12          2HZ       LYS  12 -11.439  44.366 -44.038
  106   3HZ   LYS  12          3HZ       LYS  12 -11.567  43.421 -45.444
  107    H    MET  13           H        MET  13  -6.121  43.815 -49.759
  108    HA   MET  13           HA       MET  13  -5.875  40.895 -49.606
  109   1HB   MET  13          1HB       MET  13  -4.415  42.650 -51.060
  110   2HB   MET  13          2HB       MET  13  -3.443  42.584 -49.595
  111   1HG   MET  13          1HG       MET  13  -3.998  39.935 -50.134
  112   2HG   MET  13          2HG       MET  13  -3.732  40.644 -51.726
  113   1HE   MET  13          1HE       MET  13  -2.436  38.654 -49.374
  114   2HE   MET  13          2HE       MET  13  -1.762  39.781 -48.195
  115   3HE   MET  13          3HE       MET  13  -0.691  38.888 -49.274
  116    H    THR  14           H        THR  14  -7.030  41.578 -47.424
  117    HA   THR  14           HA       THR  14  -5.042  42.250 -45.387
  118    HB   THR  14           HB       THR  14  -7.167  42.302 -43.929
  119    HG1  THR  14           HG1      THR  14  -8.800  41.553 -45.129
  120   1HG2  THR  14          1HG2      THR  14  -6.086  44.245 -45.828
  121   2HG2  THR  14          2HG2      THR  14  -6.491  44.433 -44.122
  122   3HG2  THR  14          3HG2      THR  14  -7.751  44.575 -45.346
  123    H    PHE  15           H        PHE  15  -4.393  40.859 -43.853
  124    HA   PHE  15           HA       PHE  15  -5.297  38.100 -44.065
  125   1HB   PHE  15          1HB       PHE  15  -3.398  37.479 -42.785
  126   2HB   PHE  15          2HB       PHE  15  -2.840  38.716 -43.902
  127    HD1  PHE  15           HD1      PHE  15  -3.217  37.753 -40.460
  128    HD2  PHE  15           HD2      PHE  15  -2.464  41.041 -43.050
  129    HE1  PHE  15           HE1      PHE  15  -2.319  39.034 -38.564
  130    HE2  PHE  15           HE2      PHE  15  -1.560  42.331 -41.162
  131    HZ   PHE  15           HZ       PHE  15  -1.439  41.308 -38.922
  132    H    GLY  16           H        GLY  16  -5.608  40.869 -42.019
  133   1HA   GLY  16          1HA       GLY  16  -7.268  41.229 -40.439
  134   2HA   GLY  16          2HA       GLY  16  -7.701  39.529 -40.536
  135    H    GLU  17           H        GLU  17  -6.150  41.919 -38.724
  136    HA   GLU  17           HA       GLU  17  -4.379  40.236 -37.229
  137   1HB   GLU  17          1HB       GLU  17  -4.354  42.822 -37.530
  138   2HB   GLU  17          2HB       GLU  17  -5.517  42.821 -36.211
  139   1HG   GLU  17          1HG       GLU  17  -3.429  41.174 -35.365
  140   2HG   GLU  17          2HG       GLU  17  -2.664  42.567 -36.130
  141    H    ASN  18           H        ASN  18  -7.556  41.662 -36.661
  142    HA   ASN  18           HA       ASN  18  -9.266  41.157 -35.260
  143   1HB   ASN  18          1HB       ASN  18  -8.527  38.853 -36.612
  144   2HB   ASN  18          2HB       ASN  18  -8.661  38.325 -34.938
  145   1HD2  ASN  18          1HD2      ASN  18 -10.548  37.339 -34.752
  146   2HD2  ASN  18          2HD2      ASN  18 -12.073  37.963 -35.298
  147    H    ARG  19           H        ARG  19  -7.370  42.260 -33.800
  148    HA   ARG  19           HA       ARG  19  -6.444  42.478 -31.730
  149   1HB   ARG  19          1HB       ARG  19  -8.933  42.429 -31.283
  150   2HB   ARG  19          2HB       ARG  19  -8.749  40.738 -30.840
  151   1HG   ARG  19          1HG       ARG  19  -8.410  41.463 -28.769
  152   2HG   ARG  19          2HG       ARG  19  -6.822  41.992 -29.329
  153   1HD   ARG  19          1HD       ARG  19  -8.850  43.921 -30.015
  154   2HD   ARG  19          2HD       ARG  19  -8.871  43.580 -28.286
  155    HE   ARG  19           HE       ARG  19  -6.715  44.454 -28.092
  156   1HH1  ARG  19          1HH1      ARG  19  -7.900  44.582 -31.389
  157   2HH1  ARG  19          2HH1      ARG  19  -6.585  45.573 -31.960
  158   1HH2  ARG  19          1HH2      ARG  19  -5.024  45.827 -28.825
  159   2HH2  ARG  19          2HH2      ARG  19  -4.982  46.319 -30.498
  160    H    ASP  20           H        ASP  20  -4.817  40.905 -32.810
  161    HA   ASP  20           HA       ASP  20  -4.785  38.269 -31.582
  162   1HB   ASP  20          1HB       ASP  20  -4.051  38.953 -34.022
  163   2HB   ASP  20          2HB       ASP  20  -2.509  39.276 -33.230
  164    H    LEU  21           H        LEU  21  -4.662  39.379 -29.447
  165    HA   LEU  21           HA       LEU  21  -1.893  39.380 -28.583
  166   1HB   LEU  21          1HB       LEU  21  -3.114  41.795 -29.092
  167   2HB   LEU  21          2HB       LEU  21  -3.404  41.580 -27.376
  168    HG   LEU  21           HG       LEU  21  -0.793  41.035 -27.394
  169   1HD1  LEU  21          1HD1      LEU  21   0.416  41.850 -29.101
  170   2HD1  LEU  21          2HD1      LEU  21  -0.661  43.228 -29.344
  171   3HD1  LEU  21          3HD1      LEU  21  -1.083  41.648 -30.010
  172   1HD2  LEU  21          1HD2      LEU  21  -2.193  42.883 -26.241
  173   2HD2  LEU  21          2HD2      LEU  21  -1.602  43.911 -27.546
  174   3HD2  LEU  21          3HD2      LEU  21  -0.460  43.127 -26.455
  175    H    GLU  22           H        GLU  22  -4.005  37.550 -28.264
  176    HA   GLU  22           HA       GLU  22  -4.931  37.902 -25.513
  177   1HB   GLU  22          1HB       GLU  22  -5.457  35.453 -27.164
  178   2HB   GLU  22          2HB       GLU  22  -6.430  36.146 -25.876
  179   1HG   GLU  22          1HG       GLU  22  -7.531  37.513 -27.264
  180   2HG   GLU  22          2HG       GLU  22  -6.100  37.863 -28.232
  181    H    ARG  23           H        ARG  23  -3.431  37.435 -24.037
  182    HA   ARG  23           HA       ARG  23  -1.578  35.228 -24.547
  183   1HB   ARG  23          1HB       ARG  23  -1.536  37.644 -22.790
  184   2HB   ARG  23          2HB       ARG  23  -0.575  36.246 -22.325
  185   1HG   ARG  23          1HG       ARG  23  -0.215  36.923 -25.117
  186   2HG   ARG  23          2HG       ARG  23   0.177  38.271 -24.046
  187   1HD   ARG  23          1HD       ARG  23   1.406  36.326 -22.711
  188   2HD   ARG  23          2HD       ARG  23   1.470  35.619 -24.325
  189    HE   ARG  23           HE       ARG  23   2.431  37.983 -24.893
  190   1HH1  ARG  23          1HH1      ARG  23   3.088  36.057 -22.032
  191   2HH1  ARG  23          2HH1      ARG  23   4.691  36.702 -21.816
  192   1HH2  ARG  23          1HH2      ARG  23   4.521  38.817 -24.621
  193   2HH2  ARG  23          2HH2      ARG  23   5.525  38.258 -23.310
  194    H    VAL  24           H        VAL  24  -2.397  33.341 -23.943
  195    HA   VAL  24           HA       VAL  24  -4.190  33.020 -21.720
  196    HB   VAL  24           HB       VAL  24  -2.664  30.829 -23.132
  197   1HG1  VAL  24          1HG1      VAL  24  -5.451  30.603 -22.096
  198   2HG1  VAL  24          2HG1      VAL  24  -4.097  30.518 -20.971
  199   3HG1  VAL  24          3HG1      VAL  24  -4.222  29.357 -22.291
  200   1HG2  VAL  24          1HG2      VAL  24  -4.120  32.587 -24.533
  201   2HG2  VAL  24          2HG2      VAL  24  -5.406  31.493 -24.025
  202   3HG2  VAL  24          3HG2      VAL  24  -4.035  30.872 -24.942
  203    H    VAL  25           H        VAL  25  -3.671  32.650 -19.646
  204    HA   VAL  25           HA       VAL  25  -0.930  31.768 -19.033
  205    HB   VAL  25           HB       VAL  25  -1.439  33.358 -16.896
  206   1HG1  VAL  25          1HG1      VAL  25   0.533  33.152 -18.601
  207   2HG1  VAL  25          2HG1      VAL  25   0.356  34.593 -17.601
  208   3HG1  VAL  25          3HG1      VAL  25  -0.177  34.615 -19.282
  209   1HG2  VAL  25          1HG2      VAL  25  -3.427  34.163 -18.570
  210   2HG2  VAL  25          2HG2      VAL  25  -2.145  35.303 -18.978
  211   3HG2  VAL  25          3HG2      VAL  25  -2.706  35.168 -17.313
  212    H    THR  26           H        THR  26  -0.961  30.005 -17.851
  213    HA   THR  26           HA       THR  26  -2.835  29.766 -15.640
  214    HB   THR  26           HB       THR  26  -2.691  27.190 -16.950
  215    HG1  THR  26           HG1      THR  26  -3.508  29.413 -18.487
  216   1HG2  THR  26          1HG2      THR  26  -4.992  27.117 -16.495
  217   2HG2  THR  26          2HG2      THR  26  -5.147  28.873 -16.533
  218   3HG2  THR  26          3HG2      THR  26  -4.317  28.090 -15.189
  219    H    ALA  27           H        ALA  27  -1.625  29.225 -13.925
  220    HA   ALA  27           HA       ALA  27   1.043  28.186 -14.292
  221   1HB   ALA  27          1HB       ALA  27   0.618  29.854 -12.574
  222   2HB   ALA  27          2HB       ALA  27   1.209  28.358 -11.849
  223   3HB   ALA  27          3HB       ALA  27  -0.506  28.759 -11.767
  224    HA   PRO  28           HA       PRO  28  -0.090  23.893 -14.289
  225   1HB   PRO  28          1HB       PRO  28   2.384  22.987 -13.393
  226   2HB   PRO  28          2HB       PRO  28   1.951  23.287 -15.078
  227   1HG   PRO  28          1HG       PRO  28   3.452  25.021 -13.168
  228   2HG   PRO  28          2HG       PRO  28   3.710  24.773 -14.905
  229   1HD   PRO  28          1HD       PRO  28   2.523  26.990 -13.966
  230   2HD   PRO  28          2HD       PRO  28   2.011  26.242 -15.493
  231    H    VAL  29           H        VAL  29  -1.206  22.866 -12.774
  232    HA   VAL  29           HA       VAL  29  -0.549  23.420  -9.968
  233    HB   VAL  29           HB       VAL  29  -2.948  22.452  -9.631
  234   1HG1  VAL  29          1HG1      VAL  29  -3.103  24.600  -9.052
  235   2HG1  VAL  29          2HG1      VAL  29  -3.637  24.921 -10.702
  236   3HG1  VAL  29          3HG1      VAL  29  -1.934  25.086 -10.277
  237   1HG2  VAL  29          1HG2      VAL  29  -3.067  23.282 -12.531
  238   2HG2  VAL  29          2HG2      VAL  29  -4.448  22.868 -11.517
  239   3HG2  VAL  29          3HG2      VAL  29  -3.248  21.638 -11.914
  240    H    SER  30           H        SER  30   0.778  21.905  -9.238
  241    HA   SER  30           HA       SER  30   0.359  19.109  -9.945
  242   1HB   SER  30          1HB       SER  30   2.507  20.170  -8.122
  243   2HB   SER  30          2HB       SER  30   2.532  18.721  -9.125
  244    HG   SER  30           HG       SER  30   3.729  20.661  -9.900
  245    H    SER  31           H        SER  31  -1.745  19.303  -8.769
  246    HA   SER  31           HA       SER  31  -1.733  19.529  -5.928
  247   1HB   SER  31          1HB       SER  31  -4.065  18.266  -7.231
  248   2HB   SER  31          2HB       SER  31  -3.991  19.661  -6.152
  249    HG   SER  31           HG       SER  31  -3.334  20.934  -7.884
  250    H    GLY  32           H        GLY  32  -1.240  16.964  -8.130
  251   1HA   GLY  32          1HA       GLY  32  -1.965  14.841  -6.312
  252   2HA   GLY  32          2HA       GLY  32  -1.155  14.660  -7.863
  253    H    LYS  33           H        LYS  33  -0.647  15.734  -4.541
  254    HA   LYS  33           HA       LYS  33   2.200  15.698  -4.779
  255   1HB   LYS  33          1HB       LYS  33   2.183  16.189  -2.358
  256   2HB   LYS  33          2HB       LYS  33   1.151  17.274  -3.277
  257   1HG   LYS  33          1HG       LYS  33  -0.772  16.439  -2.372
  258   2HG   LYS  33          2HG       LYS  33  -0.069  14.850  -2.069
  259   1HD   LYS  33          1HD       LYS  33   1.386  16.006  -0.326
  260   2HD   LYS  33          2HD       LYS  33   0.299  17.384  -0.496
  261   1HE   LYS  33          1HE       LYS  33  -1.273  15.033  -0.196
  262   2HE   LYS  33          2HE       LYS  33  -0.043  15.044   1.067
  263   1HZ   LYS  33          1HZ       LYS  33  -1.892  16.200   1.917
  264   2HZ   LYS  33          2HZ       LYS  33  -2.086  17.115   0.505
  265   3HZ   LYS  33          3HZ       LYS  33  -0.755  17.396   1.519
  266    H    ILE  34           H        ILE  34   0.197  13.183  -4.759
  267    HA   ILE  34           HA       ILE  34   2.149  11.484  -3.360
  268    HB   ILE  34           HB       ILE  34  -0.856  11.153  -3.347
  269   1HG1  ILE  34          1HG1      ILE  34   0.784  11.188  -0.868
  270   2HG1  ILE  34          2HG1      ILE  34   0.580  12.720  -1.711
  271   1HG2  ILE  34          1HG2      ILE  34   0.428   9.305  -1.619
  272   2HG2  ILE  34          2HG2      ILE  34   1.163   9.157  -3.217
  273   3HG2  ILE  34          3HG2      ILE  34  -0.583   8.975  -3.026
  274   1HD1  ILE  34          1HD1      ILE  34  -1.526  12.933  -1.021
  275   2HD1  ILE  34          2HD1      ILE  34  -1.127  11.675   0.147
  276   3HD1  ILE  34          3HD1      ILE  34  -1.911  11.251  -1.374
  277    H    LYS  35           H        LYS  35   2.909   9.851  -4.518
  278    HA   LYS  35           HA       LYS  35   1.648   9.242  -7.115
  279   1HB   LYS  35          1HB       LYS  35   4.550   9.401  -6.292
  280   2HB   LYS  35          2HB       LYS  35   4.041   8.532  -7.739
  281   1HG   LYS  35          1HG       LYS  35   3.108  11.331  -7.403
  282   2HG   LYS  35          2HG       LYS  35   4.804  11.060  -7.810
  283   1HD   LYS  35          1HD       LYS  35   4.324  10.365  -9.901
  284   2HD   LYS  35          2HD       LYS  35   2.877   9.494  -9.385
  285   1HE   LYS  35          1HE       LYS  35   1.521  11.256  -9.759
  286   2HE   LYS  35          2HE       LYS  35   2.720  12.429  -9.220
  287   1HZ   LYS  35          1HZ       LYS  35   2.932  12.916 -11.370
  288   2HZ   LYS  35          2HZ       LYS  35   2.117  11.521 -11.874
  289   3HZ   LYS  35          3HZ       LYS  35   3.776  11.456 -11.530
  290    H    ARG  36           H        ARG  36   2.181   6.928  -7.858
  291    HA   ARG  36           HA       ARG  36   2.415   5.123  -5.551
  292   1HB   ARG  36          1HB       ARG  36   0.442   3.922  -6.075
  293   2HB   ARG  36          2HB       ARG  36   0.004   5.624  -6.059
  294   1HG   ARG  36          1HG       ARG  36   0.802   4.689  -8.694
  295   2HG   ARG  36          2HG       ARG  36  -0.589   3.820  -8.039
  296   1HD   ARG  36          1HD       ARG  36  -1.866   5.531  -8.664
  297   2HD   ARG  36          2HD       ARG  36  -1.045   6.516  -7.456
  298    HE   ARG  36           HE       ARG  36   0.266   6.291 -10.044
  299   1HH1  ARG  36          1HH1      ARG  36  -1.817   8.166  -7.933
  300   2HH1  ARG  36          2HH1      ARG  36  -1.570   9.650  -8.805
  301   1HH2  ARG  36          1HH2      ARG  36   0.585   8.241 -11.190
  302   2HH2  ARG  36          2HH2      ARG  36  -0.241   9.687 -10.680
  303    H    VAL  37           H        VAL  37   3.099   3.037  -5.975
  304    HA   VAL  37           HA       VAL  37   3.847   2.363  -8.729
  305    HB   VAL  37           HB       VAL  37   6.023   1.439  -7.945
  306   1HG1  VAL  37          1HG1      VAL  37   6.398   4.239  -7.236
  307   2HG1  VAL  37          2HG1      VAL  37   5.416   4.012  -8.686
  308   3HG1  VAL  37          3HG1      VAL  37   7.036   3.315  -8.601
  309   1HG2  VAL  37          1HG2      VAL  37   5.289   2.883  -5.409
  310   2HG2  VAL  37          2HG2      VAL  37   6.938   2.396  -5.807
  311   3HG2  VAL  37          3HG2      VAL  37   5.678   1.176  -5.612
  312    H    ASN  38           H        ASN  38   3.924   0.127  -9.131
  313    HA   ASN  38           HA       ASN  38   2.813  -1.549  -6.968
  314   1HB   ASN  38          1HB       ASN  38   1.425  -1.319  -9.088
  315   2HB   ASN  38          2HB       ASN  38   2.711  -2.178  -9.923
  316   1HD2  ASN  38          1HD2      ASN  38  -0.149  -2.494  -8.277
  317   2HD2  ASN  38          2HD2      ASN  38  -0.082  -4.186  -7.923
  318    H    VAL  39           H        VAL  39   4.392  -2.652  -6.031
  319    HA   VAL  39           HA       VAL  39   6.776  -3.295  -7.615
  320    HB   VAL  39           HB       VAL  39   6.684  -3.627  -4.644
  321   1HG1  VAL  39          1HG1      VAL  39   8.642  -3.771  -6.647
  322   2HG1  VAL  39          2HG1      VAL  39   8.873  -3.868  -4.901
  323   3HG1  VAL  39          3HG1      VAL  39   8.990  -2.310  -5.721
  324   1HG2  VAL  39          1HG2      VAL  39   6.723  -1.014  -6.121
  325   2HG2  VAL  39          2HG2      VAL  39   7.462  -1.192  -4.530
  326   3HG2  VAL  39          3HG2      VAL  39   5.737  -1.487  -4.738
  327    H    ASN  40           H        ASN  40   7.741  -5.308  -7.569
  328    HA   ASN  40           HA       ASN  40   5.955  -7.523  -6.825
  329   1HB   ASN  40          1HB       ASN  40   6.525  -7.626  -9.152
  330   2HB   ASN  40          2HB       ASN  40   8.227  -7.329  -8.814
  331   1HD2  ASN  40          1HD2      ASN  40   9.387  -9.059  -9.167
  332   2HD2  ASN  40          2HD2      ASN  40   8.940 -10.690  -8.793
  333    H    PHE  41           H        PHE  41   6.423  -8.351  -4.911
  334    HA   PHE  41           HA       PHE  41   9.195  -8.258  -3.952
  335   1HB   PHE  41          1HB       PHE  41   6.553  -8.496  -2.512
  336   2HB   PHE  41          2HB       PHE  41   8.100  -8.750  -1.712
  337    HD1  PHE  41           HD1      PHE  41   9.820  -6.814  -1.940
  338    HD2  PHE  41           HD2      PHE  41   5.631  -6.385  -2.556
  339    HE1  PHE  41           HE1      PHE  41  10.018  -4.393  -1.560
  340    HE2  PHE  41           HE2      PHE  41   5.820  -3.967  -2.172
  341    HZ   PHE  41           HZ       PHE  41   7.982  -2.975  -1.588
  342    H    ASP  42           H        ASP  42  10.310 -10.054  -3.612
  343    HA   ASP  42           HA       ASP  42   9.195 -12.602  -4.343
  344   1HB   ASP  42          1HB       ASP  42  11.341 -13.168  -4.681
  345   2HB   ASP  42          2HB       ASP  42  11.756 -11.507  -4.288
  346    H    GLU  43           H        GLU  43   9.380 -14.497  -2.886
  347    HA   GLU  43           HA       GLU  43   7.786 -14.131  -0.658
  348   1HB   GLU  43          1HB       GLU  43   9.299 -16.368  -1.820
  349   2HB   GLU  43          2HB       GLU  43   8.978 -16.520  -0.098
  350   1HG   GLU  43          1HG       GLU  43   6.879 -15.975  -2.179
  351   2HG   GLU  43          2HG       GLU  43   7.267 -17.571  -1.541
  352    H    GLU  44           H        GLU  44  11.304 -14.277  -0.852
  353    HA   GLU  44           HA       GLU  44  11.859 -14.439   1.916
  354   1HB   GLU  44          1HB       GLU  44  13.318 -13.699  -0.527
  355   2HB   GLU  44          2HB       GLU  44  13.895 -12.897   0.927
  356   1HG   GLU  44          1HG       GLU  44  13.607 -15.870   0.564
  357   2HG   GLU  44          2HG       GLU  44  15.114 -14.963   0.453
  358    H    LYS  45           H        LYS  45  11.535 -11.673  -0.261
  359    HA   LYS  45           HA       LYS  45  11.878  -9.636   1.631
  360   1HB   LYS  45          1HB       LYS  45  10.121  -9.576  -0.835
  361   2HB   LYS  45          2HB       LYS  45  10.748  -8.180   0.029
  362   1HG   LYS  45          1HG       LYS  45  12.986  -9.692  -0.609
  363   2HG   LYS  45          2HG       LYS  45  11.958  -9.757  -2.043
  364   1HD   LYS  45          1HD       LYS  45  12.509  -7.669  -2.570
  365   2HD   LYS  45          2HD       LYS  45  11.968  -7.096  -0.990
  366   1HE   LYS  45          1HE       LYS  45  14.186  -6.482  -0.983
  367   2HE   LYS  45          2HE       LYS  45  14.240  -8.044  -0.166
  368   1HZ   LYS  45          1HZ       LYS  45  15.976  -7.813  -1.860
  369   2HZ   LYS  45          2HZ       LYS  45  14.787  -7.622  -3.058
  370   3HZ   LYS  45          3HZ       LYS  45  14.912  -9.087  -2.214
  371    H    HIS  46           H        HIS  46   8.899 -11.036   0.311
  372    HA   HIS  46           HA       HIS  46   7.164  -9.440   1.802
  373   1HB   HIS  46          1HB       HIS  46   6.776 -11.019  -0.277
  374   2HB   HIS  46          2HB       HIS  46   6.273 -12.159   0.968
  375    HD1  HIS  46           HD1      HIS  46   3.843 -12.140   1.262
  376    HD2  HIS  46           HD2      HIS  46   5.292  -8.361   0.284
  377    HE1  HIS  46           HE1      HIS  46   1.827 -10.633   1.181
  378    HE2  HIS  46           HE2      HIS  46   2.707  -8.380   0.485
  379    H    THR  47           H        THR  47   8.414 -12.684   2.539
  380    HA   THR  47           HA       THR  47   6.756 -13.110   4.781
  381    HB   THR  47           HB       THR  47   9.525 -14.256   4.388
  382    HG1  THR  47           HG1      THR  47   8.467 -14.856   2.578
  383   1HG2  THR  47          1HG2      THR  47   8.739 -16.087   5.746
  384   2HG2  THR  47          2HG2      THR  47   7.123 -15.390   5.824
  385   3HG2  THR  47          3HG2      THR  47   8.470 -14.580   6.624
  386    H    ARG  48           H        ARG  48  10.077 -11.839   4.536
  387    HA   ARG  48           HA       ARG  48  10.353 -11.338   7.323
  388   1HB   ARG  48          1HB       ARG  48  12.210 -11.477   5.587
  389   2HB   ARG  48          2HB       ARG  48  11.766  -9.840   5.127
  390   1HG   ARG  48          1HG       ARG  48  13.554  -9.577   6.598
  391   2HG   ARG  48          2HG       ARG  48  12.126  -9.235   7.576
  392   1HD   ARG  48          1HD       ARG  48  13.555 -10.634   8.867
  393   2HD   ARG  48          2HD       ARG  48  12.186 -11.612   8.341
  394    HE   ARG  48           HE       ARG  48  14.300 -11.873   6.494
  395   1HH1  ARG  48          1HH1      ARG  48  13.314 -12.882   9.696
  396   2HH1  ARG  48          2HH1      ARG  48  14.353 -14.279   9.717
  397   1HH2  ARG  48          1HH2      ARG  48  15.660 -13.712   6.503
  398   2HH2  ARG  48          2HH2      ARG  48  15.675 -14.760   7.893
  399    H    PHE  49           H        PHE  49   9.220  -9.444   4.594
  400    HA   PHE  49           HA       PHE  49   8.956  -6.926   5.723
  401   1HB   PHE  49          1HB       PHE  49   8.096  -8.231   3.387
  402   2HB   PHE  49          2HB       PHE  49   6.633  -7.600   4.132
  403    HD1  PHE  49           HD1      PHE  49   9.986  -6.050   4.284
  404    HD2  PHE  49           HD2      PHE  49   6.089  -5.933   2.585
  405    HE1  PHE  49           HE1      PHE  49  10.469  -3.834   3.336
  406    HE2  PHE  49           HE2      PHE  49   6.565  -3.713   1.638
  407    HZ   PHE  49           HZ       PHE  49   8.759  -2.661   2.013
  408    H    LYS  50           H        LYS  50   6.528  -9.495   5.584
  409    HA   LYS  50           HA       LYS  50   4.644  -8.168   7.210
  410   1HB   LYS  50          1HB       LYS  50   4.948 -11.090   6.504
  411   2HB   LYS  50          2HB       LYS  50   3.549 -10.410   7.324
  412   1HG   LYS  50          1HG       LYS  50   4.323  -9.123   4.788
  413   2HG   LYS  50          2HG       LYS  50   3.687 -10.765   4.674
  414   1HD   LYS  50          1HD       LYS  50   2.175  -8.991   6.452
  415   2HD   LYS  50          2HD       LYS  50   2.170  -8.500   4.757
  416   1HE   LYS  50          1HE       LYS  50   1.139 -10.458   4.061
  417   2HE   LYS  50          2HE       LYS  50   1.616 -11.340   5.512
  418   1HZ   LYS  50          1HZ       LYS  50  -0.118 -10.529   6.690
  419   2HZ   LYS  50          2HZ       LYS  50  -0.821 -10.425   5.149
  420   3HZ   LYS  50          3HZ       LYS  50  -0.147  -9.042   5.866
  421    H    ALA  51           H        ALA  51   7.013 -10.721   7.911
  422    HA   ALA  51           HA       ALA  51   6.281 -11.191  10.565
  423   1HB   ALA  51          1HB       ALA  51   9.139 -11.470  10.116
  424   2HB   ALA  51          2HB       ALA  51   8.175 -12.203   8.836
  425   3HB   ALA  51          3HB       ALA  51   7.929 -12.691  10.510
  426    H    ALA  52           H        ALA  52   8.818  -9.037   9.292
  427    HA   ALA  52           HA       ALA  52   9.661  -8.090  11.812
  428   1HB   ALA  52          1HB       ALA  52  10.295  -7.595   9.075
  429   2HB   ALA  52          2HB       ALA  52  11.251  -7.265  10.517
  430   3HB   ALA  52          3HB       ALA  52  10.115  -6.056   9.919
  431    H    CYS  53           H        CYS  53   7.423  -6.658   9.422
  432    HA   CYS  53           HA       CYS  53   6.852  -4.330  10.818
  433   1HB   CYS  53          1HB       CYS  53   5.155  -3.961   9.273
  434   2HB   CYS  53          2HB       CYS  53   6.224  -5.056   8.412
  435    HG   CYS  53           HG       CYS  53   4.556  -7.323   9.190
  436    H    ALA  54           H        ALA  54   5.272  -7.486  11.003
  437    HA   ALA  54           HA       ALA  54   3.223  -6.714  12.790
  438   1HB   ALA  54          1HB       ALA  54   4.191  -9.492  12.954
  439   2HB   ALA  54          2HB       ALA  54   3.691  -8.937  11.355
  440   3HB   ALA  54          3HB       ALA  54   2.559  -8.868  12.708
  441    H    ARG  55           H        ARG  55   6.522  -7.802  13.277
  442    HA   ARG  55           HA       ARG  55   6.247  -8.162  16.103
  443   1HB   ARG  55          1HB       ARG  55   8.396  -8.368  14.109
  444   2HB   ARG  55          2HB       ARG  55   8.928  -7.860  15.707
  445   1HG   ARG  55          1HG       ARG  55   8.535  -9.868  16.624
  446   2HG   ARG  55          2HG       ARG  55   7.076 -10.136  15.669
  447   1HD   ARG  55          1HD       ARG  55   8.360 -10.805  13.766
  448   2HD   ARG  55          2HD       ARG  55   9.866 -10.320  14.546
  449    HE   ARG  55           HE       ARG  55   8.388 -12.764  14.966
  450   1HH1  ARG  55          1HH1      ARG  55  10.873 -10.609  16.147
  451   2HH1  ARG  55          2HH1      ARG  55  11.507 -11.755  17.296
  452   1HH2  ARG  55          1HH2      ARG  55   9.195 -14.269  16.474
  453   2HH2  ARG  55          2HH2      ARG  55  10.530 -13.839  17.499
  454    H    LYS  56           H        LYS  56   7.419  -5.585  14.006
  455    HA   LYS  56           HA       LYS  56   8.318  -3.949  16.187
  456   1HB   LYS  56          1HB       LYS  56   7.927  -3.391  13.244
  457   2HB   LYS  56          2HB       LYS  56   8.572  -2.210  14.376
  458   1HG   LYS  56          1HG       LYS  56  10.572  -3.305  14.595
  459   2HG   LYS  56          2HG       LYS  56   9.874  -4.882  14.212
  460   1HD   LYS  56          1HD       LYS  56  10.306  -4.648  12.034
  461   2HD   LYS  56          2HD       LYS  56   9.648  -3.010  12.003
  462   1HE   LYS  56          1HE       LYS  56  12.344  -3.574  13.187
  463   2HE   LYS  56          2HE       LYS  56  12.143  -3.361  11.448
  464   1HZ   LYS  56          1HZ       LYS  56  12.647  -1.246  12.206
  465   2HZ   LYS  56          2HZ       LYS  56  11.710  -1.402  13.610
  466   3HZ   LYS  56          3HZ       LYS  56  10.952  -1.202  12.107
  467    H    GLY  57           H        GLY  57   5.348  -4.409  14.505
  468   1HA   GLY  57          1HA       GLY  57   3.253  -3.593  15.205
  469   2HA   GLY  57          2HA       GLY  57   4.075  -2.378  16.176
  470    H    THR  58           H        THR  58   5.036  -2.923  12.918
  471    HA   THR  58           HA       THR  58   4.169  -0.225  12.207
  472    HB   THR  58           HB       THR  58   5.857  -1.898  10.404
  473    HG1  THR  58           HG1      THR  58   6.638  -0.878  12.943
  474   1HG2  THR  58          1HG2      THR  58   6.631   0.087   9.620
  475   2HG2  THR  58          2HG2      THR  58   6.520   0.874  11.196
  476   3HG2  THR  58          3HG2      THR  58   5.066   0.635  10.227
  477    H    SER  59           H        SER  59   2.940   0.220  10.399
  478    HA   SER  59           HA       SER  59   1.299  -1.926   9.341
  479   1HB   SER  59          1HB       SER  59   1.290   0.851   8.215
  480   2HB   SER  59          2HB       SER  59  -0.057  -0.263   8.448
  481    HG   SER  59           HG       SER  59   1.329   1.210  10.449
  482    H    ILE  60           H        ILE  60   1.549  -2.863   7.369
  483    HA   ILE  60           HA       ILE  60   4.033  -3.055   6.243
  484    HB   ILE  60           HB       ILE  60   2.353  -4.724   5.834
  485   1HG1  ILE  60          1HG1      ILE  60   2.570  -4.102   3.035
  486   2HG1  ILE  60          2HG1      ILE  60   4.068  -3.674   3.857
  487   1HG2  ILE  60          1HG2      ILE  60   0.306  -4.382   5.009
  488   2HG2  ILE  60          2HG2      ILE  60   0.888  -3.313   3.736
  489   3HG2  ILE  60          3HG2      ILE  60   0.620  -2.682   5.360
  490   1HD1  ILE  60          1HD1      ILE  60   4.407  -5.881   4.598
  491   2HD1  ILE  60          2HD1      ILE  60   3.926  -6.003   2.904
  492   3HD1  ILE  60          3HD1      ILE  60   2.759  -6.355   4.180
  493    H    THR  61           H        THR  61   1.415  -0.922   5.178
  494    HA   THR  61           HA       THR  61   2.684   0.075   2.884
  495    HB   THR  61           HB       THR  61   0.913   1.918   4.358
  496    HG1  THR  61           HG1      THR  61  -0.731   0.559   4.570
  497   1HG2  THR  61          1HG2      THR  61   1.603   1.295   1.659
  498   2HG2  THR  61          2HG2      THR  61   0.605   2.617   2.264
  499   3HG2  THR  61          3HG2      THR  61  -0.132   1.069   1.866
  500    H    ASP  62           H        ASP  62   2.770   1.097   6.258
  501    HA   ASP  62           HA       ASP  62   4.291   3.471   5.817
  502   1HB   ASP  62          1HB       ASP  62   2.858   2.708   7.898
  503   2HB   ASP  62          2HB       ASP  62   4.380   1.990   8.415
  504    H    VAL  63           H        VAL  63   5.027   0.107   6.383
  505    HA   VAL  63           HA       VAL  63   7.772   0.304   6.966
  506    HB   VAL  63           HB       VAL  63   6.212  -1.886   5.589
  507   1HG1  VAL  63          1HG1      VAL  63   8.299  -2.464   4.869
  508   2HG1  VAL  63          2HG1      VAL  63   8.310  -3.226   6.461
  509   3HG1  VAL  63          3HG1      VAL  63   9.106  -1.669   6.223
  510   1HG2  VAL  63          1HG2      VAL  63   6.836  -2.960   7.902
  511   2HG2  VAL  63          2HG2      VAL  63   5.445  -1.887   7.745
  512   3HG2  VAL  63          3HG2      VAL  63   6.961  -1.274   8.401
  513    H    VAL  64           H        VAL  64   6.127  -0.271   3.845
  514    HA   VAL  64           HA       VAL  64   8.416  -0.214   2.239
  515    HB   VAL  64           HB       VAL  64   5.821   0.896   1.220
  516   1HG1  VAL  64          1HG1      VAL  64   8.114   0.479  -0.054
  517   2HG1  VAL  64          2HG1      VAL  64   6.554   0.230  -0.833
  518   3HG1  VAL  64          3HG1      VAL  64   7.449  -1.149  -0.193
  519   1HG2  VAL  64          1HG2      VAL  64   6.082  -2.016   1.065
  520   2HG2  VAL  64          2HG2      VAL  64   4.673  -1.019   1.425
  521   3HG2  VAL  64          3HG2      VAL  64   5.831  -1.403   2.699
  522    H    ASN  65           H        ASN  65   6.293   2.403   3.290
  523    HA   ASN  65           HA       ASN  65   7.483   4.466   1.788
  524   1HB   ASN  65          1HB       ASN  65   5.490   4.236   3.846
  525   2HB   ASN  65          2HB       ASN  65   6.569   5.580   4.223
  526   1HD2  ASN  65          1HD2      ASN  65   3.851   4.676   2.598
  527   2HD2  ASN  65          2HD2      ASN  65   3.744   5.976   1.460
  528    H    GLN  66           H        GLN  66   8.332   2.977   4.828
  529    HA   GLN  66           HA       GLN  66  10.181   4.955   5.686
  530   1HB   GLN  66          1HB       GLN  66   9.178   2.454   6.651
  531   2HB   GLN  66          2HB       GLN  66  10.934   2.438   6.742
  532   1HG   GLN  66          1HG       GLN  66  10.256   4.925   7.714
  533   2HG   GLN  66          2HG       GLN  66   9.001   3.866   8.354
  534   1HE2  GLN  66          1HE2      GLN  66   9.440   2.852  10.175
  535   2HE2  GLN  66          2HE2      GLN  66  11.028   2.595  10.836
  536    H    LEU  67           H        LEU  67  10.683   1.735   4.200
  537    HA   LEU  67           HA       LEU  67  13.460   1.931   4.052
  538   1HB   LEU  67          1HB       LEU  67  12.741   0.426   1.815
  539   2HB   LEU  67          2HB       LEU  67  13.193  -0.165   3.400
  540    HG   LEU  67           HG       LEU  67  10.424   0.565   3.421
  541   1HD1  LEU  67          1HD1      LEU  67   9.781  -1.349   1.838
  542   2HD1  LEU  67          2HD1      LEU  67  11.370  -1.090   1.118
  543   3HD1  LEU  67          3HD1      LEU  67  10.187   0.217   1.141
  544   1HD2  LEU  67          1HD2      LEU  67  10.414  -1.196   4.765
  545   2HD2  LEU  67          2HD2      LEU  67  12.140  -1.377   4.449
  546   3HD2  LEU  67          3HD2      LEU  67  10.966  -2.256   3.467
  547    H    VAL  68           H        VAL  68  11.012   2.906   1.675
  548    HA   VAL  68           HA       VAL  68  12.776   3.652  -0.383
  549    HB   VAL  68           HB       VAL  68  10.097   4.891   0.291
  550   1HG1  VAL  68          1HG1      VAL  68  11.870   5.096  -2.125
  551   2HG1  VAL  68          2HG1      VAL  68  11.165   6.396  -1.166
  552   3HG1  VAL  68          3HG1      VAL  68  10.137   5.411  -2.204
  553   1HG2  VAL  68          1HG2      VAL  68  10.724   2.760  -1.739
  554   2HG2  VAL  68          2HG2      VAL  68   9.137   3.379  -1.287
  555   3HG2  VAL  68          3HG2      VAL  68  10.076   2.435  -0.130
  556    H    ASP  69           H        ASP  69  11.432   5.511   2.313
  557    HA   ASP  69           HA       ASP  69  12.663   7.973   1.719
  558   1HB   ASP  69          1HB       ASP  69  10.835   7.752   3.353
  559   2HB   ASP  69          2HB       ASP  69  11.898   6.833   4.419
  560    H    ASN  70           H        ASN  70  13.644   5.368   3.921
  561    HA   ASN  70           HA       ASN  70  15.982   6.573   4.842
  562   1HB   ASN  70          1HB       ASN  70  15.010   3.745   4.732
  563   2HB   ASN  70          2HB       ASN  70  16.670   4.068   5.231
  564   1HD2  ASN  70          1HD2      ASN  70  13.308   4.815   5.912
  565   2HD2  ASN  70          2HD2      ASN  70  13.527   5.178   7.589
  566    H    TRP  71           H        TRP  71  15.549   4.275   2.154
  567    HA   TRP  71           HA       TRP  71  18.261   4.124   1.410
  568   1HB   TRP  71          1HB       TRP  71  16.485   2.584   0.594
  569   2HB   TRP  71          2HB       TRP  71  15.839   3.891  -0.390
  570    HD1  TRP  71           HD1      TRP  71  18.819   1.486  -0.186
  571    HE1  TRP  71           HE1      TRP  71  20.048   1.501  -2.446
  572    HE3  TRP  71           HE3      TRP  71  16.195   5.202  -2.529
  573    HZ2  TRP  71           HZ2      TRP  71  19.912   2.873  -4.892
  574    HZ3  TRP  71           HZ3      TRP  71  16.795   5.785  -4.841
  575    HH2  TRP  71           HH2      TRP  71  18.614   4.636  -6.002
  576    H    LEU  72           H        LEU  72  15.660   6.295   0.368
  577    HA   LEU  72           HA       LEU  72  17.107   7.624  -1.627
  578   1HB   LEU  72          1HB       LEU  72  14.661   8.252  -0.041
  579   2HB   LEU  72          2HB       LEU  72  15.367   9.505  -1.044
  580    HG   LEU  72           HG       LEU  72  14.444   6.806  -2.031
  581   1HD1  LEU  72          1HD1      LEU  72  13.145   9.474  -1.853
  582   2HD1  LEU  72          2HD1      LEU  72  12.461   7.867  -1.626
  583   3HD1  LEU  72          3HD1      LEU  72  12.810   8.456  -3.252
  584   1HD2  LEU  72          1HD2      LEU  72  16.368   8.241  -3.168
  585   2HD2  LEU  72          2HD2      LEU  72  14.976   9.095  -3.832
  586   3HD2  LEU  72          3HD2      LEU  72  15.162   7.365  -4.110
  587    H    LYS  73           H        LYS  73  16.872   8.241   1.839
  588    HA   LYS  73           HA       LYS  73  18.286  10.750   1.573
  589   1HB   LYS  73          1HB       LYS  73  17.561   9.282   4.112
  590   2HB   LYS  73          2HB       LYS  73  18.005  10.976   3.957
  591   1HG   LYS  73          1HG       LYS  73  15.782  10.420   2.250
  592   2HG   LYS  73          2HG       LYS  73  15.439   9.838   3.877
  593   1HD   LYS  73          1HD       LYS  73  16.681  12.465   3.874
  594   2HD   LYS  73          2HD       LYS  73  15.164  12.433   2.970
  595   1HE   LYS  73          1HE       LYS  73  15.197  11.067   5.598
  596   2HE   LYS  73          2HE       LYS  73  15.271  12.828   5.613
  597   1HZ   LYS  73          1HZ       LYS  73  13.273  12.780   4.126
  598   2HZ   LYS  73          2HZ       LYS  73  13.003  12.219   5.704
  599   3HZ   LYS  73          3HZ       LYS  73  13.159  11.113   4.427
  600    H    GLU  74           H        GLU  74  18.987   7.472   2.621
  601    HA   GLU  74           HA       GLU  74  21.536   8.122   3.720
  602   1HB   GLU  74          1HB       GLU  74  20.023   5.613   3.172
  603   2HB   GLU  74          2HB       GLU  74  21.750   5.496   3.484
  604   1HG   GLU  74          1HG       GLU  74  19.647   6.653   5.294
  605   2HG   GLU  74          2HG       GLU  74  20.554   5.159   5.528
  606    H    ASN  75           H        ASN  75  20.477   6.768   0.617
  607    HA   ASN  75           HA       ASN  75  23.231   6.395  -0.197
  608   1HB   ASN  75          1HB       ASN  75  22.426   4.873  -1.625
  609   2HB   ASN  75          2HB       ASN  75  20.877   5.097  -0.817
  610   1HD2  ASN  75          1HD2      ASN  75  19.285   6.328  -1.810
  611   2HD2  ASN  75          2HD2      ASN  75  19.340   6.670  -3.502
  612    H    GLU  76           H        GLU  76  21.143   8.973  -0.174
  613    HA   GLU  76           HA       GLU  76  21.757  10.217  -2.661
  614   1HB   GLU  76          1HB       GLU  76  20.228  10.847  -0.330
  615   2HB   GLU  76          2HB       GLU  76  21.310  12.193  -0.663
  616   1HG   GLU  76          1HG       GLU  76  20.400  11.806  -3.128
  617   2HG   GLU  76          2HG       GLU  76  19.029  11.148  -2.237
  618   1H    MET   1          1H        MET   1 -57.786 -61.728   8.482
  619   2H    MET   1          2H        MET   1 -57.551 -62.311  10.054
  620   3H    MET   1          3H        MET   1 -56.301 -61.483   9.262
  621    HA   MET   1           HA       MET   1 -58.837 -60.403  10.319
  622   1HB   MET   1          1HB       MET   1 -56.861 -60.636  11.811
  623   2HB   MET   1          2HB       MET   1 -55.949 -59.601  10.720
  624   1HG   MET   1          1HG       MET   1 -56.812 -58.429  12.712
  625   2HG   MET   1          2HG       MET   1 -57.377 -57.742  11.191
  626   1HE   MET   1          1HE       MET   1 -60.928 -57.277  11.931
  627   2HE   MET   1          2HE       MET   1 -59.934 -57.580  10.509
  628   3HE   MET   1          3HE       MET   1 -59.356 -56.495  11.770
  629    H    SER   2           H        SER   2 -55.928 -59.445   8.463
  630    HA   SER   2           HA       SER   2 -57.436 -57.196   7.362
  631   1HB   SER   2          1HB       SER   2 -54.805 -57.320   6.283
  632   2HB   SER   2          2HB       SER   2 -55.440 -56.177   7.465
  633    HG   SER   2           HG       SER   2 -54.608 -57.333   9.077
  634    H    LEU   3           H        LEU   3 -57.085 -56.756   4.966
  635    HA   LEU   3           HA       LEU   3 -57.900 -59.090   3.476
  636   1HB   LEU   3          1HB       LEU   3 -58.766 -56.722   3.158
  637   2HB   LEU   3          2HB       LEU   3 -57.230 -56.353   2.399
  638    HG   LEU   3           HG       LEU   3 -57.727 -58.148   0.712
  639   1HD1  LEU   3          1HD1      LEU   3 -60.124 -58.360   2.404
  640   2HD1  LEU   3          2HD1      LEU   3 -59.326 -59.574   1.404
  641   3HD1  LEU   3          3HD1      LEU   3 -60.406 -58.391   0.665
  642   1HD2  LEU   3          1HD2      LEU   3 -58.103 -55.703   0.359
  643   2HD2  LEU   3          2HD2      LEU   3 -59.787 -55.957   0.816
  644   3HD2  LEU   3          3HD2      LEU   3 -59.133 -56.755  -0.613
  645    H    GLU   4           H        GLU   4 -54.992 -57.758   4.382
  646    HA   GLU   4           HA       GLU   4 -52.824 -58.124   3.883
  647   1HB   GLU   4          1HB       GLU   4 -53.643 -60.410   2.106
  648   2HB   GLU   4          2HB       GLU   4 -52.171 -60.228   3.050
  649   1HG   GLU   4          1HG       GLU   4 -54.908 -60.565   4.254
  650   2HG   GLU   4          2HG       GLU   4 -53.800 -61.896   3.934
  651    H    LYS   5           H        LYS   5 -54.387 -56.360   2.269
  652    HA   LYS   5           HA       LYS   5 -53.177 -56.563  -0.387
  653   1HB   LYS   5          1HB       LYS   5 -55.568 -55.864  -0.138
  654   2HB   LYS   5          2HB       LYS   5 -55.015 -54.430   0.712
  655   1HG   LYS   5          1HG       LYS   5 -54.085 -53.493  -1.196
  656   2HG   LYS   5          2HG       LYS   5 -54.016 -55.041  -2.041
  657   1HD   LYS   5          1HD       LYS   5 -56.690 -54.039  -1.234
  658   2HD   LYS   5          2HD       LYS   5 -55.876 -53.206  -2.562
  659   1HE   LYS   5          1HE       LYS   5 -56.023 -56.188  -2.562
  660   2HE   LYS   5          2HE       LYS   5 -57.444 -55.252  -3.027
  661   1HZ   LYS   5          1HZ       LYS   5 -54.795 -54.774  -4.256
  662   2HZ   LYS   5          2HZ       LYS   5 -56.323 -54.317  -4.834
  663   3HZ   LYS   5          3HZ       LYS   5 -55.857 -55.949  -4.861
  664    H    ALA   6           H        ALA   6 -53.078 -54.708   2.574
  665    HA   ALA   6           HA       ALA   6 -50.958 -52.976   1.562
  666   1HB   ALA   6          1HB       ALA   6 -52.960 -52.515   3.349
  667   2HB   ALA   6          2HB       ALA   6 -51.482 -51.562   3.228
  668   3HB   ALA   6          3HB       ALA   6 -51.601 -52.855   4.421
  669    H    HIS   7           H        HIS   7 -49.619 -54.919   1.176
  670    HA   HIS   7           HA       HIS   7 -48.382 -55.936   3.644
  671   1HB   HIS   7          1HB       HIS   7 -48.990 -57.138   1.034
  672   2HB   HIS   7          2HB       HIS   7 -47.365 -57.485   1.622
  673    HD1  HIS   7           HD1      HIS   7 -47.771 -59.921   2.207
  674    HD2  HIS   7           HD2      HIS   7 -50.442 -57.319   4.045
  675    HE1  HIS   7           HE1      HIS   7 -49.035 -61.312   3.881
  676    HE2  HIS   7           HE2      HIS   7 -50.754 -59.751   4.864
  677    H    THR   8           H        THR   8 -47.918 -53.366   2.247
  678    HA   THR   8           HA       THR   8 -45.470 -53.364   0.880
  679    HB   THR   8           HB       THR   8 -45.744 -50.923   2.319
  680    HG1  THR   8           HG1      THR   8 -47.850 -51.390   2.863
  681   1HG2  THR   8          1HG2      THR   8 -46.791 -51.407  -0.456
  682   2HG2  THR   8          2HG2      THR   8 -45.062 -51.437  -0.117
  683   3HG2  THR   8          3HG2      THR   8 -45.996 -49.974   0.189
  684    H    SER   9           H        SER   9 -43.701 -54.273   1.747
  685    HA   SER   9           HA       SER   9 -42.931 -53.421   4.461
  686   1HB   SER   9          1HB       SER   9 -41.678 -55.900   3.594
  687   2HB   SER   9          2HB       SER   9 -42.545 -55.544   5.087
  688    HG   SER   9           HG       SER   9 -44.347 -55.653   3.151
  689    H    VAL  10           H        VAL  10 -41.508 -51.835   4.039
  690    HA   VAL  10           HA       VAL  10 -39.313 -52.461   2.172
  691    HB   VAL  10           HB       VAL  10 -39.190 -49.797   2.176
  692   1HG1  VAL  10          1HG1      VAL  10 -41.285 -50.768   0.361
  693   2HG1  VAL  10          2HG1      VAL  10 -39.793 -51.711   0.363
  694   3HG1  VAL  10          3HG1      VAL  10 -39.747 -49.985   0.006
  695   1HG2  VAL  10          1HG2      VAL  10 -41.423 -48.811   2.083
  696   2HG2  VAL  10          2HG2      VAL  10 -41.099 -49.498   3.674
  697   3HG2  VAL  10          3HG2      VAL  10 -42.131 -50.361   2.536
  698    H    LYS  11           H        LYS  11 -37.542 -52.860   3.253
  699    HA   LYS  11           HA       LYS  11 -36.743 -51.048   5.419
  700   1HB   LYS  11          1HB       LYS  11 -37.661 -53.465   6.092
  701   2HB   LYS  11          2HB       LYS  11 -36.014 -53.925   5.683
  702   1HG   LYS  11          1HG       LYS  11 -35.972 -51.595   7.344
  703   2HG   LYS  11          2HG       LYS  11 -36.963 -52.847   8.094
  704   1HD   LYS  11          1HD       LYS  11 -34.365 -53.680   6.930
  705   2HD   LYS  11          2HD       LYS  11 -34.318 -52.726   8.413
  706   1HE   LYS  11          1HE       LYS  11 -36.319 -54.770   8.624
  707   2HE   LYS  11          2HE       LYS  11 -34.776 -55.484   8.150
  708   1HZ   LYS  11          1HZ       LYS  11 -35.237 -53.720  10.498
  709   2HZ   LYS  11          2HZ       LYS  11 -33.738 -54.367  10.039
  710   3HZ   LYS  11          3HZ       LYS  11 -34.989 -55.399  10.546
  711    H    LYS  12           H        LYS  12 -35.732 -50.294   3.336
  712    HA   LYS  12           HA       LYS  12 -33.577 -51.890   2.291
  713   1HB   LYS  12          1HB       LYS  12 -34.133 -48.988   1.699
  714   2HB   LYS  12          2HB       LYS  12 -33.284 -50.151   0.691
  715   1HG   LYS  12          1HG       LYS  12 -35.410 -51.403   0.434
  716   2HG   LYS  12          2HG       LYS  12 -36.225 -50.116   1.322
  717   1HD   LYS  12          1HD       LYS  12 -36.490 -49.040  -0.605
  718   2HD   LYS  12          2HD       LYS  12 -34.739 -48.834  -0.675
  719   1HE   LYS  12          1HE       LYS  12 -35.631 -51.480  -1.524
  720   2HE   LYS  12          2HE       LYS  12 -36.280 -50.175  -2.517
  721   1HZ   LYS  12          1HZ       LYS  12 -33.984 -51.234  -3.072
  722   2HZ   LYS  12          2HZ       LYS  12 -33.411 -50.189  -1.864
  723   3HZ   LYS  12          3HZ       LYS  12 -34.205 -49.556  -3.222
  724    H    MET  13           H        MET  13 -32.295 -52.133   4.181
  725    HA   MET  13           HA       MET  13 -30.927 -49.725   5.148
  726   1HB   MET  13          1HB       MET  13 -31.717 -52.179   6.354
  727   2HB   MET  13          2HB       MET  13 -29.960 -52.112   6.388
  728   1HG   MET  13          1HG       MET  13 -30.195 -50.913   8.240
  729   2HG   MET  13          2HG       MET  13 -30.681 -49.588   7.183
  730   1HE   MET  13          1HE       MET  13 -33.193 -48.339   7.735
  731   2HE   MET  13          2HE       MET  13 -34.439 -49.511   7.299
  732   3HE   MET  13          3HE       MET  13 -32.999 -49.347   6.299
  733    H    THR  14           H        THR  14 -30.502 -50.530   2.516
  734    HA   THR  14           HA       THR  14 -28.192 -52.151   2.241
  735    HB   THR  14           HB       THR  14 -28.626 -50.387   0.004
  736    HG1  THR  14           HG1      THR  14 -30.922 -51.904   0.717
  737   1HG2  THR  14          1HG2      THR  14 -27.631 -52.552  -0.278
  738   2HG2  THR  14          2HG2      THR  14 -29.190 -52.568  -1.103
  739   3HG2  THR  14          3HG2      THR  14 -29.018 -53.345   0.472
  740    H    PHE  15           H        PHE  15 -26.093 -51.615   2.015
  741    HA   PHE  15           HA       PHE  15 -25.351 -48.882   2.719
  742   1HB   PHE  15          1HB       PHE  15 -24.070 -51.544   2.903
  743   2HB   PHE  15          2HB       PHE  15 -22.989 -50.196   2.565
  744    HD1  PHE  15           HD1      PHE  15 -21.991 -49.236   4.378
  745    HD2  PHE  15           HD2      PHE  15 -25.867 -50.928   4.823
  746    HE1  PHE  15           HE1      PHE  15 -21.959 -48.659   6.769
  747    HE2  PHE  15           HE2      PHE  15 -25.850 -50.355   7.215
  748    HZ   PHE  15           HZ       PHE  15 -23.892 -49.221   8.193
  749    H    GLY  16           H        GLY  16 -23.670 -47.768   1.551
  750   1HA   GLY  16          1HA       GLY  16 -23.274 -48.659  -1.223
  751   2HA   GLY  16          2HA       GLY  16 -23.965 -47.067  -0.937
  752    H    GLU  17           H        GLU  17 -21.395 -48.811   0.755
  753    HA   GLU  17           HA       GLU  17 -19.780 -46.580   1.168
  754   1HB   GLU  17          1HB       GLU  17 -19.698 -48.845   2.315
  755   2HB   GLU  17          2HB       GLU  17 -18.767 -49.407   0.936
  756   1HG   GLU  17          1HG       GLU  17 -17.444 -47.119   1.675
  757   2HG   GLU  17          2HG       GLU  17 -17.951 -47.808   3.217
  758    H    ASN  18           H        ASN  18 -19.635 -49.050  -1.351
  759    HA   ASN  18           HA       ASN  18 -18.605 -49.150  -3.376
  760   1HB   ASN  18          1HB       ASN  18 -20.088 -46.953  -3.411
  761   2HB   ASN  18          2HB       ASN  18 -18.518 -46.171  -3.547
  762   1HD2  ASN  18          1HD2      ASN  18 -20.262 -45.850  -5.547
  763   2HD2  ASN  18          2HD2      ASN  18 -19.786 -46.768  -6.941
  764    H    ARG  19           H        ARG  19 -16.838 -49.336  -1.291
  765    HA   ARG  19           HA       ARG  19 -14.653 -49.216  -0.716
  766   1HB   ARG  19          1HB       ARG  19 -14.577 -48.889  -3.690
  767   2HB   ARG  19          2HB       ARG  19 -13.089 -48.732  -2.766
  768   1HG   ARG  19          1HG       ARG  19 -14.866 -51.119  -2.439
  769   2HG   ARG  19          2HG       ARG  19 -13.683 -51.026  -3.746
  770   1HD   ARG  19          1HD       ARG  19 -11.874 -50.869  -2.215
  771   2HD   ARG  19          2HD       ARG  19 -12.962 -50.602  -0.855
  772    HE   ARG  19           HE       ARG  19 -12.819 -53.156  -2.331
  773   1HH1  ARG  19          1HH1      ARG  19 -13.030 -51.333   0.667
  774   2HH1  ARG  19          2HH1      ARG  19 -13.099 -52.755   1.668
  775   1HH2  ARG  19          1HH2      ARG  19 -12.902 -55.017  -1.021
  776   2HH2  ARG  19          2HH2      ARG  19 -13.008 -54.852   0.711
  777    H    ASP  20           H        ASP  20 -15.072 -47.361   0.603
  778    HA   ASP  20           HA       ASP  20 -14.553 -44.723  -0.455
  779   1HB   ASP  20          1HB       ASP  20 -16.144 -45.101   1.419
  780   2HB   ASP  20          2HB       ASP  20 -14.794 -45.602   2.435
  781    H    LEU  21           H        LEU  21 -12.452 -45.283  -1.344
  782    HA   LEU  21           HA       LEU  21 -10.319 -45.302   0.683
  783   1HB   LEU  21          1HB       LEU  21 -10.356 -46.321  -2.156
  784   2HB   LEU  21          2HB       LEU  21  -8.891 -46.178  -1.206
  785    HG   LEU  21           HG       LEU  21 -11.217 -47.837  -0.267
  786   1HD1  LEU  21          1HD1      LEU  21 -10.220 -48.418  -2.613
  787   2HD1  LEU  21          2HD1      LEU  21 -10.509 -49.686  -1.424
  788   3HD1  LEU  21          3HD1      LEU  21  -8.880 -49.054  -1.658
  789   1HD2  LEU  21          1HD2      LEU  21  -9.642 -48.858   1.163
  790   2HD2  LEU  21          2HD2      LEU  21  -9.340 -47.126   1.279
  791   3HD2  LEU  21          3HD2      LEU  21  -8.280 -48.140   0.303
  792    H    GLU  22           H        GLU  22 -11.862 -43.051  -0.625
  793    HA   GLU  22           HA       GLU  22  -9.946 -41.691  -2.268
  794   1HB   GLU  22          1HB       GLU  22 -12.697 -41.260  -1.392
  795   2HB   GLU  22          2HB       GLU  22 -11.753 -39.777  -1.431
  796   1HG   GLU  22          1HG       GLU  22 -13.050 -40.476  -3.534
  797   2HG   GLU  22          2HG       GLU  22 -11.390 -39.906  -3.709
  798    H    ARG  23           H        ARG  23  -8.097 -41.310  -1.233
  799    HA   ARG  23           HA       ARG  23  -8.211 -39.541   1.110
  800   1HB   ARG  23          1HB       ARG  23  -7.679 -42.117   1.467
  801   2HB   ARG  23          2HB       ARG  23  -6.074 -41.617   0.959
  802   1HG   ARG  23          1HG       ARG  23  -6.125 -41.567   3.327
  803   2HG   ARG  23          2HG       ARG  23  -6.123 -39.896   2.765
  804   1HD   ARG  23          1HD       ARG  23  -7.728 -40.534   4.664
  805   2HD   ARG  23          2HD       ARG  23  -8.360 -39.574   3.330
  806    HE   ARG  23           HE       ARG  23  -9.631 -41.389   2.636
  807   1HH1  ARG  23          1HH1      ARG  23  -7.621 -42.236   5.381
  808   2HH1  ARG  23          2HH1      ARG  23  -8.434 -43.752   5.660
  809   1HH2  ARG  23          1HH2      ARG  23 -10.733 -43.347   3.048
  810   2HH2  ARG  23          2HH2      ARG  23 -10.196 -44.376   4.346
  811    H    VAL  24           H        VAL  24  -7.386 -39.679  -1.962
  812    HA   VAL  24           HA       VAL  24  -4.698 -38.617  -1.803
  813    HB   VAL  24           HB       VAL  24  -6.568 -38.793  -4.176
  814   1HG1  VAL  24          1HG1      VAL  24  -3.743 -38.673  -4.774
  815   2HG1  VAL  24          2HG1      VAL  24  -4.272 -37.247  -3.882
  816   3HG1  VAL  24          3HG1      VAL  24  -5.066 -37.685  -5.395
  817   1HG2  VAL  24          1HG2      VAL  24  -5.567 -40.916  -2.952
  818   2HG2  VAL  24          2HG2      VAL  24  -4.142 -40.488  -3.900
  819   3HG2  VAL  24          3HG2      VAL  24  -5.672 -40.823  -4.710
  820    H    VAL  25           H        VAL  25  -4.437 -36.637  -1.055
  821    HA   VAL  25           HA       VAL  25  -6.461 -34.603  -1.698
  822    HB   VAL  25           HB       VAL  25  -6.329 -34.791   0.657
  823   1HG1  VAL  25          1HG1      VAL  25  -3.392 -35.028   0.208
  824   2HG1  VAL  25          2HG1      VAL  25  -4.468 -36.009   1.207
  825   3HG1  VAL  25          3HG1      VAL  25  -3.982 -34.398   1.748
  826   1HG2  VAL  25          1HG2      VAL  25  -6.470 -32.531   0.345
  827   2HG2  VAL  25          2HG2      VAL  25  -4.917 -32.435  -0.485
  828   3HG2  VAL  25          3HG2      VAL  25  -4.970 -32.617   1.268
  829    H    THR  26           H        THR  26  -5.881 -32.802  -2.796
  830    HA   THR  26           HA       THR  26  -3.336 -32.871  -4.130
  831    HB   THR  26           HB       THR  26  -4.902 -30.441  -4.539
  832    HG1  THR  26           HG1      THR  26  -6.132 -33.003  -4.777
  833   1HG2  THR  26          1HG2      THR  26  -4.739 -31.137  -6.878
  834   2HG2  THR  26          2HG2      THR  26  -4.122 -32.711  -6.377
  835   3HG2  THR  26          3HG2      THR  26  -3.171 -31.257  -6.080
  836    H    ALA  27           H        ALA  27  -1.550 -31.919  -3.488
  837    HA   ALA  27           HA       ALA  27  -1.438 -30.385  -1.103
  838   1HB   ALA  27          1HB       ALA  27   0.716 -30.767  -3.180
  839   2HB   ALA  27          2HB       ALA  27   0.359 -31.903  -1.877
  840   3HB   ALA  27          3HB       ALA  27   0.942 -30.281  -1.498
  841    HA   PRO  28           HA       PRO  28  -2.076 -26.255  -2.474
  842   1HB   PRO  28          1HB       PRO  28   0.170 -25.464  -0.712
  843   2HB   PRO  28          2HB       PRO  28  -1.516 -24.935  -0.691
  844   1HG   PRO  28          1HG       PRO  28  -0.566 -26.600   1.173
  845   2HG   PRO  28          2HG       PRO  28  -2.214 -26.768   0.538
  846   1HD   PRO  28          1HD       PRO  28   0.235 -28.361  -0.094
  847   2HD   PRO  28          2HD       PRO  28  -1.445 -28.903   0.099
  848    H    VAL  29           H        VAL  29  -1.444 -25.508  -4.376
  849    HA   VAL  29           HA       VAL  29   1.283 -25.848  -5.300
  850    HB   VAL  29           HB       VAL  29  -0.895 -24.368  -6.767
  851   1HG1  VAL  29          1HG1      VAL  29   1.753 -24.788  -7.359
  852   2HG1  VAL  29          2HG1      VAL  29   0.490 -24.380  -8.520
  853   3HG1  VAL  29          3HG1      VAL  29   0.941 -26.067  -8.262
  854   1HG2  VAL  29          1HG2      VAL  29  -0.824 -27.172  -6.060
  855   2HG2  VAL  29          2HG2      VAL  29  -0.815 -26.941  -7.810
  856   3HG2  VAL  29          3HG2      VAL  29  -2.104 -26.237  -6.832
  857    H    SER  30           H        SER  30   2.005 -24.454  -3.465
  858    HA   SER  30           HA       SER  30   1.435 -21.634  -3.678
  859   1HB   SER  30          1HB       SER  30   3.536 -22.609  -1.821
  860   2HB   SER  30          2HB       SER  30   2.206 -21.485  -1.532
  861    HG   SER  30           HG       SER  30   2.345 -24.144  -1.040
  862    H    SER  31           H        SER  31   2.551 -22.107  -6.000
  863    HA   SER  31           HA       SER  31   5.416 -21.759  -5.916
  864   1HB   SER  31          1HB       SER  31   4.366 -21.266  -8.516
  865   2HB   SER  31          2HB       SER  31   5.236 -22.693  -7.941
  866    HG   SER  31           HG       SER  31   3.116 -23.160  -8.763
  867    H    GLY  32           H        GLY  32   3.119 -19.754  -5.113
  868   1HA   GLY  32          1HA       GLY  32   3.711 -17.429  -6.709
  869   2HA   GLY  32          2HA       GLY  32   2.694 -17.486  -5.278
  870    H    LYS  33           H        LYS  33   6.095 -17.829  -6.203
  871    HA   LYS  33           HA       LYS  33   6.988 -16.867  -3.629
  872   1HB   LYS  33          1HB       LYS  33   9.232 -17.224  -4.483
  873   2HB   LYS  33          2HB       LYS  33   8.230 -18.625  -4.833
  874   1HG   LYS  33          1HG       LYS  33   7.868 -17.417  -7.125
  875   2HG   LYS  33          2HG       LYS  33   9.370 -16.598  -6.692
  876   1HD   LYS  33          1HD       LYS  33  10.383 -18.370  -7.615
  877   2HD   LYS  33          2HD       LYS  33   9.945 -19.213  -6.128
  878   1HE   LYS  33          1HE       LYS  33   9.175 -20.623  -7.820
  879   2HE   LYS  33          2HE       LYS  33   7.734 -19.744  -7.307
  880   1HZ   LYS  33          1HZ       LYS  33   7.957 -19.896  -9.736
  881   2HZ   LYS  33          2HZ       LYS  33   9.405 -19.015  -9.654
  882   3HZ   LYS  33          3HZ       LYS  33   7.944 -18.293  -9.192
  883    H    ILE  34           H        ILE  34   5.569 -15.306  -5.966
  884    HA   ILE  34           HA       ILE  34   7.082 -12.855  -5.472
  885    HB   ILE  34           HB       ILE  34   6.448 -12.122  -7.839
  886   1HG1  ILE  34          1HG1      ILE  34   6.707 -14.664  -9.068
  887   2HG1  ILE  34          2HG1      ILE  34   5.427 -14.803  -7.867
  888   1HG2  ILE  34          1HG2      ILE  34   8.647 -13.849  -6.954
  889   2HG2  ILE  34          2HG2      ILE  34   8.684 -12.280  -7.760
  890   3HG2  ILE  34          3HG2      ILE  34   8.437 -13.749  -8.703
  891   1HD1  ILE  34          1HD1      ILE  34   4.073 -13.294  -8.938
  892   2HD1  ILE  34          2HD1      ILE  34   4.872 -14.079 -10.300
  893   3HD1  ILE  34          3HD1      ILE  34   5.420 -12.496  -9.749
  894    H    LYS  35           H        LYS  35   5.809 -11.236  -4.841
  895    HA   LYS  35           HA       LYS  35   2.912 -11.481  -5.309
  896   1HB   LYS  35          1HB       LYS  35   3.247 -10.132  -2.859
  897   2HB   LYS  35          2HB       LYS  35   2.551 -11.722  -3.123
  898   1HG   LYS  35          1HG       LYS  35   5.512 -11.430  -2.887
  899   2HG   LYS  35          2HG       LYS  35   4.505 -11.397  -1.439
  900   1HD   LYS  35          1HD       LYS  35   4.641 -13.615  -3.485
  901   2HD   LYS  35          2HD       LYS  35   5.308 -13.652  -1.853
  902   1HE   LYS  35          1HE       LYS  35   2.768 -13.065  -1.264
  903   2HE   LYS  35          2HE       LYS  35   2.510 -13.936  -2.774
  904   1HZ   LYS  35          1HZ       LYS  35   4.303 -15.156  -0.817
  905   2HZ   LYS  35          2HZ       LYS  35   3.200 -15.888  -1.879
  906   3HZ   LYS  35          3HZ       LYS  35   2.648 -15.161  -0.453
  907    H    ARG  36           H        ARG  36   1.784  -9.554  -5.582
  908    HA   ARG  36           HA       ARG  36   3.536  -7.282  -6.209
  909   1HB   ARG  36          1HB       ARG  36   1.367  -6.526  -7.475
  910   2HB   ARG  36          2HB       ARG  36   2.455  -7.709  -8.190
  911   1HG   ARG  36          1HG       ARG  36   0.470  -8.989  -6.544
  912   2HG   ARG  36          2HG       ARG  36  -0.281  -7.966  -7.772
  913   1HD   ARG  36          1HD       ARG  36   0.566  -9.200  -9.513
  914   2HD   ARG  36          2HD       ARG  36   1.954  -9.760  -8.582
  915    HE   ARG  36           HE       ARG  36  -0.780 -10.841  -8.419
  916   1HH1  ARG  36          1HH1      ARG  36   2.668 -11.149  -7.850
  917   2HH1  ARG  36          2HH1      ARG  36   2.546 -12.779  -7.251
  918   1HH2  ARG  36          1HH2      ARG  36  -0.933 -12.991  -7.646
  919   2HH2  ARG  36          2HH2      ARG  36   0.513 -13.826  -7.146
  920    H    VAL  37           H        VAL  37   3.456  -5.515  -5.039
  921    HA   VAL  37           HA       VAL  37   1.087  -5.041  -3.345
  922    HB   VAL  37           HB       VAL  37   3.952  -4.379  -2.636
  923   1HG1  VAL  37          1HG1      VAL  37   1.774  -3.066  -1.770
  924   2HG1  VAL  37          2HG1      VAL  37   3.226  -3.297  -0.796
  925   3HG1  VAL  37          3HG1      VAL  37   1.839  -4.367  -0.580
  926   1HG2  VAL  37          1HG2      VAL  37   2.566  -6.221  -0.875
  927   2HG2  VAL  37          2HG2      VAL  37   4.168  -6.338  -1.609
  928   3HG2  VAL  37          3HG2      VAL  37   2.743  -6.857  -2.512
  929    H    ASN  38           H        ASN  38   0.225  -3.040  -3.420
  930    HA   ASN  38           HA       ASN  38   1.557  -1.083  -5.167
  931   1HB   ASN  38          1HB       ASN  38  -0.492  -1.159  -6.147
  932   2HB   ASN  38          2HB       ASN  38  -1.257  -1.836  -4.714
  933   1HD2  ASN  38          1HD2      ASN  38  -0.415   1.071  -6.423
  934   2HD2  ASN  38          2HD2      ASN  38  -1.366   2.156  -5.454
  935    H    VAL  39           H        VAL  39   2.386   0.688  -4.293
  936    HA   VAL  39           HA       VAL  39   1.472   1.479  -1.607
  937    HB   VAL  39           HB       VAL  39   4.213   2.214  -1.921
  938   1HG1  VAL  39          1HG1      VAL  39   3.993   0.206   0.013
  939   2HG1  VAL  39          2HG1      VAL  39   2.437   1.040   0.005
  940   3HG1  VAL  39          3HG1      VAL  39   3.924   1.953   0.261
  941   1HG2  VAL  39          1HG2      VAL  39   3.562  -0.530  -2.810
  942   2HG2  VAL  39          2HG2      VAL  39   4.907  -0.363  -1.684
  943   3HG2  VAL  39          3HG2      VAL  39   4.931   0.502  -3.221
  944    H    ASN  40           H        ASN  40   1.662   3.681  -1.098
  945    HA   ASN  40           HA       ASN  40   1.986   5.421  -3.443
  946   1HB   ASN  40          1HB       ASN  40   0.445   7.010  -2.269
  947   2HB   ASN  40          2HB       ASN  40  -0.309   5.501  -2.760
  948   1HD2  ASN  40          1HD2      ASN  40  -0.985   4.040  -1.215
  949   2HD2  ASN  40          2HD2      ASN  40  -1.123   4.467   0.467
  950    H    PHE  41           H        PHE  41   3.417   7.014  -3.347
  951    HA   PHE  41           HA       PHE  41   4.666   7.620  -0.748
  952   1HB   PHE  41          1HB       PHE  41   6.114   7.463  -3.400
  953   2HB   PHE  41          2HB       PHE  41   6.835   7.784  -1.831
  954    HD1  PHE  41           HD1      PHE  41   6.077   5.835  -0.041
  955    HD2  PHE  41           HD2      PHE  41   6.580   5.396  -4.240
  956    HE1  PHE  41           HE1      PHE  41   6.489   3.431   0.263
  957    HE2  PHE  41           HE2      PHE  41   6.995   2.989  -3.943
  958    HZ   PHE  41           HZ       PHE  41   6.956   2.006  -1.695
  959    H    ASP  42           H        ASP  42   5.698   9.753  -0.692
  960    HA   ASP  42           HA       ASP  42   4.040  11.798  -1.682
  961   1HB   ASP  42          1HB       ASP  42   6.898  12.267  -0.892
  962   2HB   ASP  42          2HB       ASP  42   5.496  13.296  -0.612
  963    H    GLU  43           H        GLU  43   4.356  13.325  -3.302
  964    HA   GLU  43           HA       GLU  43   5.490  12.424  -5.700
  965   1HB   GLU  43          1HB       GLU  43   3.719  14.314  -5.162
  966   2HB   GLU  43          2HB       GLU  43   5.138  15.349  -5.222
  967   1HG   GLU  43          1HG       GLU  43   5.133  13.595  -7.482
  968   2HG   GLU  43          2HG       GLU  43   3.580  14.423  -7.363
  969    H    GLU  44           H        GLU  44   6.715  14.628  -3.229
  970    HA   GLU  44           HA       GLU  44   9.124  15.401  -4.457
  971   1HB   GLU  44          1HB       GLU  44   7.980  16.119  -2.200
  972   2HB   GLU  44          2HB       GLU  44   8.964  14.821  -1.530
  973   1HG   GLU  44          1HG       GLU  44  10.598  16.467  -3.193
  974   2HG   GLU  44          2HG       GLU  44   9.710  17.486  -2.063
  975    H    LYS  45           H        LYS  45   8.374  12.730  -2.282
  976    HA   LYS  45           HA       LYS  45  10.924  11.522  -2.256
  977   1HB   LYS  45          1HB       LYS  45   9.279  11.050  -0.548
  978   2HB   LYS  45          2HB       LYS  45   8.143  10.443  -1.741
  979   1HG   LYS  45          1HG       LYS  45   9.820   8.616  -2.216
  980   2HG   LYS  45          2HG       LYS  45  10.683   9.165  -0.777
  981   1HD   LYS  45          1HD       LYS  45   7.783   8.730  -0.452
  982   2HD   LYS  45          2HD       LYS  45   8.750   7.283  -0.742
  983   1HE   LYS  45          1HE       LYS  45   9.015   7.328   1.493
  984   2HE   LYS  45          2HE       LYS  45  10.268   8.507   1.114
  985   1HZ   LYS  45          1HZ       LYS  45   9.132  10.108   2.132
  986   2HZ   LYS  45          2HZ       LYS  45   8.122   8.903   2.764
  987   3HZ   LYS  45          3HZ       LYS  45   7.680   9.718   1.344
  988    H    HIS  46           H        HIS  46   8.333  11.516  -4.532
  989    HA   HIS  46           HA       HIS  46   9.284   9.191  -5.986
  990   1HB   HIS  46          1HB       HIS  46   6.860   9.912  -5.909
  991   2HB   HIS  46          2HB       HIS  46   7.307  11.259  -6.949
  992    HD1  HIS  46           HD1      HIS  46   7.150  10.831  -9.390
  993    HD2  HIS  46           HD2      HIS  46   7.459   7.302  -7.195
  994    HE1  HIS  46           HE1      HIS  46   6.852   8.963 -11.050
  995    HE2  HIS  46           HE2      HIS  46   7.112   6.835  -9.724
  996    H    THR  47           H        THR  47   9.644  12.661  -6.093
  997    HA   THR  47           HA       THR  47  10.946  12.759  -8.652
  998    HB   THR  47           HB       THR  47  11.458  14.811  -6.526
  999    HG1  THR  47           HG1      THR  47   9.053  14.055  -6.896
 1000   1HG2  THR  47          1HG2      THR  47  12.532  15.347  -8.522
 1001   2HG2  THR  47          2HG2      THR  47  11.031  16.268  -8.618
 1002   3HG2  THR  47          3HG2      THR  47  11.197  14.758  -9.512
 1003    H    ARG  48           H        ARG  48  11.926  12.541  -5.286
 1004    HA   ARG  48           HA       ARG  48  14.727  12.578  -5.677
 1005   1HB   ARG  48          1HB       ARG  48  13.079  12.494  -3.499
 1006   2HB   ARG  48          2HB       ARG  48  13.703  10.850  -3.529
 1007   1HG   ARG  48          1HG       ARG  48  15.129  12.109  -2.128
 1008   2HG   ARG  48          2HG       ARG  48  16.006  11.823  -3.633
 1009   1HD   ARG  48          1HD       ARG  48  16.411  14.057  -3.334
 1010   2HD   ARG  48          2HD       ARG  48  14.949  14.123  -4.317
 1011    HE   ARG  48           HE       ARG  48  13.714  14.747  -2.404
 1012   1HH1  ARG  48          1HH1      ARG  48  17.135  14.365  -1.760
 1013   2HH1  ARG  48          2HH1      ARG  48  17.084  15.271  -0.277
 1014   1HH2  ARG  48          1HH2      ARG  48  13.636  15.942  -0.475
 1015   2HH2  ARG  48          2HH2      ARG  48  15.096  16.190   0.445
 1016    H    PHE  49           H        PHE  49  12.319  10.003  -5.581
 1017    HA   PHE  49           HA       PHE  49  14.050   7.820  -5.864
 1018   1HB   PHE  49          1HB       PHE  49  11.370   8.104  -5.521
 1019   2HB   PHE  49          2HB       PHE  49  11.430   7.612  -7.212
 1020    HD1  PHE  49           HD1      PHE  49  14.154   6.395  -5.252
 1021    HD2  PHE  49           HD2      PHE  49  10.115   5.623  -6.344
 1022    HE1  PHE  49           HE1      PHE  49  14.421   4.053  -4.564
 1023    HE2  PHE  49           HE2      PHE  49  10.377   3.276  -5.662
 1024    HZ   PHE  49           HZ       PHE  49  12.537   2.489  -4.771
 1025    H    LYS  50           H        LYS  50  12.460   9.863  -8.262
 1026    HA   LYS  50           HA       LYS  50  13.266   8.441 -10.555
 1027   1HB   LYS  50          1HB       LYS  50  12.186  11.126  -9.966
 1028   2HB   LYS  50          2HB       LYS  50  13.103  10.992 -11.459
 1029   1HG   LYS  50          1HG       LYS  50  10.871   9.107 -10.775
 1030   2HG   LYS  50          2HG       LYS  50  10.600  10.638 -11.608
 1031   1HD   LYS  50          1HD       LYS  50  12.413   8.419 -12.557
 1032   2HD   LYS  50          2HD       LYS  50  10.798   8.757 -13.180
 1033   1HE   LYS  50          1HE       LYS  50  12.473  11.117 -13.195
 1034   2HE   LYS  50          2HE       LYS  50  13.199   9.799 -14.112
 1035   1HZ   LYS  50          1HZ       LYS  50  10.378  10.592 -14.505
 1036   2HZ   LYS  50          2HZ       LYS  50  11.373   9.693 -15.540
 1037   3HZ   LYS  50          3HZ       LYS  50  11.637  11.359 -15.341
 1038    H    ALA  51           H        ALA  51  14.748  11.140  -8.800
 1039    HA   ALA  51           HA       ALA  51  16.964  11.478 -10.523
 1040   1HB   ALA  51          1HB       ALA  51  16.083  12.489  -7.948
 1041   2HB   ALA  51          2HB       ALA  51  17.011  13.289  -9.220
 1042   3HB   ALA  51          3HB       ALA  51  17.832  12.279  -8.027
 1043    H    ALA  52           H        ALA  52  16.570   9.670  -7.486
 1044    HA   ALA  52           HA       ALA  52  19.213   8.740  -7.336
 1045   1HB   ALA  52          1HB       ALA  52  17.211   6.950  -6.190
 1046   2HB   ALA  52          2HB       ALA  52  17.031   8.637  -5.709
 1047   3HB   ALA  52          3HB       ALA  52  18.554   7.797  -5.424
 1048    H    CYS  53           H        CYS  53  16.294   7.134  -8.654
 1049    HA   CYS  53           HA       CYS  53  17.663   4.751  -9.345
 1050   1HB   CYS  53          1HB       CYS  53  15.691   4.130 -10.573
 1051   2HB   CYS  53          2HB       CYS  53  15.193   4.930  -9.088
 1052    HG   CYS  53           HG       CYS  53  14.218   7.152 -10.171
 1053    H    ALA  54           H        ALA  54  17.376   7.830 -10.887
 1054    HA   ALA  54           HA       ALA  54  18.212   6.996 -13.497
 1055   1HB   ALA  54          1HB       ALA  54  18.891   9.738 -12.729
 1056   2HB   ALA  54          2HB       ALA  54  17.194   9.323 -12.479
 1057   3HB   ALA  54          3HB       ALA  54  17.920   9.142 -14.078
 1058    H    ARG  55           H        ARG  55  19.814   8.333 -10.641
 1059    HA   ARG  55           HA       ARG  55  22.435   8.378 -11.713
 1060   1HB   ARG  55          1HB       ARG  55  21.180   8.762  -9.104
 1061   2HB   ARG  55          2HB       ARG  55  22.750   7.979  -8.990
 1062   1HG   ARG  55          1HG       ARG  55  22.410  10.443 -10.641
 1063   2HG   ARG  55          2HG       ARG  55  22.601  10.553  -8.891
 1064   1HD   ARG  55          1HD       ARG  55  24.796  10.298  -9.092
 1065   2HD   ARG  55          2HD       ARG  55  24.559   8.756  -9.913
 1066    HE   ARG  55           HE       ARG  55  25.049   9.769 -11.893
 1067   1HH1  ARG  55          1HH1      ARG  55  24.296  12.263  -9.534
 1068   2HH1  ARG  55          2HH1      ARG  55  24.659  13.574 -10.624
 1069   1HH2  ARG  55          1HH2      ARG  55  25.512  11.507 -13.320
 1070   2HH2  ARG  55          2HH2      ARG  55  25.348  13.145 -12.758
 1071    H    LYS  56           H        LYS  56  20.593   5.970  -9.921
 1072    HA   LYS  56           HA       LYS  56  22.756   4.111  -9.739
 1073   1HB   LYS  56          1HB       LYS  56  19.789   3.894  -9.237
 1074   2HB   LYS  56          2HB       LYS  56  20.876   2.525  -9.046
 1075   1HG   LYS  56          1HG       LYS  56  21.323   5.120  -7.608
 1076   2HG   LYS  56          2HG       LYS  56  20.275   3.854  -6.964
 1077   1HD   LYS  56          1HD       LYS  56  22.127   2.281  -6.978
 1078   2HD   LYS  56          2HD       LYS  56  23.179   3.497  -7.704
 1079   1HE   LYS  56          1HE       LYS  56  23.214   4.797  -5.759
 1080   2HE   LYS  56          2HE       LYS  56  21.798   3.991  -5.091
 1081   1HZ   LYS  56          1HZ       LYS  56  24.581   3.236  -4.969
 1082   2HZ   LYS  56          2HZ       LYS  56  23.531   1.956  -5.339
 1083   3HZ   LYS  56          3HZ       LYS  56  23.304   2.853  -3.919
 1084    H    GLY  57           H        GLY  57  20.482   4.910 -12.160
 1085   1HA   GLY  57          1HA       GLY  57  20.121   4.076 -14.268
 1086   2HA   GLY  57          2HA       GLY  57  21.592   3.132 -14.063
 1087    H    THR  58           H        THR  58  18.400   3.144 -12.490
 1088    HA   THR  58           HA       THR  58  18.041   0.347 -13.253
 1089    HB   THR  58           HB       THR  58  19.239   0.908 -10.902
 1090    HG1  THR  58           HG1      THR  58  17.375  -1.227 -10.971
 1091   1HG2  THR  58          1HG2      THR  58  16.605   0.262  -9.777
 1092   2HG2  THR  58          2HG2      THR  58  16.779   1.916 -10.367
 1093   3HG2  THR  58          3HG2      THR  58  17.892   1.293  -9.150
 1094    H    SER  59           H        SER  59  15.858  -0.469 -12.693
 1095    HA   SER  59           HA       SER  59  13.853   1.349 -13.533
 1096   1HB   SER  59          1HB       SER  59  12.629  -0.940 -12.385
 1097   2HB   SER  59          2HB       SER  59  12.914  -0.612 -14.094
 1098    HG   SER  59           HG       SER  59  14.829  -1.772 -12.335
 1099    H    ILE  60           H        ILE  60  12.288   2.406 -12.430
 1100    HA   ILE  60           HA       ILE  60  12.762   3.260  -9.847
 1101    HB   ILE  60           HB       ILE  60  11.327   4.381 -11.580
 1102   1HG1  ILE  60          1HG1      ILE  60   9.533   4.607  -9.350
 1103   2HG1  ILE  60          2HG1      ILE  60  11.184   4.450  -8.758
 1104   1HG2  ILE  60          1HG2      ILE  60   9.743   2.960 -12.371
 1105   2HG2  ILE  60          2HG2      ILE  60   8.793   3.763 -11.118
 1106   3HG2  ILE  60          3HG2      ILE  60   9.504   2.177 -10.808
 1107   1HD1  ILE  60          1HD1      ILE  60  10.790   6.342 -10.976
 1108   2HD1  ILE  60          2HD1      ILE  60  11.790   6.471  -9.530
 1109   3HD1  ILE  60          3HD1      ILE  60  10.056   6.781  -9.432
 1110    H    THR  61           H        THR  61  10.987   0.439 -10.868
 1111    HA   THR  61           HA       THR  61   9.744   0.060  -8.304
 1112    HB   THR  61           HB       THR  61   9.698  -2.348  -9.792
 1113    HG1  THR  61           HG1      THR  61   9.386  -1.738 -11.828
 1114   1HG2  THR  61          1HG2      THR  61   7.514  -2.174  -9.317
 1115   2HG2  THR  61          2HG2      THR  61   7.385  -0.594 -10.091
 1116   3HG2  THR  61          3HG2      THR  61   7.953  -0.716  -8.425
 1117    H    ASP  62           H        ASP  62  12.585  -1.150 -10.003
 1118    HA   ASP  62           HA       ASP  62  13.056  -3.205  -8.058
 1119   1HB   ASP  62          1HB       ASP  62  14.515  -4.091  -9.518
 1120   2HB   ASP  62          2HB       ASP  62  13.768  -2.982 -10.656
 1121    H    VAL  63           H        VAL  63  13.754   0.123  -8.202
 1122    HA   VAL  63           HA       VAL  63  16.010   0.014  -6.386
 1123    HB   VAL  63           HB       VAL  63  14.702   2.424  -5.865
 1124   1HG1  VAL  63          1HG1      VAL  63  17.005   2.398  -5.869
 1125   2HG1  VAL  63          2HG1      VAL  63  16.626   3.309  -7.333
 1126   3HG1  VAL  63          3HG1      VAL  63  17.101   1.612  -7.446
 1127   1HG2  VAL  63          1HG2      VAL  63  14.298   3.450  -7.981
 1128   2HG2  VAL  63          2HG2      VAL  63  13.329   1.979  -7.892
 1129   3HG2  VAL  63          3HG2      VAL  63  14.815   2.000  -8.842
 1130    H    VAL  64           H        VAL  64  12.538  -0.059  -6.221
 1131    HA   VAL  64           HA       VAL  64  12.271   0.306  -3.407
 1132    HB   VAL  64           HB       VAL  64  10.484  -1.415  -5.133
 1133   1HG1  VAL  64          1HG1      VAL  64   9.005  -1.409  -3.431
 1134   2HG1  VAL  64          2HG1      VAL  64   9.422   0.226  -2.926
 1135   3HG1  VAL  64          3HG1      VAL  64  10.449  -1.128  -2.462
 1136   1HG2  VAL  64          1HG2      VAL  64  10.870   0.920  -6.053
 1137   2HG2  VAL  64          2HG2      VAL  64  10.060   1.517  -4.603
 1138   3HG2  VAL  64          3HG2      VAL  64   9.197   0.469  -5.732
 1139    H    ASN  65           H        ASN  65  12.665  -2.500  -5.532
 1140    HA   ASN  65           HA       ASN  65  12.780  -4.504  -3.559
 1141   1HB   ASN  65          1HB       ASN  65  12.655  -5.119  -5.881
 1142   2HB   ASN  65          2HB       ASN  65  14.162  -4.284  -6.241
 1143   1HD2  ASN  65          1HD2      ASN  65  15.803  -5.598  -6.536
 1144   2HD2  ASN  65          2HD2      ASN  65  16.034  -7.133  -5.761
 1145    H    GLN  66           H        GLN  66  15.219  -2.228  -4.683
 1146    HA   GLN  66           HA       GLN  66  17.416  -3.447  -3.335
 1147   1HB   GLN  66          1HB       GLN  66  16.938  -1.061  -4.958
 1148   2HB   GLN  66          2HB       GLN  66  18.144  -0.821  -3.701
 1149   1HG   GLN  66          1HG       GLN  66  18.697  -3.301  -4.916
 1150   2HG   GLN  66          2HG       GLN  66  18.396  -2.139  -6.211
 1151   1HE2  GLN  66          1HE2      GLN  66  20.013  -0.897  -6.811
 1152   2HE2  GLN  66          2HE2      GLN  66  21.469  -0.608  -5.908
 1153    H    LEU  67           H        LEU  67  15.274  -0.696  -2.515
 1154    HA   LEU  67           HA       LEU  67  16.718  -0.092  -0.141
 1155   1HB   LEU  67          1HB       LEU  67  14.373   0.961   0.500
 1156   2HB   LEU  67          2HB       LEU  67  15.490   1.735  -0.600
 1157    HG   LEU  67           HG       LEU  67  13.954   0.196  -2.285
 1158   1HD1  LEU  67          1HD1      LEU  67  11.914   1.581  -0.669
 1159   2HD1  LEU  67          2HD1      LEU  67  12.533   0.062  -0.020
 1160   3HD1  LEU  67          3HD1      LEU  67  11.801   0.102  -1.622
 1161   1HD2  LEU  67          1HD2      LEU  67  13.979   2.191  -3.247
 1162   2HD2  LEU  67          2HD2      LEU  67  14.519   2.931  -1.741
 1163   3HD2  LEU  67          3HD2      LEU  67  12.795   2.770  -2.078
 1164    H    VAL  68           H        VAL  68  14.022  -2.193  -0.887
 1165    HA   VAL  68           HA       VAL  68  13.410  -2.922   1.799
 1166    HB   VAL  68           HB       VAL  68  13.034  -4.587  -0.701
 1167   1HG1  VAL  68          1HG1      VAL  68  12.084  -4.842   2.126
 1168   2HG1  VAL  68          2HG1      VAL  68  12.779  -6.068   1.061
 1169   3HG1  VAL  68          3HG1      VAL  68  11.129  -5.502   0.797
 1170   1HG2  VAL  68          1HG2      VAL  68  10.711  -3.262   0.503
 1171   2HG2  VAL  68          2HG2      VAL  68  11.153  -3.461  -1.191
 1172   3HG2  VAL  68          3HG2      VAL  68  11.882  -2.171  -0.237
 1173    H    ASP  69           H        ASP  69  15.754  -3.954  -0.583
 1174    HA   ASP  69           HA       ASP  69  16.676  -6.317   0.619
 1175   1HB   ASP  69          1HB       ASP  69  17.653  -4.411  -1.378
 1176   2HB   ASP  69          2HB       ASP  69  18.943  -5.149  -0.433
 1177    H    ASN  70           H        ASN  70  17.871  -2.993   0.906
 1178    HA   ASN  70           HA       ASN  70  19.839  -3.486   2.825
 1179   1HB   ASN  70          1HB       ASN  70  19.673  -1.402   1.516
 1180   2HB   ASN  70          2HB       ASN  70  18.221  -0.963   2.409
 1181   1HD2  ASN  70          1HD2      ASN  70  21.597  -1.909   2.969
 1182   2HD2  ASN  70          2HD2      ASN  70  21.853  -0.814   4.293
 1183    H    TRP  71           H        TRP  71  16.495  -2.360   3.252
 1184    HA   TRP  71           HA       TRP  71  16.503  -2.255   6.052
 1185   1HB   TRP  71          1HB       TRP  71  14.761  -1.241   4.635
 1186   2HB   TRP  71          2HB       TRP  71  14.190  -2.845   4.188
 1187    HD1  TRP  71           HD1      TRP  71  14.334  -0.462   7.186
 1188    HE1  TRP  71           HE1      TRP  71  12.534  -1.150   8.891
 1189    HE3  TRP  71           HE3      TRP  71  12.733  -4.763   4.951
 1190    HZ2  TRP  71           HZ2      TRP  71  10.677  -3.248   9.235
 1191    HZ3  TRP  71           HZ3      TRP  71  10.937  -6.051   6.029
 1192    HH2  TRP  71           HH2      TRP  71   9.926  -5.307   8.124
 1193    H    LEU  72           H        LEU  72  15.180  -4.798   3.958
 1194    HA   LEU  72           HA       LEU  72  14.267  -6.536   5.850
 1195   1HB   LEU  72          1HB       LEU  72  14.348  -6.535   3.181
 1196   2HB   LEU  72          2HB       LEU  72  15.601  -7.722   3.486
 1197    HG   LEU  72           HG       LEU  72  13.638  -8.675   5.082
 1198   1HD1  LEU  72          1HD1      LEU  72  11.638  -8.583   3.391
 1199   2HD1  LEU  72          2HD1      LEU  72  12.372  -7.043   2.939
 1200   3HD1  LEU  72          3HD1      LEU  72  11.856  -7.322   4.605
 1201   1HD2  LEU  72          1HD2      LEU  72  13.237 -10.305   3.320
 1202   2HD2  LEU  72          2HD2      LEU  72  14.954  -9.916   3.427
 1203   3HD2  LEU  72          3HD2      LEU  72  13.972  -9.225   2.136
 1204    H    LYS  73           H        LYS  73  17.460  -6.664   4.331
 1205    HA   LYS  73           HA       LYS  73  18.185  -8.947   5.852
 1206   1HB   LYS  73          1HB       LYS  73  20.009  -7.239   4.177
 1207   2HB   LYS  73          2HB       LYS  73  20.191  -8.944   4.574
 1208   1HG   LYS  73          1HG       LYS  73  18.271  -9.517   3.238
 1209   2HG   LYS  73          2HG       LYS  73  17.925  -7.815   2.948
 1210   1HD   LYS  73          1HD       LYS  73  19.460  -7.639   1.320
 1211   2HD   LYS  73          2HD       LYS  73  20.638  -8.627   2.190
 1212   1HE   LYS  73          1HE       LYS  73  20.034 -10.497   1.110
 1213   2HE   LYS  73          2HE       LYS  73  18.317 -10.122   1.230
 1214   1HZ   LYS  73          1HZ       LYS  73  18.461  -8.714  -0.669
 1215   2HZ   LYS  73          2HZ       LYS  73  19.194 -10.189  -1.075
 1216   3HZ   LYS  73          3HZ       LYS  73  20.153  -8.837  -0.719
 1217    H    GLU  74           H        GLU  74  18.638  -5.530   6.306
 1218    HA   GLU  74           HA       GLU  74  20.769  -5.983   8.239
 1219   1HB   GLU  74          1HB       GLU  74  19.575  -3.499   7.040
 1220   2HB   GLU  74          2HB       GLU  74  20.701  -3.432   8.390
 1221   1HG   GLU  74          1HG       GLU  74  21.547  -5.043   6.073
 1222   2HG   GLU  74          2HG       GLU  74  21.447  -3.302   5.821
 1223    H    ASN  75           H        ASN  75  17.401  -4.900   8.197
 1224    HA   ASN  75           HA       ASN  75  17.365  -4.033  10.893
 1225   1HB   ASN  75          1HB       ASN  75  15.231  -3.387  10.503
 1226   2HB   ASN  75          2HB       ASN  75  15.645  -3.719   8.823
 1227   1HD2  ASN  75          1HD2      ASN  75  14.832  -5.552   7.829
 1228   2HD2  ASN  75          2HD2      ASN  75  13.521  -6.466   8.497
 1229    H    GLU  76           H        GLU  76  16.881  -7.162   9.435
 1230    HA   GLU  76           HA       GLU  76  15.716  -8.339  11.790
 1231   1HB   GLU  76          1HB       GLU  76  15.277  -9.208   9.500
 1232   2HB   GLU  76          2HB       GLU  76  16.964  -9.693   9.387
 1233   1HG   GLU  76          1HG       GLU  76  15.689 -11.617   9.929
 1234   2HG   GLU  76          2HG       GLU  76  16.607 -11.160  11.363
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -4.438  29.601  30.665
    2   2H    MET   1          2H        MET   1  -3.509  30.747  31.502
    3   3H    MET   1          3H        MET   1  -5.125  31.088  31.101
    4    HA   MET   1           HA       MET   1  -4.196  28.998  32.988
    5   1HB   MET   1          1HB       MET   1  -4.432  31.718  33.378
    6   2HB   MET   1          2HB       MET   1  -5.992  31.119  33.924
    7   1HG   MET   1          1HG       MET   1  -5.035  30.672  35.868
    8   2HG   MET   1          2HG       MET   1  -4.156  29.379  35.054
    9   1HE   MET   1          1HE       MET   1  -3.956  33.332  35.760
   10   2HE   MET   1          2HE       MET   1  -2.511  33.226  36.762
   11   3HE   MET   1          3HE       MET   1  -3.957  32.319  37.204
   12    H    SER   2           H        SER   2  -6.175  28.334  34.367
   13    HA   SER   2           HA       SER   2  -8.037  27.138  32.595
   14   1HB   SER   2          1HB       SER   2  -8.745  26.988  35.410
   15   2HB   SER   2          2HB       SER   2  -8.258  25.700  34.306
   16    HG   SER   2           HG       SER   2  -6.335  25.755  35.143
   17    H    LEU   3           H        LEU   3  -8.448  29.793  32.199
   18    HA   LEU   3           HA       LEU   3 -11.228  30.046  32.914
   19   1HB   LEU   3          1HB       LEU   3 -10.380  32.623  33.488
   20   2HB   LEU   3          2HB       LEU   3 -10.961  31.434  34.638
   21    HG   LEU   3           HG       LEU   3  -8.188  30.950  34.182
   22   1HD1  LEU   3          1HD1      LEU   3  -7.142  32.922  34.267
   23   2HD1  LEU   3          2HD1      LEU   3  -8.316  33.605  35.389
   24   3HD1  LEU   3          3HD1      LEU   3  -8.662  33.578  33.660
   25   1HD2  LEU   3          1HD2      LEU   3  -8.124  31.608  36.639
   26   2HD2  LEU   3          2HD2      LEU   3  -9.181  30.266  36.195
   27   3HD2  LEU   3          3HD2      LEU   3  -9.864  31.865  36.497
   28    H    GLU   4           H        GLU   4  -9.012  32.644  32.046
   29    HA   GLU   4           HA       GLU   4  -8.817  33.967  30.224
   30   1HB   GLU   4          1HB       GLU   4  -9.024  31.255  29.176
   31   2HB   GLU   4          2HB       GLU   4  -9.561  32.468  28.021
   32   1HG   GLU   4          1HG       GLU   4  -7.357  32.419  27.499
   33   2HG   GLU   4          2HG       GLU   4  -7.316  33.648  28.762
   34    H    LYS   5           H        LYS   5 -11.319  33.897  31.619
   35    HA   LYS   5           HA       LYS   5 -13.107  34.800  29.460
   36   1HB   LYS   5          1HB       LYS   5 -15.005  34.124  30.933
   37   2HB   LYS   5          2HB       LYS   5 -14.019  32.771  30.414
   38   1HG   LYS   5          1HG       LYS   5 -13.575  32.188  32.500
   39   2HG   LYS   5          2HG       LYS   5 -13.066  33.824  32.921
   40   1HD   LYS   5          1HD       LYS   5 -15.590  34.350  32.989
   41   2HD   LYS   5          2HD       LYS   5 -15.798  32.598  33.066
   42   1HE   LYS   5          1HE       LYS   5 -13.778  33.466  34.926
   43   2HE   LYS   5          2HE       LYS   5 -15.282  34.348  35.187
   44   1HZ   LYS   5          1HZ       LYS   5 -16.445  32.393  35.604
   45   2HZ   LYS   5          2HZ       LYS   5 -14.969  32.151  36.401
   46   3HZ   LYS   5          3HZ       LYS   5 -15.256  31.407  34.907
   47    H    ALA   6           H        ALA   6 -15.020  35.922  31.379
   48    HA   ALA   6           HA       ALA   6 -14.019  38.490  31.727
   49   1HB   ALA   6          1HB       ALA   6 -16.448  37.393  32.011
   50   2HB   ALA   6          2HB       ALA   6 -16.025  38.988  32.638
   51   3HB   ALA   6          3HB       ALA   6 -16.009  37.585  33.710
   52    H    HIS   7           H        HIS   7 -13.008  39.575  33.343
   53    HA   HIS   7           HA       HIS   7 -11.615  39.936  35.092
   54   1HB   HIS   7          1HB       HIS   7 -13.592  38.110  36.183
   55   2HB   HIS   7          2HB       HIS   7 -12.015  37.864  36.926
   56    HD1  HIS   7           HD1      HIS   7 -10.881  40.437  37.528
   57    HD2  HIS   7           HD2      HIS   7 -15.007  39.903  37.587
   58    HE1  HIS   7           HE1      HIS   7 -11.789  42.304  38.951
   59    HE2  HIS   7           HE2      HIS   7 -14.298  42.079  38.792
   60    H    THR   8           H        THR   8 -10.329  39.019  33.155
   61    HA   THR   8           HA       THR   8  -9.126  36.436  33.560
   62    HB   THR   8           HB       THR   8  -7.840  38.252  31.648
   63    HG1  THR   8           HG1      THR   8 -10.565  37.507  31.230
   64   1HG2  THR   8          1HG2      THR   8  -8.224  36.360  30.127
   65   2HG2  THR   8          2HG2      THR   8  -9.199  35.567  31.366
   66   3HG2  THR   8          3HG2      THR   8  -7.475  35.833  31.636
   67    H    SER   9           H        SER   9  -6.705  36.249  33.434
   68    HA   SER   9           HA       SER   9  -5.488  37.913  35.472
   69   1HB   SER   9          1HB       SER   9  -3.853  35.887  34.069
   70   2HB   SER   9          2HB       SER   9  -4.075  36.156  35.798
   71    HG   SER   9           HG       SER   9  -5.527  34.552  34.030
   72    H    VAL  10           H        VAL  10  -2.794  37.798  34.510
   73    HA   VAL  10           HA       VAL  10  -2.826  40.079  32.776
   74    HB   VAL  10           HB       VAL  10  -0.223  39.362  32.726
   75   1HG1  VAL  10          1HG1      VAL  10   0.111  40.930  34.536
   76   2HG1  VAL  10          2HG1      VAL  10  -1.573  40.758  35.030
   77   3HG1  VAL  10          3HG1      VAL  10  -1.180  41.495  33.476
   78   1HG2  VAL  10          1HG2      VAL  10  -1.206  38.341  35.386
   79   2HG2  VAL  10          2HG2      VAL  10   0.458  38.398  34.815
   80   3HG2  VAL  10          3HG2      VAL  10  -0.700  37.312  34.049
   81    H    LYS  11           H        LYS  11  -3.689  39.545  30.830
   82    HA   LYS  11           HA       LYS  11  -2.153  37.640  29.190
   83   1HB   LYS  11          1HB       LYS  11  -5.134  38.166  29.086
   84   2HB   LYS  11          2HB       LYS  11  -4.249  37.095  28.010
   85   1HG   LYS  11          1HG       LYS  11  -4.303  36.700  30.987
   86   2HG   LYS  11          2HG       LYS  11  -5.520  36.012  29.912
   87   1HD   LYS  11          1HD       LYS  11  -2.561  35.556  29.576
   88   2HD   LYS  11          2HD       LYS  11  -3.611  34.482  30.500
   89   1HE   LYS  11          1HE       LYS  11  -4.769  33.781  28.621
   90   2HE   LYS  11          2HE       LYS  11  -4.314  35.207  27.690
   91   1HZ   LYS  11          1HZ       LYS  11  -2.956  33.647  26.769
   92   2HZ   LYS  11          2HZ       LYS  11  -2.791  32.757  28.203
   93   3HZ   LYS  11          3HZ       LYS  11  -1.932  34.208  28.000
   94    H    LYS  12           H        LYS  12  -3.470  38.189  26.779
   95    HA   LYS  12           HA       LYS  12  -3.083  41.063  26.353
   96   1HB   LYS  12          1HB       LYS  12  -1.455  38.881  25.237
   97   2HB   LYS  12          2HB       LYS  12  -2.083  39.990  24.023
   98   1HG   LYS  12          1HG       LYS  12  -0.633  40.953  26.469
   99   2HG   LYS  12          2HG       LYS  12   0.208  40.499  24.985
  100   1HD   LYS  12          1HD       LYS  12  -0.626  42.281  23.806
  101   2HD   LYS  12          2HD       LYS  12  -2.079  42.399  24.801
  102   1HE   LYS  12          1HE       LYS  12  -0.024  42.925  26.572
  103   2HE   LYS  12          2HE       LYS  12   0.488  43.726  25.087
  104   1HZ   LYS  12          1HZ       LYS  12  -1.091  44.884  26.843
  105   2HZ   LYS  12          2HZ       LYS  12  -2.284  44.108  25.922
  106   3HZ   LYS  12          3HZ       LYS  12  -1.212  45.196  25.182
  107    H    MET  13           H        MET  13  -5.496  40.435  26.585
  108    HA   MET  13           HA       MET  13  -6.815  39.027  24.548
  109   1HB   MET  13          1HB       MET  13  -7.567  40.785  26.777
  110   2HB   MET  13          2HB       MET  13  -8.708  40.778  25.441
  111   1HG   MET  13          1HG       MET  13  -9.575  39.053  26.595
  112   2HG   MET  13          2HG       MET  13  -8.359  38.151  25.694
  113   1HE   MET  13          1HE       MET  13  -7.658  40.708  28.417
  114   2HE   MET  13          2HE       MET  13  -7.312  39.762  29.865
  115   3HE   MET  13          3HE       MET  13  -8.977  39.945  29.307
  116    H    THR  14           H        THR  14  -6.131  42.470  24.944
  117    HA   THR  14           HA       THR  14  -7.448  43.172  22.485
  118    HB   THR  14           HB       THR  14  -5.929  45.335  23.134
  119    HG1  THR  14           HG1      THR  14  -6.163  45.472  25.469
  120   1HG2  THR  14          1HG2      THR  14  -8.055  46.019  24.461
  121   2HG2  THR  14          2HG2      THR  14  -8.685  44.469  23.907
  122   3HG2  THR  14          3HG2      THR  14  -8.188  45.687  22.735
  123    H    PHE  15           H        PHE  15  -6.553  43.446  20.523
  124    HA   PHE  15           HA       PHE  15  -3.779  42.656  20.176
  125   1HB   PHE  15          1HB       PHE  15  -4.277  42.259  17.951
  126   2HB   PHE  15          2HB       PHE  15  -5.847  41.988  18.695
  127    HD1  PHE  15           HD1      PHE  15  -3.930  43.999  16.388
  128    HD2  PHE  15           HD2      PHE  15  -7.611  43.728  18.505
  129    HE1  PHE  15           HE1      PHE  15  -4.922  45.655  14.870
  130    HE2  PHE  15           HE2      PHE  15  -8.611  45.385  16.986
  131    HZ   PHE  15           HZ       PHE  15  -7.264  46.356  15.167
  132    H    GLY  16           H        GLY  16  -5.625  45.490  20.453
  133   1HA   GLY  16          1HA       GLY  16  -5.066  47.705  20.431
  134   2HA   GLY  16          2HA       GLY  16  -3.388  47.186  20.492
  135    H    GLU  17           H        GLU  17  -2.174  47.700  18.857
  136    HA   GLU  17           HA       GLU  17  -3.412  48.068  16.216
  137   1HB   GLU  17          1HB       GLU  17  -1.339  49.861  17.500
  138   2HB   GLU  17          2HB       GLU  17  -1.890  49.987  15.835
  139   1HG   GLU  17          1HG       GLU  17  -3.257  51.544  16.704
  140   2HG   GLU  17          2HG       GLU  17  -4.251  50.141  17.093
  141    H    ASN  18           H        ASN  18  -1.707  46.030  17.762
  142    HA   ASN  18           HA       ASN  18   0.795  46.043  16.342
  143   1HB   ASN  18          1HB       ASN  18   0.956  45.266  18.558
  144   2HB   ASN  18          2HB       ASN  18  -0.444  44.215  18.381
  145   1HD2  ASN  18          1HD2      ASN  18   2.783  44.714  16.987
  146   2HD2  ASN  18          2HD2      ASN  18   3.155  43.029  16.828
  147    H    ARG  19           H        ARG  19  -1.859  43.656  16.560
  148    HA   ARG  19           HA       ARG  19  -0.859  42.219  14.291
  149   1HB   ARG  19          1HB       ARG  19  -2.735  41.737  16.373
  150   2HB   ARG  19          2HB       ARG  19  -3.575  41.519  14.844
  151   1HG   ARG  19          1HG       ARG  19  -1.134  40.212  14.525
  152   2HG   ARG  19          2HG       ARG  19  -1.674  39.806  16.154
  153   1HD   ARG  19          1HD       ARG  19  -3.303  38.484  15.390
  154   2HD   ARG  19          2HD       ARG  19  -3.827  39.684  14.208
  155    HE   ARG  19           HE       ARG  19  -1.950  38.840  12.784
  156   1HH1  ARG  19          1HH1      ARG  19  -3.414  36.791  15.233
  157   2HH1  ARG  19          2HH1      ARG  19  -2.945  35.315  14.442
  158   1HH2  ARG  19          1HH2      ARG  19  -1.368  36.875  11.742
  159   2HH2  ARG  19          2HH2      ARG  19  -1.787  35.357  12.488
  160    H    ASP  20           H        ASP  20  -1.740  42.064  12.235
  161    HA   ASP  20           HA       ASP  20  -3.616  44.222  11.530
  162   1HB   ASP  20          1HB       ASP  20  -2.492  44.593   9.532
  163   2HB   ASP  20          2HB       ASP  20  -1.167  44.220  10.624
  164    H    LEU  21           H        LEU  21  -3.708  41.208  12.238
  165    HA   LEU  21           HA       LEU  21  -5.118  39.490  11.883
  166   1HB   LEU  21          1HB       LEU  21  -6.696  41.539  11.538
  167   2HB   LEU  21          2HB       LEU  21  -6.653  41.060   9.852
  168    HG   LEU  21           HG       LEU  21  -7.302  38.699  10.832
  169   1HD1  LEU  21          1HD1      LEU  21  -8.274  38.614  12.879
  170   2HD1  LEU  21          2HD1      LEU  21  -8.809  40.293  12.821
  171   3HD1  LEU  21          3HD1      LEU  21  -7.126  39.917  13.188
  172   1HD2  LEU  21          1HD2      LEU  21  -9.636  39.230  10.457
  173   2HD2  LEU  21          2HD2      LEU  21  -8.629  40.050   9.262
  174   3HD2  LEU  21          3HD2      LEU  21  -9.295  40.953  10.623
  175    H    GLU  22           H        GLU  22  -2.771  39.941  10.173
  176    HA   GLU  22           HA       GLU  22  -3.550  38.488   7.750
  177   1HB   GLU  22          1HB       GLU  22  -1.884  40.464   7.760
  178   2HB   GLU  22          2HB       GLU  22  -0.751  39.322   8.471
  179   1HG   GLU  22          1HG       GLU  22  -2.116  38.404   6.038
  180   2HG   GLU  22          2HG       GLU  22  -1.004  39.758   5.835
  181    H    ARG  23           H        ARG  23  -3.554  36.363   7.834
  182    HA   ARG  23           HA       ARG  23  -1.729  35.016   9.709
  183   1HB   ARG  23          1HB       ARG  23  -4.069  33.439   9.422
  184   2HB   ARG  23          2HB       ARG  23  -3.457  34.220  10.872
  185   1HG   ARG  23          1HG       ARG  23  -4.655  36.316  10.045
  186   2HG   ARG  23          2HG       ARG  23  -5.483  35.245   8.914
  187   1HD   ARG  23          1HD       ARG  23  -5.562  35.215  11.914
  188   2HD   ARG  23          2HD       ARG  23  -6.903  35.427  10.789
  189    HE   ARG  23           HE       ARG  23  -6.344  33.026  10.110
  190   1HH1  ARG  23          1HH1      ARG  23  -6.016  34.309  13.363
  191   2HH1  ARG  23          2HH1      ARG  23  -6.107  32.737  14.115
  192   1HH2  ARG  23          1HH2      ARG  23  -6.482  30.994  11.085
  193   2HH2  ARG  23          2HH2      ARG  23  -6.350  30.838  12.810
  194    H    VAL  24           H        VAL  24  -0.528  33.500   8.809
  195    HA   VAL  24           HA       VAL  24  -0.919  32.837   6.024
  196    HB   VAL  24           HB       VAL  24   1.189  31.811   7.930
  197   1HG1  VAL  24          1HG1      VAL  24   0.605  30.660   5.632
  198   2HG1  VAL  24          2HG1      VAL  24   2.277  30.873   6.153
  199   3HG1  VAL  24          3HG1      VAL  24   1.567  31.990   4.986
  200   1HG2  VAL  24          1HG2      VAL  24   1.522  34.123   7.885
  201   2HG2  VAL  24          2HG2      VAL  24   1.078  34.246   6.181
  202   3HG2  VAL  24          3HG2      VAL  24   2.613  33.509   6.643
  203    H    VAL  25           H        VAL  25  -2.075  31.201   5.320
  204    HA   VAL  25           HA       VAL  25  -2.958  29.132   7.156
  205    HB   VAL  25           HB       VAL  25  -4.324  28.309   5.288
  206   1HG1  VAL  25          1HG1      VAL  25  -5.246  30.921   4.895
  207   2HG1  VAL  25          2HG1      VAL  25  -4.510  30.907   6.500
  208   3HG1  VAL  25          3HG1      VAL  25  -5.792  29.759   6.107
  209   1HG2  VAL  25          1HG2      VAL  25  -3.389  30.636   3.641
  210   2HG2  VAL  25          2HG2      VAL  25  -4.309  29.220   3.136
  211   3HG2  VAL  25          3HG2      VAL  25  -2.603  29.061   3.545
  212    H    THR  26           H        THR  26  -2.609  26.912   6.859
  213    HA   THR  26           HA       THR  26  -0.038  26.336   5.602
  214    HB   THR  26           HB       THR  26  -1.211  24.102   7.026
  215    HG1  THR  26           HG1      THR  26  -1.995  25.095   8.720
  216   1HG2  THR  26          1HG2      THR  26   1.214  24.549   6.514
  217   2HG2  THR  26          2HG2      THR  26   0.871  24.106   8.185
  218   3HG2  THR  26          3HG2      THR  26   1.175  25.793   7.765
  219    H    ALA  27           H        ALA  27  -0.021  25.539   3.622
  220    HA   ALA  27           HA       ALA  27  -2.317  24.562   2.298
  221   1HB   ALA  27          1HB       ALA  27   0.598  24.481   1.541
  222   2HB   ALA  27          2HB       ALA  27  -0.612  25.659   1.031
  223   3HB   ALA  27          3HB       ALA  27  -0.716  23.990   0.473
  224    HA   PRO  28           HA       PRO  28  -1.998  20.364   3.768
  225   1HB   PRO  28          1HB       PRO  28  -4.364  19.770   2.232
  226   2HB   PRO  28          2HB       PRO  28  -4.207  19.969   3.978
  227   1HG   PRO  28          1HG       PRO  28  -5.573  21.708   2.355
  228   2HG   PRO  28          2HG       PRO  28  -4.860  22.155   3.914
  229   1HD   PRO  28          1HD       PRO  28  -3.810  22.604   1.148
  230   2HD   PRO  28          2HD       PRO  28  -3.771  23.683   2.560
  231    H    VAL  29           H        VAL  29  -2.374  18.135   2.672
  232    HA   VAL  29           HA       VAL  29  -0.598  17.945   0.439
  233    HB   VAL  29           HB       VAL  29  -2.395  15.794   1.575
  234   1HG1  VAL  29          1HG1      VAL  29  -0.652  14.275   0.645
  235   2HG1  VAL  29          2HG1      VAL  29   0.079  15.674  -0.142
  236   3HG1  VAL  29          3HG1      VAL  29  -1.551  15.170  -0.581
  237   1HG2  VAL  29          1HG2      VAL  29  -0.446  15.108   2.899
  238   2HG2  VAL  29          2HG2      VAL  29  -0.991  16.729   3.329
  239   3HG2  VAL  29          3HG2      VAL  29   0.438  16.517   2.315
  240    H    SER  30           H        SER  30  -1.221  18.596  -1.522
  241    HA   SER  30           HA       SER  30  -3.626  17.472  -2.706
  242   1HB   SER  30          1HB       SER  30  -3.562  20.318  -3.295
  243   2HB   SER  30          2HB       SER  30  -4.902  19.331  -2.711
  244    HG   SER  30           HG       SER  30  -2.838  20.122  -0.958
  245    H    SER  31           H        SER  31  -3.801  18.583  -5.046
  246    HA   SER  31           HA       SER  31  -2.923  18.816  -7.117
  247   1HB   SER  31          1HB       SER  31  -0.298  19.631  -5.879
  248   2HB   SER  31          2HB       SER  31  -0.993  20.138  -7.421
  249    HG   SER  31           HG       SER  31  -2.761  21.011  -5.968
  250    H    GLY  32           H        GLY  32  -2.864  16.275  -5.967
  251   1HA   GLY  32          1HA       GLY  32  -2.047  14.182  -6.423
  252   2HA   GLY  32          2HA       GLY  32  -1.224  14.923  -7.788
  253    H    LYS  33           H        LYS  33  -0.863  15.218  -4.259
  254    HA   LYS  33           HA       LYS  33   2.023  15.116  -4.558
  255   1HB   LYS  33          1HB       LYS  33   0.324  16.408  -2.808
  256   2HB   LYS  33          2HB       LYS  33   0.979  15.100  -1.827
  257   1HG   LYS  33          1HG       LYS  33   3.267  15.886  -2.714
  258   2HG   LYS  33          2HG       LYS  33   2.411  17.367  -3.150
  259   1HD   LYS  33          1HD       LYS  33   2.783  18.053  -1.063
  260   2HD   LYS  33          2HD       LYS  33   1.593  16.853  -0.555
  261   1HE   LYS  33          1HE       LYS  33   3.224  15.296   0.012
  262   2HE   LYS  33          2HE       LYS  33   4.460  16.092  -0.960
  263   1HZ   LYS  33          1HZ       LYS  33   5.121  17.065   0.905
  264   2HZ   LYS  33          2HZ       LYS  33   3.766  16.513   1.764
  265   3HZ   LYS  33          3HZ       LYS  33   3.682  17.966   0.892
  266    H    ILE  34           H        ILE  34  -0.205  12.829  -4.589
  267    HA   ILE  34           HA       ILE  34   1.471  10.899  -3.123
  268    HB   ILE  34           HB       ILE  34  -1.359  10.247  -3.843
  269   1HG1  ILE  34          1HG1      ILE  34  -0.653  11.700  -1.291
  270   2HG1  ILE  34          2HG1      ILE  34  -1.344  12.505  -2.695
  271   1HG2  ILE  34          1HG2      ILE  34  -1.152   8.960  -1.690
  272   2HG2  ILE  34          2HG2      ILE  34   0.545   9.436  -1.658
  273   3HG2  ILE  34          3HG2      ILE  34  -0.070   8.453  -2.984
  274   1HD1  ILE  34          1HD1      ILE  34  -3.399  11.631  -2.354
  275   2HD1  ILE  34          2HD1      ILE  34  -2.820  11.586  -0.687
  276   3HD1  ILE  34          3HD1      ILE  34  -2.773  10.129  -1.679
  277    H    LYS  35           H        LYS  35   2.424   9.438  -4.314
  278    HA   LYS  35           HA       LYS  35   1.610   9.126  -7.126
  279   1HB   LYS  35          1HB       LYS  35   4.320   8.840  -5.812
  280   2HB   LYS  35          2HB       LYS  35   3.991   8.542  -7.518
  281   1HG   LYS  35          1HG       LYS  35   3.294  11.184  -6.322
  282   2HG   LYS  35          2HG       LYS  35   4.971  10.828  -6.735
  283   1HD   LYS  35          1HD       LYS  35   4.380  11.654  -8.746
  284   2HD   LYS  35          2HD       LYS  35   3.728  10.033  -9.003
  285   1HE   LYS  35          1HE       LYS  35   1.833  11.151  -9.492
  286   2HE   LYS  35          2HE       LYS  35   1.648  11.216  -7.740
  287   1HZ   LYS  35          1HZ       LYS  35   2.216  13.339  -9.618
  288   2HZ   LYS  35          2HZ       LYS  35   3.197  13.364  -8.233
  289   3HZ   LYS  35          3HZ       LYS  35   1.507  13.412  -8.076
  290    H    ARG  36           H        ARG  36   2.174   6.950  -8.065
  291    HA   ARG  36           HA       ARG  36   1.739   4.848  -6.043
  292   1HB   ARG  36          1HB       ARG  36  -0.012   5.685  -8.113
  293   2HB   ARG  36          2HB       ARG  36   0.595   4.096  -8.554
  294   1HG   ARG  36          1HG       ARG  36  -1.499   3.974  -7.303
  295   2HG   ARG  36          2HG       ARG  36  -0.173   3.182  -6.453
  296   1HD   ARG  36          1HD       ARG  36  -1.453   4.448  -4.867
  297   2HD   ARG  36          2HD       ARG  36   0.106   5.236  -5.085
  298    HE   ARG  36           HE       ARG  36  -1.250   6.696  -6.736
  299   1HH1  ARG  36          1HH1      ARG  36  -2.455   5.331  -3.748
  300   2HH1  ARG  36          2HH1      ARG  36  -3.503   6.677  -3.402
  301   1HH2  ARG  36          1HH2      ARG  36  -2.652   8.459  -6.297
  302   2HH2  ARG  36          2HH2      ARG  36  -3.636   8.435  -4.861
  303    H    VAL  37           H        VAL  37   2.864   3.016  -6.220
  304    HA   VAL  37           HA       VAL  37   4.354   2.462  -8.687
  305    HB   VAL  37           HB       VAL  37   5.597   2.510  -5.927
  306   1HG1  VAL  37          1HG1      VAL  37   7.053   1.782  -8.441
  307   2HG1  VAL  37          2HG1      VAL  37   6.209   0.559  -7.490
  308   3HG1  VAL  37          3HG1      VAL  37   7.514   1.499  -6.763
  309   1HG2  VAL  37          1HG2      VAL  37   6.733   4.378  -6.516
  310   2HG2  VAL  37          2HG2      VAL  37   5.340   4.609  -7.574
  311   3HG2  VAL  37          3HG2      VAL  37   6.828   3.917  -8.217
  312    H    ASN  38           H        ASN  38   4.160   0.380  -9.264
  313    HA   ASN  38           HA       ASN  38   3.086  -1.515  -7.283
  314   1HB   ASN  38          1HB       ASN  38   1.698  -1.250  -9.293
  315   2HB   ASN  38          2HB       ASN  38   3.083  -1.646 -10.306
  316   1HD2  ASN  38          1HD2      ASN  38   0.981  -2.931  -7.780
  317   2HD2  ASN  38          2HD2      ASN  38   1.126  -4.584  -8.256
  318    H    VAL  39           H        VAL  39   4.581  -2.714  -6.380
  319    HA   VAL  39           HA       VAL  39   7.105  -3.104  -7.794
  320    HB   VAL  39           HB       VAL  39   6.787  -3.807  -4.923
  321   1HG1  VAL  39          1HG1      VAL  39   9.076  -2.687  -4.918
  322   2HG1  VAL  39          2HG1      VAL  39   8.942  -2.670  -6.675
  323   3HG1  VAL  39          3HG1      VAL  39   8.927  -4.204  -5.806
  324   1HG2  VAL  39          1HG2      VAL  39   7.547  -1.117  -4.947
  325   2HG2  VAL  39          2HG2      VAL  39   6.039  -1.794  -4.332
  326   3HG2  VAL  39          3HG2      VAL  39   6.132  -1.214  -5.995
  327    H    ASN  40           H        ASN  40   8.236  -5.045  -7.672
  328    HA   ASN  40           HA       ASN  40   6.583  -7.464  -7.438
  329   1HB   ASN  40          1HB       ASN  40   8.322  -6.616  -9.469
  330   2HB   ASN  40          2HB       ASN  40   9.228  -7.842  -8.592
  331   1HD2  ASN  40          1HD2      ASN  40   8.953  -8.743 -10.851
  332   2HD2  ASN  40          2HD2      ASN  40   7.598  -9.807 -11.082
  333    H    PHE  41           H        PHE  41   6.812  -8.315  -5.461
  334    HA   PHE  41           HA       PHE  41   9.343  -7.908  -4.031
  335   1HB   PHE  41          1HB       PHE  41   6.500  -8.285  -3.232
  336   2HB   PHE  41          2HB       PHE  41   7.733  -8.883  -2.131
  337    HD1  PHE  41           HD1      PHE  41   8.366  -7.472  -0.457
  338    HD2  PHE  41           HD2      PHE  41   7.063  -5.817  -4.155
  339    HE1  PHE  41           HE1      PHE  41   8.621  -5.206   0.470
  340    HE2  PHE  41           HE2      PHE  41   7.315  -3.551  -3.229
  341    HZ   PHE  41           HZ       PHE  41   8.097  -3.242  -0.923
  342    H    ASP  42           H        ASP  42  10.258  -9.617  -2.789
  343    HA   ASP  42           HA       ASP  42   9.946 -12.244  -4.015
  344   1HB   ASP  42          1HB       ASP  42  12.196 -11.043  -3.239
  345   2HB   ASP  42          2HB       ASP  42  11.771 -11.767  -1.696
  346    H    GLU  43           H        GLU  43   9.530 -14.123  -2.719
  347    HA   GLU  43           HA       GLU  43   7.432 -13.830  -0.852
  348   1HB   GLU  43          1HB       GLU  43   8.319 -15.897  -2.315
  349   2HB   GLU  43          2HB       GLU  43   9.082 -16.299  -0.783
  350   1HG   GLU  43          1HG       GLU  43   6.286 -15.563  -0.489
  351   2HG   GLU  43          2HG       GLU  43   6.528 -16.954  -1.545
  352    H    GLU  44           H        GLU  44  10.879 -14.386  -0.530
  353    HA   GLU  44           HA       GLU  44  11.084 -14.702   2.245
  354   1HB   GLU  44          1HB       GLU  44  12.828 -14.660   0.160
  355   2HB   GLU  44          2HB       GLU  44  13.179 -13.109   0.916
  356   1HG   GLU  44          1HG       GLU  44  13.056 -14.913   3.025
  357   2HG   GLU  44          2HG       GLU  44  13.905 -15.772   1.741
  358    H    LYS  45           H        LYS  45  11.172 -11.820   0.216
  359    HA   LYS  45           HA       LYS  45  11.639  -9.977   2.282
  360   1HB   LYS  45          1HB       LYS  45  10.350  -9.551  -0.422
  361   2HB   LYS  45          2HB       LYS  45  10.928  -8.271   0.643
  362   1HG   LYS  45          1HG       LYS  45  13.083 -10.032   0.335
  363   2HG   LYS  45          2HG       LYS  45  12.373  -9.848  -1.271
  364   1HD   LYS  45          1HD       LYS  45  13.133  -7.758  -1.466
  365   2HD   LYS  45          2HD       LYS  45  12.568  -7.322   0.148
  366   1HE   LYS  45          1HE       LYS  45  14.954  -7.064   0.065
  367   2HE   LYS  45          2HE       LYS  45  14.565  -8.442   1.095
  368   1HZ   LYS  45          1HZ       LYS  45  16.369  -8.485  -0.893
  369   2HZ   LYS  45          2HZ       LYS  45  14.998  -9.095  -1.691
  370   3HZ   LYS  45          3HZ       LYS  45  15.572  -9.860  -0.288
  371    H    HIS  46           H        HIS  46   8.670 -11.273   0.891
  372    HA   HIS  46           HA       HIS  46   7.020  -9.368   2.234
  373   1HB   HIS  46          1HB       HIS  46   6.522 -10.855   0.100
  374   2HB   HIS  46          2HB       HIS  46   5.841 -11.937   1.316
  375    HD1  HIS  46           HD1      HIS  46   3.561 -11.381   2.177
  376    HD2  HIS  46           HD2      HIS  46   5.316  -8.200   0.150
  377    HE1  HIS  46           HE1      HIS  46   1.809  -9.573   2.096
  378    HE2  HIS  46           HE2      HIS  46   2.954  -7.601   1.013
  379    H    THR  47           H        THR  47   8.068 -12.650   2.974
  380    HA   THR  47           HA       THR  47   6.325 -13.032   5.184
  381    HB   THR  47           HB       THR  47   9.048 -14.276   4.751
  382    HG1  THR  47           HG1      THR  47   7.939 -15.860   3.603
  383   1HG2  THR  47          1HG2      THR  47   7.802 -16.201   5.975
  384   2HG2  THR  47          2HG2      THR  47   6.718 -14.924   6.528
  385   3HG2  THR  47          3HG2      THR  47   8.434 -14.855   6.925
  386    H    ARG  48           H        ARG  48   9.588 -11.694   4.867
  387    HA   ARG  48           HA       ARG  48   9.865 -11.196   7.690
  388   1HB   ARG  48          1HB       ARG  48  11.544 -11.032   5.385
  389   2HB   ARG  48          2HB       ARG  48  11.586  -9.485   6.225
  390   1HG   ARG  48          1HG       ARG  48  11.854 -11.172   8.305
  391   2HG   ARG  48          2HG       ARG  48  12.637 -12.107   7.028
  392   1HD   ARG  48          1HD       ARG  48  13.449  -9.369   6.856
  393   2HD   ARG  48          2HD       ARG  48  13.699  -9.953   8.501
  394    HE   ARG  48           HE       ARG  48  14.888 -11.115   6.070
  395   1HH1  ARG  48          1HH1      ARG  48  14.786 -10.769   9.550
  396   2HH1  ARG  48          2HH1      ARG  48  16.357 -11.472   9.795
  397   1HH2  ARG  48          1HH2      ARG  48  16.949 -12.042   6.370
  398   2HH2  ARG  48          2HH2      ARG  48  17.593 -12.191   7.981
  399    H    PHE  49           H        PHE  49   8.439  -9.599   5.008
  400    HA   PHE  49           HA       PHE  49   8.461  -6.941   5.959
  401   1HB   PHE  49          1HB       PHE  49   7.423  -8.315   3.728
  402   2HB   PHE  49          2HB       PHE  49   6.043  -7.549   4.503
  403    HD1  PHE  49           HD1      PHE  49   9.499  -6.261   4.445
  404    HD2  PHE  49           HD2      PHE  49   5.550  -5.904   2.911
  405    HE1  PHE  49           HE1      PHE  49  10.110  -4.133   3.388
  406    HE2  PHE  49           HE2      PHE  49   6.154  -3.772   1.843
  407    HZ   PHE  49           HZ       PHE  49   8.435  -2.881   2.081
  408    H    LYS  50           H        LYS  50   5.948  -9.453   6.080
  409    HA   LYS  50           HA       LYS  50   4.205  -8.050   7.801
  410   1HB   LYS  50          1HB       LYS  50   4.060 -10.381   6.379
  411   2HB   LYS  50          2HB       LYS  50   4.182 -10.985   8.028
  412   1HG   LYS  50          1HG       LYS  50   2.286  -8.812   7.825
  413   2HG   LYS  50          2HG       LYS  50   1.887 -10.139   6.731
  414   1HD   LYS  50          1HD       LYS  50   2.689 -10.992   9.418
  415   2HD   LYS  50          2HD       LYS  50   1.215 -10.023   9.378
  416   1HE   LYS  50          1HE       LYS  50   0.061 -11.775   8.659
  417   2HE   LYS  50          2HE       LYS  50   1.108 -11.900   7.245
  418   1HZ   LYS  50          1HZ       LYS  50   1.232 -13.364   9.785
  419   2HZ   LYS  50          2HZ       LYS  50   2.685 -13.057   8.960
  420   3HZ   LYS  50          3HZ       LYS  50   1.446 -13.927   8.200
  421    H    ALA  51           H        ALA  51   6.922 -10.196   8.362
  422    HA   ALA  51           HA       ALA  51   6.564 -10.573  11.135
  423   1HB   ALA  51          1HB       ALA  51   8.076 -11.962   9.791
  424   2HB   ALA  51          2HB       ALA  51   8.901 -11.250  11.178
  425   3HB   ALA  51          3HB       ALA  51   9.142 -10.574   9.566
  426    H    ALA  52           H        ALA  52   8.847  -8.415   9.437
  427    HA   ALA  52           HA       ALA  52   9.629  -7.068  11.778
  428   1HB   ALA  52          1HB       ALA  52  10.207  -6.916   8.951
  429   2HB   ALA  52          2HB       ALA  52  11.245  -6.588  10.339
  430   3HB   ALA  52          3HB       ALA  52  10.185  -5.325   9.711
  431    H    CYS  53           H        CYS  53   7.025  -6.400   9.491
  432    HA   CYS  53           HA       CYS  53   6.559  -3.744  10.374
  433   1HB   CYS  53          1HB       CYS  53   4.642  -3.752   9.051
  434   2HB   CYS  53          2HB       CYS  53   5.677  -4.921   8.244
  435    HG   CYS  53           HG       CYS  53   2.906  -5.541  10.141
  436    H    ALA  54           H        ALA  54   5.437  -6.894  11.447
  437    HA   ALA  54           HA       ALA  54   3.609  -5.873  13.406
  438   1HB   ALA  54          1HB       ALA  54   2.946  -7.993  13.294
  439   2HB   ALA  54          2HB       ALA  54   4.404  -8.449  14.176
  440   3HB   ALA  54          3HB       ALA  54   4.405  -8.448  12.413
  441    H    ARG  55           H        ARG  55   7.003  -6.588  13.275
  442    HA   ARG  55           HA       ARG  55   7.475  -6.633  16.088
  443   1HB   ARG  55          1HB       ARG  55   9.350  -6.125  13.766
  444   2HB   ARG  55          2HB       ARG  55   9.870  -6.307  15.437
  445   1HG   ARG  55          1HG       ARG  55   8.411  -8.557  15.116
  446   2HG   ARG  55          2HG       ARG  55   9.040  -8.327  13.484
  447   1HD   ARG  55          1HD       ARG  55  11.184  -7.827  15.206
  448   2HD   ARG  55          2HD       ARG  55  10.379  -9.257  15.851
  449    HE   ARG  55           HE       ARG  55  11.868  -9.049  13.385
  450   1HH1  ARG  55          1HH1      ARG  55   9.375 -10.849  15.089
  451   2HH1  ARG  55          2HH1      ARG  55   9.688 -12.331  14.233
  452   1HH2  ARG  55          1HH2      ARG  55  12.241 -10.969  12.232
  453   2HH2  ARG  55          2HH2      ARG  55  11.297 -12.392  12.585
  454    H    LYS  56           H        LYS  56   7.850  -4.158  13.568
  455    HA   LYS  56           HA       LYS  56   8.668  -2.145  15.438
  456   1HB   LYS  56          1HB       LYS  56   8.490  -2.430  12.584
  457   2HB   LYS  56          2HB       LYS  56   7.754  -0.911  13.074
  458   1HG   LYS  56          1HG       LYS  56   9.732  -0.070  13.924
  459   2HG   LYS  56          2HG       LYS  56  10.440  -1.673  14.136
  460   1HD   LYS  56          1HD       LYS  56   9.892  -1.366  11.380
  461   2HD   LYS  56          2HD       LYS  56  10.666   0.123  11.921
  462   1HE   LYS  56          1HE       LYS  56  11.720  -2.671  11.904
  463   2HE   LYS  56          2HE       LYS  56  12.477  -1.183  11.340
  464   1HZ   LYS  56          1HZ       LYS  56  13.624  -1.563  13.262
  465   2HZ   LYS  56          2HZ       LYS  56  12.306  -2.264  14.061
  466   3HZ   LYS  56          3HZ       LYS  56  12.380  -0.583  13.868
  467    H    GLY  57           H        GLY  57   5.657  -3.282  14.200
  468   1HA   GLY  57          1HA       GLY  57   3.516  -2.791  14.918
  469   2HA   GLY  57          2HA       GLY  57   4.197  -1.604  16.022
  470    H    THR  58           H        THR  58   4.092  -2.023  12.492
  471    HA   THR  58           HA       THR  58   2.708   0.520  12.251
  472    HB   THR  58           HB       THR  58   5.269   0.887  12.241
  473    HG1  THR  58           HG1      THR  58   4.794   2.246  10.112
  474   1HG2  THR  58          1HG2      THR  58   5.060   0.136   9.345
  475   2HG2  THR  58          2HG2      THR  58   5.559  -1.050  10.552
  476   3HG2  THR  58          3HG2      THR  58   6.500   0.422  10.324
  477    H    SER  59           H        SER  59   1.908   0.898  10.070
  478    HA   SER  59           HA       SER  59   0.724  -1.396   8.972
  479   1HB   SER  59          1HB       SER  59   0.960   1.103   7.354
  480   2HB   SER  59          2HB       SER  59  -0.441   0.065   7.617
  481    HG   SER  59           HG       SER  59   0.568   2.151   9.183
  482    H    ILE  60           H        ILE  60   1.129  -2.581   7.146
  483    HA   ILE  60           HA       ILE  60   3.802  -2.934   6.389
  484    HB   ILE  60           HB       ILE  60   2.034  -4.675   6.205
  485   1HG1  ILE  60          1HG1      ILE  60   3.022  -4.651   3.452
  486   2HG1  ILE  60          2HG1      ILE  60   4.273  -4.300   4.639
  487   1HG2  ILE  60          1HG2      ILE  60   0.930  -4.494   3.757
  488   2HG2  ILE  60          2HG2      ILE  60   0.980  -2.786   4.205
  489   3HG2  ILE  60          3HG2      ILE  60   0.139  -3.947   5.236
  490   1HD1  ILE  60          1HD1      ILE  60   2.462  -6.634   5.043
  491   2HD1  ILE  60          2HD1      ILE  60   4.112  -6.378   5.614
  492   3HD1  ILE  60          3HD1      ILE  60   3.814  -6.745   3.913
  493    H    THR  61           H        THR  61   1.299  -0.907   5.081
  494    HA   THR  61           HA       THR  61   2.537  -0.293   2.612
  495    HB   THR  61           HB       THR  61   0.914   1.859   3.651
  496    HG1  THR  61           HG1      THR  61  -0.939   0.029   3.544
  497   1HG2  THR  61          1HG2      THR  61  -0.270   0.061   1.667
  498   2HG2  THR  61          2HG2      THR  61   1.349   0.615   1.242
  499   3HG2  THR  61          3HG2      THR  61   0.074   1.789   1.564
  500    H    ASP  62           H        ASP  62   2.668   1.066   5.849
  501    HA   ASP  62           HA       ASP  62   4.231   3.364   5.199
  502   1HB   ASP  62          1HB       ASP  62   2.909   3.329   7.235
  503   2HB   ASP  62          2HB       ASP  62   3.784   1.919   7.821
  504    H    VAL  63           H        VAL  63   4.923   0.044   6.012
  505    HA   VAL  63           HA       VAL  63   7.661   0.247   6.618
  506    HB   VAL  63           HB       VAL  63   6.173  -2.020   5.274
  507   1HG1  VAL  63          1HG1      VAL  63   8.210  -3.203   6.571
  508   2HG1  VAL  63          2HG1      VAL  63   8.982  -1.688   6.098
  509   3HG1  VAL  63          3HG1      VAL  63   8.270  -2.740   4.870
  510   1HG2  VAL  63          1HG2      VAL  63   6.992  -2.363   8.039
  511   2HG2  VAL  63          2HG2      VAL  63   5.421  -2.632   7.283
  512   3HG2  VAL  63          3HG2      VAL  63   5.876  -1.016   7.822
  513    H    VAL  64           H        VAL  64   5.996  -0.247   3.510
  514    HA   VAL  64           HA       VAL  64   8.334  -0.345   1.925
  515    HB   VAL  64           HB       VAL  64   5.773   0.782   0.852
  516   1HG1  VAL  64          1HG1      VAL  64   8.078   0.273  -0.374
  517   2HG1  VAL  64          2HG1      VAL  64   6.520   0.062  -1.171
  518   3HG1  VAL  64          3HG1      VAL  64   7.358  -1.334  -0.494
  519   1HG2  VAL  64          1HG2      VAL  64   5.603  -1.977   0.506
  520   2HG2  VAL  64          2HG2      VAL  64   4.593  -0.970   1.542
  521   3HG2  VAL  64          3HG2      VAL  64   6.024  -1.757   2.203
  522    H    ASN  65           H        ASN  65   6.170   2.293   2.848
  523    HA   ASN  65           HA       ASN  65   7.395   4.370   1.419
  524   1HB   ASN  65          1HB       ASN  65   5.219   4.230   2.976
  525   2HB   ASN  65          2HB       ASN  65   6.331   4.939   4.139
  526   1HD2  ASN  65          1HD2      ASN  65   4.466   5.445   1.300
  527   2HD2  ASN  65          2HD2      ASN  65   4.777   7.140   1.143
  528    H    GLN  66           H        GLN  66   8.146   2.916   4.529
  529    HA   GLN  66           HA       GLN  66  10.058   4.802   5.377
  530   1HB   GLN  66          1HB       GLN  66   8.857   2.999   6.738
  531   2HB   GLN  66          2HB       GLN  66  10.091   1.897   6.143
  532   1HG   GLN  66          1HG       GLN  66  11.710   3.767   7.041
  533   2HG   GLN  66          2HG       GLN  66  10.319   4.161   8.052
  534   1HE2  GLN  66          1HE2      GLN  66   9.368   2.323   9.257
  535   2HE2  GLN  66          2HE2      GLN  66  10.462   1.150   9.912
  536    H    LEU  67           H        LEU  67  10.475   1.661   3.685
  537    HA   LEU  67           HA       LEU  67  13.302   1.879   3.653
  538   1HB   LEU  67          1HB       LEU  67  12.959   0.269   1.561
  539   2HB   LEU  67          2HB       LEU  67  12.867  -0.276   3.221
  540    HG   LEU  67           HG       LEU  67  10.263   0.501   2.574
  541   1HD1  LEU  67          1HD1      LEU  67   9.733  -0.288   0.502
  542   2HD1  LEU  67          2HD1      LEU  67  11.099  -1.402   0.453
  543   3HD1  LEU  67          3HD1      LEU  67  11.357   0.322   0.177
  544   1HD2  LEU  67          1HD2      LEU  67   9.943  -1.440   3.601
  545   2HD2  LEU  67          2HD2      LEU  67  11.686  -1.704   3.575
  546   3HD2  LEU  67          3HD2      LEU  67  10.680  -2.314   2.259
  547    H    VAL  68           H        VAL  68  10.800   2.986   1.441
  548    HA   VAL  68           HA       VAL  68  12.519   3.741  -0.687
  549    HB   VAL  68           HB       VAL  68   9.920   5.072   0.117
  550   1HG1  VAL  68          1HG1      VAL  68  11.348   4.996  -2.539
  551   2HG1  VAL  68          2HG1      VAL  68  11.280   6.378  -1.446
  552   3HG1  VAL  68          3HG1      VAL  68   9.806   5.782  -2.206
  553   1HG2  VAL  68          1HG2      VAL  68   8.857   3.613  -1.534
  554   2HG2  VAL  68          2HG2      VAL  68   9.577   2.691  -0.214
  555   3HG2  VAL  68          3HG2      VAL  68  10.389   2.776  -1.779
  556    H    ASP  69           H        ASP  69  11.231   5.468   2.107
  557    HA   ASP  69           HA       ASP  69  12.527   7.937   1.729
  558   1HB   ASP  69          1HB       ASP  69  10.663   7.434   3.353
  559   2HB   ASP  69          2HB       ASP  69  11.850   6.629   4.371
  560    H    ASN  70           H        ASN  70  13.465   5.040   3.512
  561    HA   ASN  70           HA       ASN  70  15.840   6.035   4.598
  562   1HB   ASN  70          1HB       ASN  70  14.505   3.899   5.175
  563   2HB   ASN  70          2HB       ASN  70  15.468   3.138   3.911
  564   1HD2  ASN  70          1HD2      ASN  70  16.988   1.969   4.820
  565   2HD2  ASN  70          2HD2      ASN  70  18.012   2.472   6.132
  566    H    TRP  71           H        TRP  71  15.507   3.784   1.819
  567    HA   TRP  71           HA       TRP  71  18.226   3.823   1.134
  568   1HB   TRP  71          1HB       TRP  71  16.510   2.160   0.316
  569   2HB   TRP  71          2HB       TRP  71  15.951   3.390  -0.812
  570    HD1  TRP  71           HD1      TRP  71  19.148   1.341  -0.041
  571    HE1  TRP  71           HE1      TRP  71  20.528   1.158  -2.203
  572    HE3  TRP  71           HE3      TRP  71  16.244   4.210  -3.133
  573    HZ2  TRP  71           HZ2      TRP  71  20.394   2.063  -4.855
  574    HZ3  TRP  71           HZ3      TRP  71  16.929   4.457  -5.487
  575    HH2  TRP  71           HH2      TRP  71  18.959   3.411  -6.328
  576    H    LEU  72           H        LEU  72  15.599   5.967   0.265
  577    HA   LEU  72           HA       LEU  72  16.880   7.335  -1.835
  578   1HB   LEU  72          1HB       LEU  72  14.499   7.660  -0.204
  579   2HB   LEU  72          2HB       LEU  72  15.246   9.201  -0.580
  580    HG   LEU  72           HG       LEU  72  14.860   8.990  -2.856
  581   1HD1  LEU  72          1HD1      LEU  72  14.667   7.032  -4.080
  582   2HD1  LEU  72          2HD1      LEU  72  14.113   6.098  -2.690
  583   3HD1  LEU  72          3HD1      LEU  72  15.806   6.576  -2.815
  584   1HD2  LEU  72          1HD2      LEU  72  12.530   7.411  -1.826
  585   2HD2  LEU  72          2HD2      LEU  72  12.558   8.667  -3.064
  586   3HD2  LEU  72          3HD2      LEU  72  12.778   9.095  -1.369
  587    H    LYS  73           H        LYS  73  16.543   8.218   1.604
  588    HA   LYS  73           HA       LYS  73  18.183  10.522   1.303
  589   1HB   LYS  73          1HB       LYS  73  17.247   9.053   3.768
  590   2HB   LYS  73          2HB       LYS  73  18.087  10.599   3.794
  591   1HG   LYS  73          1HG       LYS  73  16.295  11.728   2.816
  592   2HG   LYS  73          2HG       LYS  73  15.555  10.234   2.232
  593   1HD   LYS  73          1HD       LYS  73  14.496   9.862   4.172
  594   2HD   LYS  73          2HD       LYS  73  15.894  10.345   5.136
  595   1HE   LYS  73          1HE       LYS  73  14.743  12.183   5.648
  596   2HE   LYS  73          2HE       LYS  73  15.039  12.708   3.991
  597   1HZ   LYS  73          1HZ       LYS  73  12.606  12.378   5.101
  598   2HZ   LYS  73          2HZ       LYS  73  12.798  10.913   4.268
  599   3HZ   LYS  73          3HZ       LYS  73  12.916  12.384   3.433
  600    H    GLU  74           H        GLU  74  18.819   7.192   2.096
  601    HA   GLU  74           HA       GLU  74  21.397   7.703   3.233
  602   1HB   GLU  74          1HB       GLU  74  19.823   5.264   2.535
  603   2HB   GLU  74          2HB       GLU  74  21.552   5.103   2.819
  604   1HG   GLU  74          1HG       GLU  74  19.477   6.138   4.734
  605   2HG   GLU  74          2HG       GLU  74  20.410   4.648   4.861
  606    H    ASN  75           H        ASN  75  20.271   6.462   0.093
  607    HA   ASN  75           HA       ASN  75  23.035   6.311  -0.802
  608   1HB   ASN  75          1HB       ASN  75  22.364   4.575  -2.016
  609   2HB   ASN  75          2HB       ASN  75  20.778   4.751  -1.277
  610   1HD2  ASN  75          1HD2      ASN  75  19.136   5.738  -2.413
  611   2HD2  ASN  75          2HD2      ASN  75  19.216   5.939  -4.126
  612    H    GLU  76           H        GLU  76  20.350   8.421  -1.127
  613    HA   GLU  76           HA       GLU  76  21.762   9.854  -3.279
  614   1HB   GLU  76          1HB       GLU  76  19.149   9.012  -3.313
  615   2HB   GLU  76          2HB       GLU  76  18.984  10.660  -2.725
  616   1HG   GLU  76          1HG       GLU  76  20.735  10.324  -5.057
  617   2HG   GLU  76          2HG       GLU  76  19.032   9.961  -5.327
  618   1H    MET   1          1H        MET   1  36.550 -27.700 -28.807
  619   2H    MET   1          2H        MET   1  37.392 -26.250 -28.538
  620   3H    MET   1          3H        MET   1  37.665 -27.586 -27.530
  621    HA   MET   1           HA       MET   1  39.471 -27.298 -29.098
  622   1HB   MET   1          1HB       MET   1  37.664 -29.680 -29.164
  623   2HB   MET   1          2HB       MET   1  39.051 -29.648 -30.246
  624   1HG   MET   1          1HG       MET   1  40.412 -29.094 -28.141
  625   2HG   MET   1          2HG       MET   1  38.997 -29.663 -27.257
  626   1HE   MET   1          1HE       MET   1  41.719 -32.272 -26.866
  627   2HE   MET   1          2HE       MET   1  41.676 -30.506 -26.879
  628   3HE   MET   1          3HE       MET   1  42.468 -31.380 -28.191
  629    H    SER   2           H        SER   2  39.844 -28.316 -31.529
  630    HA   SER   2           HA       SER   2  38.516 -26.380 -33.217
  631   1HB   SER   2          1HB       SER   2  40.235 -28.180 -34.667
  632   2HB   SER   2          2HB       SER   2  40.458 -26.460 -34.332
  633    HG   SER   2           HG       SER   2  42.030 -28.151 -33.455
  634    H    LEU   3           H        LEU   3  38.603 -29.869 -32.790
  635    HA   LEU   3           HA       LEU   3  37.090 -30.492 -35.117
  636   1HB   LEU   3          1HB       LEU   3  38.038 -31.944 -32.716
  637   2HB   LEU   3          2HB       LEU   3  36.651 -32.625 -33.544
  638    HG   LEU   3           HG       LEU   3  38.949 -31.912 -35.262
  639   1HD1  LEU   3          1HD1      LEU   3  39.999 -32.862 -33.209
  640   2HD1  LEU   3          2HD1      LEU   3  40.263 -33.811 -34.671
  641   3HD1  LEU   3          3HD1      LEU   3  39.070 -34.336 -33.482
  642   1HD2  LEU   3          1HD2      LEU   3  38.011 -33.410 -36.633
  643   2HD2  LEU   3          2HD2      LEU   3  36.616 -33.309 -35.559
  644   3HD2  LEU   3          3HD2      LEU   3  37.802 -34.595 -35.345
  645    H    GLU   4           H        GLU   4  36.112 -30.973 -31.722
  646    HA   GLU   4           HA       GLU   4  34.090 -30.939 -30.693
  647   1HB   GLU   4          1HB       GLU   4  34.383 -28.464 -32.029
  648   2HB   GLU   4          2HB       GLU   4  32.713 -28.965 -32.258
  649   1HG   GLU   4          1HG       GLU   4  32.505 -27.841 -30.296
  650   2HG   GLU   4          2HG       GLU   4  32.864 -29.449 -29.674
  651    H    LYS   5           H        LYS   5  34.376 -32.853 -32.641
  652    HA   LYS   5           HA       LYS   5  31.647 -33.480 -33.255
  653   1HB   LYS   5          1HB       LYS   5  32.001 -33.775 -35.684
  654   2HB   LYS   5          2HB       LYS   5  32.175 -32.095 -35.206
  655   1HG   LYS   5          1HG       LYS   5  34.519 -32.169 -35.430
  656   2HG   LYS   5          2HG       LYS   5  34.527 -33.930 -35.538
  657   1HD   LYS   5          1HD       LYS   5  32.852 -33.162 -37.595
  658   2HD   LYS   5          2HD       LYS   5  34.123 -31.938 -37.617
  659   1HE   LYS   5          1HE       LYS   5  35.537 -33.366 -38.559
  660   2HE   LYS   5          2HE       LYS   5  35.300 -34.517 -37.247
  661   1HZ   LYS   5          1HZ       LYS   5  33.887 -34.341 -39.831
  662   2HZ   LYS   5          2HZ       LYS   5  33.162 -35.119 -38.509
  663   3HZ   LYS   5          3HZ       LYS   5  34.644 -35.681 -39.114
  664    H    ALA   6           H        ALA   6  31.808 -35.661 -34.731
  665    HA   ALA   6           HA       ALA   6  33.076 -37.570 -33.092
  666   1HB   ALA   6          1HB       ALA   6  31.777 -37.683 -35.786
  667   2HB   ALA   6          2HB       ALA   6  31.221 -38.353 -34.252
  668   3HB   ALA   6          3HB       ALA   6  32.573 -39.100 -35.102
  669    H    HIS   7           H        HIS   7  34.768 -39.032 -33.617
  670    HA   HIS   7           HA       HIS   7  36.844 -39.635 -34.338
  671   1HB   HIS   7          1HB       HIS   7  35.781 -38.978 -36.662
  672   2HB   HIS   7          2HB       HIS   7  36.869 -37.601 -36.531
  673    HD1  HIS   7           HD1      HIS   7  36.789 -41.235 -37.224
  674    HD2  HIS   7           HD2      HIS   7  39.628 -38.249 -36.667
  675    HE1  HIS   7           HE1      HIS   7  38.959 -42.199 -38.054
  676    HE2  HIS   7           HE2      HIS   7  40.599 -40.281 -37.937
  677    H    THR   8           H        THR   8  36.443 -37.760 -32.348
  678    HA   THR   8           HA       THR   8  38.264 -35.548 -32.705
  679    HB   THR   8           HB       THR   8  37.580 -36.074 -29.952
  680    HG1  THR   8           HG1      THR   8  35.354 -35.860 -31.735
  681   1HG2  THR   8          1HG2      THR   8  36.746 -33.915 -31.895
  682   2HG2  THR   8          2HG2      THR   8  38.140 -33.873 -30.817
  683   3HG2  THR   8          3HG2      THR   8  36.510 -33.859 -30.149
  684    H    SER   9           H        SER   9  40.160 -35.224 -31.378
  685    HA   SER   9           HA       SER   9  41.605 -37.711 -30.905
  686   1HB   SER   9          1HB       SER   9  43.146 -35.336 -30.344
  687   2HB   SER   9          2HB       SER   9  43.391 -36.540 -31.611
  688    HG   SER   9           HG       SER   9  41.930 -34.129 -31.681
  689    H    VAL  10           H        VAL  10  42.472 -38.275 -28.943
  690    HA   VAL  10           HA       VAL  10  42.526 -38.561 -26.695
  691    HB   VAL  10           HB       VAL  10  42.281 -35.578 -26.400
  692   1HG1  VAL  10          1HG1      VAL  10  42.352 -36.710 -24.306
  693   2HG1  VAL  10          2HG1      VAL  10  43.954 -36.019 -24.568
  694   3HG1  VAL  10          3HG1      VAL  10  43.679 -37.741 -24.839
  695   1HG2  VAL  10          1HG2      VAL  10  44.526 -35.237 -26.964
  696   2HG2  VAL  10          2HG2      VAL  10  43.917 -36.298 -28.232
  697   3HG2  VAL  10          3HG2      VAL  10  44.890 -36.961 -26.921
  698    H    LYS  11           H        LYS  11  40.013 -38.743 -27.939
  699    HA   LYS  11           HA       LYS  11  38.255 -37.926 -25.721
  700   1HB   LYS  11          1HB       LYS  11  38.042 -36.967 -28.287
  701   2HB   LYS  11          2HB       LYS  11  36.935 -38.333 -28.313
  702   1HG   LYS  11          1HG       LYS  11  35.401 -37.187 -27.209
  703   2HG   LYS  11          2HG       LYS  11  36.543 -36.799 -25.923
  704   1HD   LYS  11          1HD       LYS  11  37.133 -34.787 -26.868
  705   2HD   LYS  11          2HD       LYS  11  36.715 -35.311 -28.500
  706   1HE   LYS  11          1HE       LYS  11  34.823 -34.162 -28.258
  707   2HE   LYS  11          2HE       LYS  11  34.316 -35.413 -27.123
  708   1HZ   LYS  11          1HZ       LYS  11  34.147 -33.720 -25.702
  709   2HZ   LYS  11          2HZ       LYS  11  35.133 -32.690 -26.622
  710   3HZ   LYS  11          3HZ       LYS  11  35.837 -33.825 -25.572
  711    H    LYS  12           H        LYS  12  37.806 -39.707 -24.629
  712    HA   LYS  12           HA       LYS  12  38.147 -42.302 -25.610
  713   1HB   LYS  12          1HB       LYS  12  37.074 -41.076 -23.149
  714   2HB   LYS  12          2HB       LYS  12  36.480 -42.693 -23.497
  715   1HG   LYS  12          1HG       LYS  12  39.254 -42.795 -23.900
  716   2HG   LYS  12          2HG       LYS  12  39.002 -41.872 -22.416
  717   1HD   LYS  12          1HD       LYS  12  37.970 -43.632 -21.337
  718   2HD   LYS  12          2HD       LYS  12  37.500 -44.414 -22.851
  719   1HE   LYS  12          1HE       LYS  12  39.812 -45.019 -23.278
  720   2HE   LYS  12          2HE       LYS  12  40.321 -44.185 -21.811
  721   1HZ   LYS  12          1HZ       LYS  12  40.137 -46.605 -21.536
  722   2HZ   LYS  12          2HZ       LYS  12  38.477 -46.513 -21.873
  723   3HZ   LYS  12          3HZ       LYS  12  39.103 -45.755 -20.490
  724    H    MET  13           H        MET  13  36.863 -43.741 -26.555
  725    HA   MET  13           HA       MET  13  34.348 -42.845 -27.652
  726   1HB   MET  13          1HB       MET  13  36.159 -44.295 -28.795
  727   2HB   MET  13          2HB       MET  13  35.463 -45.630 -27.888
  728   1HG   MET  13          1HG       MET  13  33.235 -44.937 -28.927
  729   2HG   MET  13          2HG       MET  13  34.202 -43.975 -30.044
  730   1HE   MET  13          1HE       MET  13  33.538 -47.301 -28.464
  731   2HE   MET  13          2HE       MET  13  35.215 -47.795 -28.702
  732   3HE   MET  13          3HE       MET  13  33.936 -48.511 -29.684
  733    H    THR  14           H        THR  14  33.866 -42.739 -25.109
  734    HA   THR  14           HA       THR  14  32.075 -44.993 -24.587
  735    HB   THR  14           HB       THR  14  33.029 -44.225 -22.074
  736    HG1  THR  14           HG1      THR  14  35.257 -44.978 -23.670
  737   1HG2  THR  14          1HG2      THR  14  33.811 -46.520 -21.916
  738   2HG2  THR  14          2HG2      THR  14  33.720 -46.688 -23.669
  739   3HG2  THR  14          3HG2      THR  14  32.247 -46.463 -22.727
  740    H    PHE  15           H        PHE  15  30.274 -44.443 -23.282
  741    HA   PHE  15           HA       PHE  15  29.407 -41.748 -23.470
  742   1HB   PHE  15          1HB       PHE  15  27.963 -43.854 -23.457
  743   2HB   PHE  15          2HB       PHE  15  28.207 -43.891 -21.713
  744    HD1  PHE  15           HD1      PHE  15  26.736 -42.792 -20.350
  745    HD2  PHE  15           HD2      PHE  15  27.074 -41.609 -24.419
  746    HE1  PHE  15           HE1      PHE  15  24.861 -41.244 -20.048
  747    HE2  PHE  15           HE2      PHE  15  25.197 -40.054 -24.129
  748    HZ   PHE  15           HZ       PHE  15  24.108 -39.831 -21.947
  749    H    GLY  16           H        GLY  16  30.574 -43.810 -20.857
  750   1HA   GLY  16          1HA       GLY  16  32.077 -42.803 -19.227
  751   2HA   GLY  16          2HA       GLY  16  31.066 -41.364 -19.279
  752    H    GLU  17           H        GLU  17  31.363 -44.632 -18.098
  753    HA   GLU  17           HA       GLU  17  28.849 -44.800 -16.813
  754   1HB   GLU  17          1HB       GLU  17  31.433 -46.274 -16.617
  755   2HB   GLU  17          2HB       GLU  17  30.239 -46.506 -15.348
  756   1HG   GLU  17          1HG       GLU  17  28.588 -47.091 -17.125
  757   2HG   GLU  17          2HG       GLU  17  29.913 -47.040 -18.287
  758    H    ASN  18           H        ASN  18  31.659 -43.038 -16.088
  759    HA   ASN  18           HA       ASN  18  31.212 -42.799 -13.250
  760   1HB   ASN  18          1HB       ASN  18  33.150 -41.592 -13.183
  761   2HB   ASN  18          2HB       ASN  18  33.410 -42.417 -14.712
  762   1HD2  ASN  18          1HD2      ASN  18  33.675 -39.541 -13.243
  763   2HD2  ASN  18          2HD2      ASN  18  33.500 -38.476 -14.608
  764    H    ARG  19           H        ARG  19  29.590 -41.692 -15.886
  765    HA   ARG  19           HA       ARG  19  28.691 -39.253 -14.507
  766   1HB   ARG  19          1HB       ARG  19  29.445 -39.686 -17.209
  767   2HB   ARG  19          2HB       ARG  19  27.711 -39.399 -17.192
  768   1HG   ARG  19          1HG       ARG  19  29.219 -37.379 -17.476
  769   2HG   ARG  19          2HG       ARG  19  27.953 -37.270 -16.251
  770   1HD   ARG  19          1HD       ARG  19  30.408 -38.373 -15.175
  771   2HD   ARG  19          2HD       ARG  19  30.666 -36.783 -15.896
  772    HE   ARG  19           HE       ARG  19  28.874 -37.408 -13.648
  773   1HH1  ARG  19          1HH1      ARG  19  30.521 -35.069 -15.672
  774   2HH1  ARG  19          2HH1      ARG  19  30.095 -33.711 -14.667
  775   1HH2  ARG  19          1HH2      ARG  19  28.336 -35.640 -12.308
  776   2HH2  ARG  19          2HH2      ARG  19  28.870 -34.040 -12.743
  777    H    ASP  20           H        ASP  20  26.719 -39.251 -13.699
  778    HA   ASP  20           HA       ASP  20  25.035 -41.578 -14.139
  779   1HB   ASP  20          1HB       ASP  20  25.406 -39.612 -12.026
  780   2HB   ASP  20          2HB       ASP  20  23.701 -39.884 -12.379
  781    H    LEU  21           H        LEU  21  25.321 -38.458 -15.334
  782    HA   LEU  21           HA       LEU  21  24.055 -37.092 -16.624
  783   1HB   LEU  21          1HB       LEU  21  23.395 -39.774 -17.417
  784   2HB   LEU  21          2HB       LEU  21  21.978 -38.754 -17.558
  785    HG   LEU  21           HG       LEU  21  23.250 -38.888 -19.662
  786   1HD1  LEU  21          1HD1      LEU  21  22.822 -36.743 -20.222
  787   2HD1  LEU  21          2HD1      LEU  21  23.703 -36.087 -18.839
  788   3HD1  LEU  21          3HD1      LEU  21  22.070 -36.723 -18.626
  789   1HD2  LEU  21          1HD2      LEU  21  25.480 -39.185 -18.945
  790   2HD2  LEU  21          2HD2      LEU  21  25.447 -37.711 -17.975
  791   3HD2  LEU  21          3HD2      LEU  21  25.431 -37.611 -19.737
  792    H    GLU  22           H        GLU  22  23.476 -37.171 -13.918
  793    HA   GLU  22           HA       GLU  22  20.626 -37.279 -13.515
  794   1HB   GLU  22          1HB       GLU  22  23.017 -36.970 -11.863
  795   2HB   GLU  22          2HB       GLU  22  21.706 -35.915 -11.354
  796   1HG   GLU  22          1HG       GLU  22  21.781 -38.901 -11.470
  797   2HG   GLU  22          2HG       GLU  22  21.416 -37.850 -10.101
  798    H    ARG  23           H        ARG  23  19.271 -35.519 -13.067
  799    HA   ARG  23           HA       ARG  23  20.344 -32.875 -13.762
  800   1HB   ARG  23          1HB       ARG  23  18.125 -34.357 -15.039
  801   2HB   ARG  23          2HB       ARG  23  17.809 -32.664 -14.688
  802   1HG   ARG  23          1HG       ARG  23  19.712 -31.985 -15.996
  803   2HG   ARG  23          2HG       ARG  23  20.178 -33.669 -16.251
  804   1HD   ARG  23          1HD       ARG  23  17.796 -32.198 -17.340
  805   2HD   ARG  23          2HD       ARG  23  19.085 -33.009 -18.229
  806    HE   ARG  23           HE       ARG  23  18.113 -35.114 -17.132
  807   1HH1  ARG  23          1HH1      ARG  23  16.230 -32.319 -18.070
  808   2HH1  ARG  23          2HH1      ARG  23  14.780 -33.225 -18.371
  809   1HH2  ARG  23          1HH2      ARG  23  16.215 -36.318 -17.512
  810   2HH2  ARG  23          2HH2      ARG  23  14.758 -35.505 -18.012
  811    H    VAL  24           H        VAL  24  19.396 -31.145 -12.720
  812    HA   VAL  24           HA       VAL  24  17.321 -31.704 -10.738
  813    HB   VAL  24           HB       VAL  24  18.910 -29.881  -9.405
  814   1HG1  VAL  24          1HG1      VAL  24  19.563 -32.290  -8.251
  815   2HG1  VAL  24          2HG1      VAL  24  18.054 -32.643  -9.094
  816   3HG1  VAL  24          3HG1      VAL  24  18.118 -31.335  -7.911
  817   1HG2  VAL  24          1HG2      VAL  24  20.903 -31.973  -9.736
  818   2HG2  VAL  24          2HG2      VAL  24  21.096 -30.220  -9.723
  819   3HG2  VAL  24          3HG2      VAL  24  20.643 -31.047 -11.213
  820    H    VAL  25           H        VAL  25  15.827 -30.538 -11.818
  821    HA   VAL  25           HA       VAL  25  16.377 -28.077 -13.110
  822    HB   VAL  25           HB       VAL  25  13.666 -29.057 -12.214
  823   1HG1  VAL  25          1HG1      VAL  25  13.392 -26.864 -12.944
  824   2HG1  VAL  25          2HG1      VAL  25  13.038 -27.818 -14.384
  825   3HG1  VAL  25          3HG1      VAL  25  14.608 -27.030 -14.211
  826   1HG2  VAL  25          1HG2      VAL  25  14.233 -30.853 -13.467
  827   2HG2  VAL  25          2HG2      VAL  25  15.461 -29.973 -14.376
  828   3HG2  VAL  25          3HG2      VAL  25  13.754 -29.779 -14.781
  829    H    THR  26           H        THR  26  16.841 -26.242 -12.151
  830    HA   THR  26           HA       THR  26  16.422 -25.732  -9.411
  831    HB   THR  26           HB       THR  26  16.798 -23.269 -10.769
  832    HG1  THR  26           HG1      THR  26  17.767 -23.830 -12.561
  833   1HG2  THR  26          1HG2      THR  26  19.040 -23.387  -9.814
  834   2HG2  THR  26          2HG2      THR  26  18.832 -25.111  -9.500
  835   3HG2  THR  26          3HG2      THR  26  17.841 -23.932  -8.639
  836    H    ALA  27           H        ALA  27  15.039 -24.214  -8.408
  837    HA   ALA  27           HA       ALA  27  12.431 -24.085  -9.667
  838   1HB   ALA  27          1HB       ALA  27  12.385 -24.781  -7.416
  839   2HB   ALA  27          2HB       ALA  27  11.762 -23.130  -7.415
  840   3HB   ALA  27          3HB       ALA  27  13.421 -23.449  -6.899
  841    HA   PRO  28           HA       PRO  28  13.289 -19.900 -10.988
  842   1HB   PRO  28          1HB       PRO  28  11.100 -19.594 -12.515
  843   2HB   PRO  28          2HB       PRO  28  12.450 -20.617 -13.022
  844   1HG   PRO  28          1HG       PRO  28   9.830 -21.399 -11.808
  845   2HG   PRO  28          2HG       PRO  28  10.716 -22.160 -13.141
  846   1HD   PRO  28          1HD       PRO  28  10.751 -23.083 -10.562
  847   2HD   PRO  28          2HD       PRO  28  12.064 -23.349 -11.727
  848    H    VAL  29           H        VAL  29  11.781 -17.856 -11.173
  849    HA   VAL  29           HA       VAL  29  10.047 -17.785  -8.786
  850    HB   VAL  29           HB       VAL  29  11.326 -15.266  -9.710
  851   1HG1  VAL  29          1HG1      VAL  29  10.706 -16.429  -6.999
  852   2HG1  VAL  29          2HG1      VAL  29   9.731 -15.254  -7.881
  853   3HG1  VAL  29          3HG1      VAL  29  11.334 -14.809  -7.300
  854   1HG2  VAL  29          1HG2      VAL  29  13.262 -16.671  -9.757
  855   2HG2  VAL  29          2HG2      VAL  29  12.819 -17.424  -8.225
  856   3HG2  VAL  29          3HG2      VAL  29  13.316 -15.733  -8.265
  857    H    SER  30           H        SER  30   8.346 -18.350 -10.304
  858    HA   SER  30           HA       SER  30   7.566 -16.170 -12.107
  859   1HB   SER  30          1HB       SER  30   5.997 -18.659 -12.184
  860   2HB   SER  30          2HB       SER  30   6.726 -17.742 -13.506
  861    HG   SER  30           HG       SER  30   8.782 -18.656 -12.788
  862    H    SER  31           H        SER  31   6.189 -18.377  -9.676
  863    HA   SER  31           HA       SER  31   4.418 -16.224  -8.813
  864   1HB   SER  31          1HB       SER  31   2.859 -18.606  -8.738
  865   2HB   SER  31          2HB       SER  31   2.552 -17.132  -9.654
  866    HG   SER  31           HG       SER  31   4.036 -19.419 -10.474
  867    H    GLY  32           H        GLY  32   3.519 -16.563  -6.686
  868   1HA   GLY  32          1HA       GLY  32   3.452 -17.505  -4.557
  869   2HA   GLY  32          2HA       GLY  32   4.472 -18.817  -5.128
  870    H    LYS  33           H        LYS  33   6.750 -17.982  -5.787
  871    HA   LYS  33           HA       LYS  33   7.924 -16.872  -3.415
  872   1HB   LYS  33          1HB       LYS  33   9.131 -17.695  -6.060
  873   2HB   LYS  33          2HB       LYS  33  10.069 -17.156  -4.674
  874   1HG   LYS  33          1HG       LYS  33   8.206 -19.293  -4.020
  875   2HG   LYS  33          2HG       LYS  33   9.384 -19.748  -5.251
  876   1HD   LYS  33          1HD       LYS  33  10.903 -20.034  -3.655
  877   2HD   LYS  33          2HD       LYS  33  10.779 -18.320  -3.254
  878   1HE   LYS  33          1HE       LYS  33   8.533 -19.466  -2.092
  879   2HE   LYS  33          2HE       LYS  33   9.817 -20.642  -1.807
  880   1HZ   LYS  33          1HZ       LYS  33   9.347 -18.418  -0.320
  881   2HZ   LYS  33          2HZ       LYS  33  10.640 -17.936  -1.309
  882   3HZ   LYS  33          3HZ       LYS  33  10.791 -19.312  -0.328
  883    H    ILE  34           H        ILE  34   6.353 -15.408  -5.800
  884    HA   ILE  34           HA       ILE  34   7.805 -12.914  -5.372
  885    HB   ILE  34           HB       ILE  34   8.370 -13.843  -7.661
  886   1HG1  ILE  34          1HG1      ILE  34   7.038 -11.395  -8.431
  887   2HG1  ILE  34          2HG1      ILE  34   7.772 -11.236  -6.838
  888   1HG2  ILE  34          1HG2      ILE  34   5.492 -13.963  -7.828
  889   2HG2  ILE  34          2HG2      ILE  34   6.715 -14.674  -8.882
  890   3HG2  ILE  34          3HG2      ILE  34   6.175 -13.017  -9.151
  891   1HD1  ILE  34          1HD1      ILE  34   9.920 -11.875  -7.728
  892   2HD1  ILE  34          2HD1      ILE  34   9.261 -10.527  -8.653
  893   3HD1  ILE  34          3HD1      ILE  34   9.207 -12.160  -9.316
  894    H    LYS  35           H        LYS  35   6.459 -11.134  -5.186
  895    HA   LYS  35           HA       LYS  35   3.570 -11.641  -5.341
  896   1HB   LYS  35          1HB       LYS  35   4.010  -9.943  -3.121
  897   2HB   LYS  35          2HB       LYS  35   3.340 -11.565  -3.124
  898   1HG   LYS  35          1HG       LYS  35   6.299 -11.249  -3.158
  899   2HG   LYS  35          2HG       LYS  35   5.426 -10.938  -1.659
  900   1HD   LYS  35          1HD       LYS  35   5.466 -13.493  -3.264
  901   2HD   LYS  35          2HD       LYS  35   6.132 -13.228  -1.652
  902   1HE   LYS  35          1HE       LYS  35   4.176 -13.680  -0.692
  903   2HE   LYS  35          2HE       LYS  35   3.331 -12.538  -1.738
  904   1HZ   LYS  35          1HZ       LYS  35   2.833 -15.109  -1.801
  905   2HZ   LYS  35          2HZ       LYS  35   4.129 -15.105  -2.891
  906   3HZ   LYS  35          3HZ       LYS  35   2.757 -14.157  -3.206
  907    H    ARG  36           H        ARG  36   2.257  -9.743  -5.453
  908    HA   ARG  36           HA       ARG  36   3.703  -7.481  -6.662
  909   1HB   ARG  36          1HB       ARG  36   0.899  -8.525  -7.007
  910   2HB   ARG  36          2HB       ARG  36   1.367  -6.920  -7.554
  911   1HG   ARG  36          1HG       ARG  36   2.811  -7.758  -9.175
  912   2HG   ARG  36          2HG       ARG  36   2.883  -9.349  -8.417
  913   1HD   ARG  36          1HD       ARG  36   1.493  -9.139 -10.542
  914   2HD   ARG  36          2HD       ARG  36   0.735  -9.924  -9.156
  915    HE   ARG  36           HE       ARG  36  -0.766  -8.189  -9.002
  916   1HH1  ARG  36          1HH1      ARG  36   1.759  -7.380 -11.301
  917   2HH1  ARG  36          2HH1      ARG  36   0.983  -5.916 -11.833
  918   1HH2  ARG  36          1HH2      ARG  36  -1.803  -6.282  -9.715
  919   2HH2  ARG  36          2HH2      ARG  36  -1.053  -5.298 -10.946
  920    H    VAL  37           H        VAL  37   3.843  -5.668  -5.516
  921    HA   VAL  37           HA       VAL  37   1.799  -5.180  -3.443
  922    HB   VAL  37           HB       VAL  37   4.743  -4.489  -3.328
  923   1HG1  VAL  37          1HG1      VAL  37   2.431  -3.461  -1.859
  924   2HG1  VAL  37          2HG1      VAL  37   4.047  -2.785  -2.050
  925   3HG1  VAL  37          3HG1      VAL  37   3.750  -4.025  -0.833
  926   1HG2  VAL  37          1HG2      VAL  37   5.059  -6.232  -1.916
  927   2HG2  VAL  37          2HG2      VAL  37   3.695  -6.891  -2.817
  928   3HG2  VAL  37          3HG2      VAL  37   3.431  -6.130  -1.249
  929    H    ASN  38           H        ASN  38   0.634  -3.410  -3.771
  930    HA   ASN  38           HA       ASN  38   1.734  -1.322  -5.534
  931   1HB   ASN  38          1HB       ASN  38  -0.367  -2.177  -6.369
  932   2HB   ASN  38          2HB       ASN  38  -1.130  -1.964  -4.796
  933   1HD2  ASN  38          1HD2      ASN  38  -2.437  -0.293  -4.729
  934   2HD2  ASN  38          2HD2      ASN  38  -2.234   1.201  -5.582
  935    H    VAL  39           H        VAL  39   2.534   0.377  -4.519
  936    HA   VAL  39           HA       VAL  39   1.374   1.106  -1.914
  937    HB   VAL  39           HB       VAL  39   4.076   2.064  -2.225
  938   1HG1  VAL  39          1HG1      VAL  39   3.257   0.032  -0.211
  939   2HG1  VAL  39          2HG1      VAL  39   2.497   1.627  -0.175
  940   3HG1  VAL  39          3HG1      VAL  39   4.250   1.478  -0.020
  941   1HG2  VAL  39          1HG2      VAL  39   5.109  -0.250  -1.901
  942   2HG2  VAL  39          2HG2      VAL  39   4.639   0.204  -3.540
  943   3HG2  VAL  39          3HG2      VAL  39   3.617  -0.883  -2.598
  944    H    ASN  40           H        ASN  40   1.614   3.346  -1.307
  945    HA   ASN  40           HA       ASN  40   1.734   5.157  -3.619
  946   1HB   ASN  40          1HB       ASN  40   0.289   6.697  -2.166
  947   2HB   ASN  40          2HB       ASN  40  -0.504   5.304  -2.894
  948   1HD2  ASN  40          1HD2      ASN  40  -1.513   3.896  -1.624
  949   2HD2  ASN  40          2HD2      ASN  40  -1.491   3.921   0.109
  950    H    PHE  41           H        PHE  41   3.100   6.835  -3.499
  951    HA   PHE  41           HA       PHE  41   4.522   7.264  -0.952
  952   1HB   PHE  41          1HB       PHE  41   5.781   7.327  -3.709
  953   2HB   PHE  41          2HB       PHE  41   6.609   7.553  -2.169
  954    HD1  PHE  41           HD1      PHE  41   6.063   5.499  -0.469
  955    HD2  PHE  41           HD2      PHE  41   6.116   5.311  -4.721
  956    HE1  PHE  41           HE1      PHE  41   6.511   3.086  -0.352
  957    HE2  PHE  41           HE2      PHE  41   6.560   2.892  -4.610
  958    HZ   PHE  41           HZ       PHE  41   6.737   1.771  -2.449
  959    H    ASP  42           H        ASP  42   5.562   9.423  -0.829
  960    HA   ASP  42           HA       ASP  42   3.703  11.405  -1.772
  961   1HB   ASP  42          1HB       ASP  42   4.327  12.466   0.086
  962   2HB   ASP  42          2HB       ASP  42   5.421  11.135   0.426
  963    H    GLU  43           H        GLU  43   4.326  13.333  -2.920
  964    HA   GLU  43           HA       GLU  43   5.532  12.769  -5.337
  965   1HB   GLU  43          1HB       GLU  43   3.948  14.601  -5.038
  966   2HB   GLU  43          2HB       GLU  43   5.114  15.475  -4.054
  967   1HG   GLU  43          1HG       GLU  43   5.627  16.522  -5.951
  968   2HG   GLU  43          2HG       GLU  43   6.534  15.059  -6.335
  969    H    GLU  44           H        GLU  44   6.943  14.260  -2.466
  970    HA   GLU  44           HA       GLU  44   9.446  14.958  -3.628
  971   1HB   GLU  44          1HB       GLU  44   8.469  15.705  -1.374
  972   2HB   GLU  44          2HB       GLU  44   9.012  14.148  -0.763
  973   1HG   GLU  44          1HG       GLU  44  11.211  15.242  -2.094
  974   2HG   GLU  44          2HG       GLU  44  10.497  16.567  -1.173
  975    H    LYS  45           H        LYS  45   8.279  12.159  -1.822
  976    HA   LYS  45           HA       LYS  45  10.596  10.603  -1.862
  977   1HB   LYS  45          1HB       LYS  45   8.001  10.307  -0.942
  978   2HB   LYS  45          2HB       LYS  45   8.121   9.075  -2.190
  979   1HG   LYS  45          1HG       LYS  45   8.826   7.900  -0.362
  980   2HG   LYS  45          2HG       LYS  45  10.372   8.492  -0.977
  981   1HD   LYS  45          1HD       LYS  45  10.744   9.427   1.005
  982   2HD   LYS  45          2HD       LYS  45   9.377  10.502   0.710
  983   1HE   LYS  45          1HE       LYS  45   7.901   8.655   1.608
  984   2HE   LYS  45          2HE       LYS  45   9.381   7.852   2.133
  985   1HZ   LYS  45          1HZ       LYS  45   9.908   9.967   3.355
  986   2HZ   LYS  45          2HZ       LYS  45   8.603   9.073   3.967
  987   3HZ   LYS  45          3HZ       LYS  45   8.312  10.465   3.041
  988    H    HIS  46           H        HIS  46   8.205  11.226  -4.312
  989    HA   HIS  46           HA       HIS  46   8.999   9.061  -6.018
  990   1HB   HIS  46          1HB       HIS  46   6.742  10.336  -5.934
  991   2HB   HIS  46          2HB       HIS  46   7.547  11.498  -6.983
  992    HD1  HIS  46           HD1      HIS  46   6.589  11.099  -9.217
  993    HD2  HIS  46           HD2      HIS  46   7.630   7.542  -7.326
  994    HE1  HIS  46           HE1      HIS  46   6.063   9.270 -10.860
  995    HE2  HIS  46           HE2      HIS  46   6.487   7.127  -9.616
  996    H    THR  47           H        THR  47   9.561  12.585  -6.054
  997    HA   THR  47           HA       THR  47  11.202  12.542  -8.376
  998    HB   THR  47           HB       THR  47  11.582  14.650  -6.294
  999    HG1  THR  47           HG1      THR  47   9.208  14.226  -7.815
 1000   1HG2  THR  47          1HG2      THR  47  12.548  14.478  -8.740
 1001   2HG2  THR  47          2HG2      THR  47  12.026  16.027  -8.081
 1002   3HG2  THR  47          3HG2      THR  47  10.969  15.128  -9.170
 1003    H    ARG  48           H        ARG  48  11.848  12.376  -4.917
 1004    HA   ARG  48           HA       ARG  48  14.670  12.388  -4.988
 1005   1HB   ARG  48          1HB       ARG  48  12.617  12.000  -3.067
 1006   2HB   ARG  48          2HB       ARG  48  13.692  10.614  -2.963
 1007   1HG   ARG  48          1HG       ARG  48  15.549  12.481  -2.942
 1008   2HG   ARG  48          2HG       ARG  48  14.210  13.471  -2.347
 1009   1HD   ARG  48          1HD       ARG  48  13.783  11.808  -0.591
 1010   2HD   ARG  48          2HD       ARG  48  15.146  10.856  -1.171
 1011    HE   ARG  48           HE       ARG  48  15.234  13.192   0.485
 1012   1HH1  ARG  48          1HH1      ARG  48  17.047  11.433  -1.936
 1013   2HH1  ARG  48          2HH1      ARG  48  18.597  11.854  -1.275
 1014   1HH2  ARG  48          1HH2      ARG  48  17.250  13.728   1.380
 1015   2HH2  ARG  48          2HH2      ARG  48  18.714  13.157   0.623
 1016    H    PHE  49           H        PHE  49  12.268   9.819  -5.227
 1017    HA   PHE  49           HA       PHE  49  14.048   7.640  -5.330
 1018   1HB   PHE  49          1HB       PHE  49  11.582   7.496  -4.912
 1019   2HB   PHE  49          2HB       PHE  49  11.318   7.832  -6.619
 1020    HD1  PHE  49           HD1      PHE  49  13.792   5.628  -4.912
 1021    HD2  PHE  49           HD2      PHE  49  10.478   5.915  -7.566
 1022    HE1  PHE  49           HE1      PHE  49  13.988   3.228  -5.410
 1023    HE2  PHE  49           HE2      PHE  49  10.673   3.518  -8.072
 1024    HZ   PHE  49           HZ       PHE  49  12.430   2.172  -6.993
 1025    H    LYS  50           H        LYS  50  12.494   9.544  -7.887
 1026    HA   LYS  50           HA       LYS  50  13.520   8.166 -10.085
 1027   1HB   LYS  50          1HB       LYS  50  12.510  10.939  -9.632
 1028   2HB   LYS  50          2HB       LYS  50  13.302  10.568 -11.158
 1029   1HG   LYS  50          1HG       LYS  50  11.692   8.788 -11.572
 1030   2HG   LYS  50          2HG       LYS  50  10.914   9.126 -10.025
 1031   1HD   LYS  50          1HD       LYS  50   9.619  10.611 -11.052
 1032   2HD   LYS  50          2HD       LYS  50  11.056  11.578 -11.390
 1033   1HE   LYS  50          1HE       LYS  50  10.049   9.333 -13.136
 1034   2HE   LYS  50          2HE       LYS  50   9.711  11.041 -13.410
 1035   1HZ   LYS  50          1HZ       LYS  50  12.290   9.614 -13.613
 1036   2HZ   LYS  50          2HZ       LYS  50  12.242  11.296 -13.392
 1037   3HZ   LYS  50          3HZ       LYS  50  11.527  10.600 -14.761
 1038    H    ALA  51           H        ALA  51  14.868  10.828  -8.207
 1039    HA   ALA  51           HA       ALA  51  17.191  11.239  -9.777
 1040   1HB   ALA  51          1HB       ALA  51  17.200  12.987  -8.397
 1041   2HB   ALA  51          2HB       ALA  51  17.885  11.911  -7.179
 1042   3HB   ALA  51          3HB       ALA  51  16.142  12.174  -7.244
 1043    H    ALA  52           H        ALA  52  16.511   9.227  -6.945
 1044    HA   ALA  52           HA       ALA  52  19.114   8.201  -6.611
 1045   1HB   ALA  52          1HB       ALA  52  17.496   6.205  -5.689
 1046   2HB   ALA  52          2HB       ALA  52  16.437   7.613  -5.600
 1047   3HB   ALA  52          3HB       ALA  52  17.993   7.626  -4.767
 1048    H    CYS  53           H        CYS  53  16.374   7.105  -8.568
 1049    HA   CYS  53           HA       CYS  53  17.453   4.644  -9.401
 1050   1HB   CYS  53          1HB       CYS  53  15.618   6.461 -10.980
 1051   2HB   CYS  53          2HB       CYS  53  15.853   4.738 -11.241
 1052    HG   CYS  53           HG       CYS  53  14.549   6.007  -8.346
 1053    H    ALA  54           H        ALA  54  17.665   7.889 -10.797
 1054    HA   ALA  54           HA       ALA  54  19.112   7.167 -13.105
 1055   1HB   ALA  54          1HB       ALA  54  18.482   9.264 -13.512
 1056   2HB   ALA  54          2HB       ALA  54  19.868   9.767 -12.546
 1057   3HB   ALA  54          3HB       ALA  54  18.277   9.616 -11.797
 1058    H    ARG  55           H        ARG  55  20.091   7.930  -9.839
 1059    HA   ARG  55           HA       ARG  55  22.858   8.250 -10.422
 1060   1HB   ARG  55          1HB       ARG  55  21.171   8.607  -8.194
 1061   2HB   ARG  55          2HB       ARG  55  22.399   7.453  -7.695
 1062   1HG   ARG  55          1HG       ARG  55  24.042   9.173  -8.769
 1063   2HG   ARG  55          2HG       ARG  55  22.698  10.295  -8.542
 1064   1HD   ARG  55          1HD       ARG  55  23.232   8.645  -6.196
 1065   2HD   ARG  55          2HD       ARG  55  24.604   9.649  -6.665
 1066    HE   ARG  55           HE       ARG  55  21.949  10.863  -6.354
 1067   1HH1  ARG  55          1HH1      ARG  55  25.274  10.544  -5.283
 1068   2HH1  ARG  55          2HH1      ARG  55  25.209  11.956  -4.269
 1069   1HH2  ARG  55          1HH2      ARG  55  21.857  12.702  -5.035
 1070   2HH2  ARG  55          2HH2      ARG  55  23.274  13.203  -4.148
 1071    H    LYS  56           H        LYS  56  20.866   5.494 -10.082
 1072    HA   LYS  56           HA       LYS  56  23.233   3.799  -9.625
 1073   1HB   LYS  56          1HB       LYS  56  20.337   3.089  -9.119
 1074   2HB   LYS  56          2HB       LYS  56  21.742   2.112  -8.718
 1075   1HG   LYS  56          1HG       LYS  56  21.621   4.841  -7.579
 1076   2HG   LYS  56          2HG       LYS  56  20.504   3.635  -6.936
 1077   1HD   LYS  56          1HD       LYS  56  22.176   2.960  -5.622
 1078   2HD   LYS  56          2HD       LYS  56  22.930   2.301  -7.076
 1079   1HE   LYS  56          1HE       LYS  56  24.495   3.909  -7.140
 1080   2HE   LYS  56          2HE       LYS  56  23.355   5.172  -6.679
 1081   1HZ   LYS  56          1HZ       LYS  56  25.267   3.874  -5.085
 1082   2HZ   LYS  56          2HZ       LYS  56  23.732   3.517  -4.462
 1083   3HZ   LYS  56          3HZ       LYS  56  24.214   5.131  -4.655
 1084    H    GLY  57           H        GLY  57  20.735   4.598 -11.828
 1085   1HA   GLY  57          1HA       GLY  57  20.407   3.926 -14.008
 1086   2HA   GLY  57          2HA       GLY  57  21.820   2.889 -13.858
 1087    H    THR  58           H        THR  58  18.752   2.979 -12.079
 1088    HA   THR  58           HA       THR  58  18.420   0.121 -12.717
 1089    HB   THR  58           HB       THR  58  17.059   1.205 -10.342
 1090    HG1  THR  58           HG1      THR  58  19.886   0.833 -10.287
 1091   1HG2  THR  58          1HG2      THR  58  17.649  -0.875  -9.380
 1092   2HG2  THR  58          2HG2      THR  58  18.903  -1.162 -10.587
 1093   3HG2  THR  58          3HG2      THR  58  17.203  -1.219 -11.051
 1094    H    SER  59           H        SER  59  16.381  -0.682 -13.155
 1095    HA   SER  59           HA       SER  59  14.440   1.045 -14.303
 1096   1HB   SER  59          1HB       SER  59  13.279  -1.457 -13.662
 1097   2HB   SER  59          2HB       SER  59  13.906  -0.931 -15.226
 1098    HG   SER  59           HG       SER  59  14.885  -2.882 -14.362
 1099    H    ILE  60           H        ILE  60  12.744   2.027 -13.376
 1100    HA   ILE  60           HA       ILE  60  12.662   2.771 -10.833
 1101    HB   ILE  60           HB       ILE  60  11.210   3.875 -12.313
 1102   1HG1  ILE  60          1HG1      ILE  60   8.962   2.781 -10.814
 1103   2HG1  ILE  60          2HG1      ILE  60  10.365   3.075  -9.791
 1104   1HG2  ILE  60          1HG2      ILE  60   9.473   1.432 -12.540
 1105   2HG2  ILE  60          2HG2      ILE  60  10.727   1.846 -13.707
 1106   3HG2  ILE  60          3HG2      ILE  60   9.360   2.932 -13.458
 1107   1HD1  ILE  60          1HD1      ILE  60  10.436   5.395 -10.709
 1108   2HD1  ILE  60          2HD1      ILE  60   9.004   5.020  -9.747
 1109   3HD1  ILE  60          3HD1      ILE  60   8.903   5.058 -11.509
 1110    H    THR  61           H        THR  61  10.856  -0.124 -11.920
 1111    HA   THR  61           HA       THR  61   9.778  -0.692  -9.366
 1112    HB   THR  61           HB       THR  61  10.335  -2.831 -11.390
 1113    HG1  THR  61           HG1      THR  61   9.156  -1.821 -12.822
 1114   1HG2  THR  61          1HG2      THR  61   9.058  -2.975  -9.054
 1115   2HG2  THR  61          2HG2      THR  61   8.562  -3.920 -10.458
 1116   3HG2  THR  61          3HG2      THR  61   7.714  -2.427 -10.056
 1117    H    ASP  62           H        ASP  62  12.727  -1.738 -11.001
 1118    HA   ASP  62           HA       ASP  62  13.464  -3.726  -9.133
 1119   1HB   ASP  62          1HB       ASP  62  14.339  -3.277 -11.549
 1120   2HB   ASP  62          2HB       ASP  62  15.501  -2.224 -10.741
 1121    H    VAL  63           H        VAL  63  14.029  -0.247  -9.229
 1122    HA   VAL  63           HA       VAL  63  16.001  -0.307  -7.149
 1123    HB   VAL  63           HB       VAL  63  14.732   2.231  -7.105
 1124   1HG1  VAL  63          1HG1      VAL  63  17.070   1.792  -6.638
 1125   2HG1  VAL  63          2HG1      VAL  63  16.910   2.980  -7.933
 1126   3HG1  VAL  63          3HG1      VAL  63  17.333   1.311  -8.315
 1127   1HG2  VAL  63          1HG2      VAL  63  13.722   1.836  -9.224
 1128   2HG2  VAL  63          2HG2      VAL  63  15.216   1.166  -9.876
 1129   3HG2  VAL  63          3HG2      VAL  63  15.116   2.881  -9.488
 1130    H    VAL  64           H        VAL  64  12.530  -0.291  -7.224
 1131    HA   VAL  64           HA       VAL  64  12.162   0.490  -4.497
 1132    HB   VAL  64           HB       VAL  64  10.278  -1.379  -5.905
 1133   1HG1  VAL  64          1HG1      VAL  64   8.957  -0.925  -4.175
 1134   2HG1  VAL  64          2HG1      VAL  64   9.100   0.809  -4.470
 1135   3HG1  VAL  64          3HG1      VAL  64  10.282  -0.012  -3.454
 1136   1HG2  VAL  64          1HG2      VAL  64   9.205   1.028  -6.479
 1137   2HG2  VAL  64          2HG2      VAL  64  10.199   0.103  -7.605
 1138   3HG2  VAL  64          3HG2      VAL  64  10.921   1.398  -6.650
 1139    H    ASN  65           H        ASN  65  12.609  -2.548  -6.220
 1140    HA   ASN  65           HA       ASN  65  12.482  -4.289  -3.989
 1141   1HB   ASN  65          1HB       ASN  65  12.431  -5.193  -6.234
 1142   2HB   ASN  65          2HB       ASN  65  14.012  -4.504  -6.593
 1143   1HD2  ASN  65          1HD2      ASN  65  15.651  -5.861  -6.476
 1144   2HD2  ASN  65          2HD2      ASN  65  15.700  -7.321  -5.553
 1145    H    GLN  66           H        GLN  66  14.984  -2.207  -5.265
 1146    HA   GLN  66           HA       GLN  66  17.180  -3.246  -3.829
 1147   1HB   GLN  66          1HB       GLN  66  17.088  -1.557  -5.816
 1148   2HB   GLN  66          2HB       GLN  66  16.966  -0.344  -4.550
 1149   1HG   GLN  66          1HG       GLN  66  19.280  -0.927  -5.511
 1150   2HG   GLN  66          2HG       GLN  66  19.094  -0.757  -3.765
 1151   1HE2  GLN  66          1HE2      GLN  66  18.955  -3.219  -6.318
 1152   2HE2  GLN  66          2HE2      GLN  66  19.702  -4.472  -5.378
 1153    H    LEU  67           H        LEU  67  14.873  -0.623  -3.040
 1154    HA   LEU  67           HA       LEU  67  16.165   0.114  -0.633
 1155   1HB   LEU  67          1HB       LEU  67  13.331   0.460  -0.372
 1156   2HB   LEU  67          2HB       LEU  67  14.591   1.667  -0.479
 1157    HG   LEU  67           HG       LEU  67  13.943   0.535  -3.081
 1158   1HD1  LEU  67          1HD1      LEU  67  11.771   2.276  -2.126
 1159   2HD1  LEU  67          2HD1      LEU  67  11.757   0.626  -1.504
 1160   3HD1  LEU  67          3HD1      LEU  67  11.731   0.913  -3.244
 1161   1HD2  LEU  67          1HD2      LEU  67  14.064   2.763  -3.758
 1162   2HD2  LEU  67          2HD2      LEU  67  15.208   2.676  -2.420
 1163   3HD2  LEU  67          3HD2      LEU  67  13.609   3.373  -2.166
 1164    H    VAL  68           H        VAL  68  13.580  -2.206  -1.347
 1165    HA   VAL  68           HA       VAL  68  13.086  -2.971   1.332
 1166    HB   VAL  68           HB       VAL  68  12.827  -4.945  -0.914
 1167   1HG1  VAL  68          1HG1      VAL  68  11.172  -4.330   1.529
 1168   2HG1  VAL  68          2HG1      VAL  68  12.294  -5.678   1.336
 1169   3HG1  VAL  68          3HG1      VAL  68  10.831  -5.601   0.354
 1170   1HG2  VAL  68          1HG2      VAL  68  11.271  -2.425  -0.533
 1171   2HG2  VAL  68          2HG2      VAL  68  10.454  -3.871  -1.124
 1172   3HG2  VAL  68          3HG2      VAL  68  11.812  -3.195  -2.025
 1173    H    ASP  69           H        ASP  69  15.405  -4.067  -1.075
 1174    HA   ASP  69           HA       ASP  69  16.342  -6.356   0.229
 1175   1HB   ASP  69          1HB       ASP  69  16.909  -5.376  -2.135
 1176   2HB   ASP  69          2HB       ASP  69  18.234  -4.580  -1.277
 1177    H    ASN  70           H        ASN  70  17.527  -3.032   0.342
 1178    HA   ASN  70           HA       ASN  70  19.571  -3.466   2.245
 1179   1HB   ASN  70          1HB       ASN  70  18.066  -1.031   1.314
 1180   2HB   ASN  70          2HB       ASN  70  19.227  -0.922   2.633
 1181   1HD2  ASN  70          1HD2      ASN  70  18.836  -1.771  -0.756
 1182   2HD2  ASN  70          2HD2      ASN  70  20.484  -1.495  -1.196
 1183    H    TRP  71           H        TRP  71  16.257  -2.238   2.562
 1184    HA   TRP  71           HA       TRP  71  16.244  -1.794   5.307
 1185   1HB   TRP  71          1HB       TRP  71  14.499  -1.054   3.689
 1186   2HB   TRP  71          2HB       TRP  71  13.922  -2.714   3.598
 1187    HD1  TRP  71           HD1      TRP  71  13.913   0.340   5.860
 1188    HE1  TRP  71           HE1      TRP  71  12.207  -0.009   7.747
 1189    HE3  TRP  71           HE3      TRP  71  12.732  -4.557   4.974
 1190    HZ2  TRP  71           HZ2      TRP  71  10.571  -2.085   8.729
 1191    HZ3  TRP  71           HZ3      TRP  71  11.074  -5.646   6.426
 1192    HH2  TRP  71           HH2      TRP  71  10.013  -4.430   8.267
 1193    H    LEU  72           H        LEU  72  15.032  -4.639   3.561
 1194    HA   LEU  72           HA       LEU  72  14.166  -6.011   5.797
 1195   1HB   LEU  72          1HB       LEU  72  13.978  -6.388   3.145
 1196   2HB   LEU  72          2HB       LEU  72  15.132  -7.649   3.544
 1197    HG   LEU  72           HG       LEU  72  13.184  -7.985   5.458
 1198   1HD1  LEU  72          1HD1      LEU  72  11.644  -6.470   4.486
 1199   2HD1  LEU  72          2HD1      LEU  72  11.089  -8.093   4.082
 1200   3HD1  LEU  72          3HD1      LEU  72  11.921  -7.121   2.870
 1201   1HD2  LEU  72          1HD2      LEU  72  13.075  -9.379   2.810
 1202   2HD2  LEU  72          2HD2      LEU  72  12.815 -10.033   4.428
 1203   3HD2  LEU  72          3HD2      LEU  72  14.442  -9.602   3.900
 1204    H    LYS  73           H        LYS  73  17.229  -6.525   4.030
 1205    HA   LYS  73           HA       LYS  73  17.914  -8.610   5.874
 1206   1HB   LYS  73          1HB       LYS  73  19.691  -7.414   3.760
 1207   2HB   LYS  73          2HB       LYS  73  19.813  -9.011   4.486
 1208   1HG   LYS  73          1HG       LYS  73  18.064  -9.857   3.251
 1209   2HG   LYS  73          2HG       LYS  73  17.316  -8.272   3.038
 1210   1HD   LYS  73          1HD       LYS  73  18.268  -8.129   1.042
 1211   2HD   LYS  73          2HD       LYS  73  19.847  -8.123   1.827
 1212   1HE   LYS  73          1HE       LYS  73  20.236 -10.319   1.378
 1213   2HE   LYS  73          2HE       LYS  73  18.526 -10.747   1.461
 1214   1HZ   LYS  73          1HZ       LYS  73  18.494 -10.712  -0.741
 1215   2HZ   LYS  73          2HZ       LYS  73  20.089 -10.148  -0.815
 1216   3HZ   LYS  73          3HZ       LYS  73  18.802  -9.046  -0.707
 1217    H    GLU  74           H        GLU  74  18.635  -5.229   5.701
 1218    HA   GLU  74           HA       GLU  74  20.955  -5.521   7.435
 1219   1HB   GLU  74          1HB       GLU  74  20.134  -3.626   5.521
 1220   2HB   GLU  74          2HB       GLU  74  20.143  -2.789   7.068
 1221   1HG   GLU  74          1HG       GLU  74  22.501  -4.409   6.764
 1222   2HG   GLU  74          2HG       GLU  74  22.315  -3.295   5.410
 1223    H    ASN  75           H        ASN  75  17.672  -4.211   7.587
 1224    HA   ASN  75           HA       ASN  75  18.055  -3.179  10.234
 1225   1HB   ASN  75          1HB       ASN  75  16.347  -1.884   9.634
 1226   2HB   ASN  75          2HB       ASN  75  16.208  -2.777   8.132
 1227   1HD2  ASN  75          1HD2      ASN  75  14.652  -4.412   7.951
 1228   2HD2  ASN  75          2HD2      ASN  75  13.330  -4.518   9.059
 1229    H    GLU  76           H        GLU  76  16.740  -6.121   8.896
 1230    HA   GLU  76           HA       GLU  76  15.566  -6.868  11.453
 1231   1HB   GLU  76          1HB       GLU  76  15.144  -7.616   8.714
 1232   2HB   GLU  76          2HB       GLU  76  15.494  -9.054   9.665
 1233   1HG   GLU  76          1HG       GLU  76  13.517  -7.106  10.722
 1234   2HG   GLU  76          2HG       GLU  76  13.045  -8.147   9.380
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1 -46.663  52.395   1.355
    2   2H    MET   1          2H        MET   1 -46.770  51.531  -0.105
    3   3H    MET   1          3H        MET   1 -45.262  51.754   0.639
    4    HA   MET   1           HA       MET   1 -46.299  50.534   2.620
    5   1HB   MET   1          1HB       MET   1 -48.578  50.670   1.542
    6   2HB   MET   1          2HB       MET   1 -48.019  49.494   0.360
    7   1HG   MET   1          1HG       MET   1 -47.451  48.059   2.441
    8   2HG   MET   1          2HG       MET   1 -48.573  49.137   3.268
    9   1HE   MET   1          1HE       MET   1 -51.418  49.364   1.879
   10   2HE   MET   1          2HE       MET   1 -50.730  48.959   3.450
   11   3HE   MET   1          3HE       MET   1 -51.854  47.847   2.666
   12    H    SER   2           H        SER   2 -45.987  49.594  -0.800
   13    HA   SER   2           HA       SER   2 -43.731  47.879  -0.081
   14   1HB   SER   2          1HB       SER   2 -45.276  46.418  -1.967
   15   2HB   SER   2          2HB       SER   2 -44.889  45.974  -0.305
   16    HG   SER   2           HG       SER   2 -46.925  46.226   0.088
   17    H    LEU   3           H        LEU   3 -43.845  50.381  -1.438
   18    HA   LEU   3           HA       LEU   3 -42.818  49.552  -4.056
   19   1HB   LEU   3          1HB       LEU   3 -45.050  51.453  -3.514
   20   2HB   LEU   3          2HB       LEU   3 -43.957  51.811  -4.838
   21    HG   LEU   3           HG       LEU   3 -45.536  49.253  -4.553
   22   1HD1  LEU   3          1HD1      LEU   3 -46.472  51.756  -5.271
   23   2HD1  LEU   3          2HD1      LEU   3 -47.235  50.205  -5.619
   24   3HD1  LEU   3          3HD1      LEU   3 -46.167  50.950  -6.808
   25   1HD2  LEU   3          1HD2      LEU   3 -44.639  49.798  -7.196
   26   2HD2  LEU   3          2HD2      LEU   3 -44.253  48.428  -6.157
   27   3HD2  LEU   3          3HD2      LEU   3 -43.258  49.881  -6.103
   28    H    GLU   4           H        GLU   4 -41.564  50.405  -1.536
   29    HA   GLU   4           HA       GLU   4 -40.554  53.059  -1.965
   30   1HB   GLU   4          1HB       GLU   4 -38.874  52.403  -0.206
   31   2HB   GLU   4          2HB       GLU   4 -40.554  52.290   0.293
   32   1HG   GLU   4          1HG       GLU   4 -39.524  49.809  -0.826
   33   2HG   GLU   4          2HG       GLU   4 -38.646  50.353   0.604
   34    H    LYS   5           H        LYS   5 -38.578  53.662  -2.768
   35    HA   LYS   5           HA       LYS   5 -36.750  53.619  -4.107
   36   1HB   LYS   5          1HB       LYS   5 -36.737  50.711  -3.318
   37   2HB   LYS   5          2HB       LYS   5 -35.559  51.378  -4.440
   38   1HG   LYS   5          1HG       LYS   5 -34.505  52.609  -2.820
   39   2HG   LYS   5          2HG       LYS   5 -35.948  52.715  -1.809
   40   1HD   LYS   5          1HD       LYS   5 -35.695  50.231  -1.417
   41   2HD   LYS   5          2HD       LYS   5 -34.106  50.364  -2.172
   42   1HE   LYS   5          1HE       LYS   5 -34.621  52.356  -0.086
   43   2HE   LYS   5          2HE       LYS   5 -34.620  50.689   0.489
   44   1HZ   LYS   5          1HZ       LYS   5 -32.429  52.320  -0.206
   45   2HZ   LYS   5          2HZ       LYS   5 -32.438  50.949  -1.203
   46   3HZ   LYS   5          3HZ       LYS   5 -32.427  50.770   0.480
   47    H    ALA   6           H        ALA   6 -37.702  54.256  -5.951
   48    HA   ALA   6           HA       ALA   6 -39.388  52.619  -7.537
   49   1HB   ALA   6          1HB       ALA   6 -38.492  55.331  -7.524
   50   2HB   ALA   6          2HB       ALA   6 -39.902  54.628  -8.315
   51   3HB   ALA   6          3HB       ALA   6 -38.351  54.674  -9.154
   52    H    HIS   7           H        HIS   7 -35.994  52.885  -7.283
   53    HA   HIS   7           HA       HIS   7 -34.272  51.799  -8.285
   54   1HB   HIS   7          1HB       HIS   7 -36.054  49.899  -8.197
   55   2HB   HIS   7          2HB       HIS   7 -36.186  50.170  -9.931
   56    HD1  HIS   7           HD1      HIS   7 -34.837  48.541 -11.185
   57    HD2  HIS   7           HD2      HIS   7 -33.045  49.564  -7.571
   58    HE1  HIS   7           HE1      HIS   7 -32.689  47.229 -11.097
   59    HE2  HIS   7           HE2      HIS   7 -31.668  47.782  -8.856
   60    H    THR   8           H        THR   8 -35.354  54.192  -9.415
   61    HA   THR   8           HA       THR   8 -35.255  53.964 -12.279
   62    HB   THR   8           HB       THR   8 -34.875  56.652 -11.216
   63    HG1  THR   8           HG1      THR   8 -37.409  56.017 -10.535
   64   1HG2  THR   8          1HG2      THR   8 -37.179  55.420 -12.730
   65   2HG2  THR   8          2HG2      THR   8 -35.720  56.071 -13.476
   66   3HG2  THR   8          3HG2      THR   8 -36.803  57.138 -12.584
   67    H    SER   9           H        SER   9 -33.494  54.048 -13.521
   68    HA   SER   9           HA       SER   9 -30.900  54.392 -12.321
   69   1HB   SER   9          1HB       SER   9 -31.382  54.191 -15.282
   70   2HB   SER   9          2HB       SER   9 -30.020  53.586 -14.338
   71    HG   SER   9           HG       SER   9 -31.257  51.835 -14.821
   72    H    VAL  10           H        VAL  10 -31.582  56.661 -11.674
   73    HA   VAL  10           HA       VAL  10 -31.564  58.691 -13.711
   74    HB   VAL  10           HB       VAL  10 -31.096  59.174 -10.773
   75   1HG1  VAL  10          1HG1      VAL  10 -30.918  61.232 -11.694
   76   2HG1  VAL  10          2HG1      VAL  10 -32.677  61.169 -11.609
   77   3HG1  VAL  10          3HG1      VAL  10 -31.854  60.796 -13.122
   78   1HG2  VAL  10          1HG2      VAL  10 -33.498  59.297 -10.442
   79   2HG2  VAL  10          2HG2      VAL  10 -33.043  57.689 -11.009
   80   3HG2  VAL  10          3HG2      VAL  10 -33.772  58.844 -12.124
   81    H    LYS  11           H        LYS  11 -29.927  59.939 -14.373
   82    HA   LYS  11           HA       LYS  11 -27.834  60.745 -14.724
   83   1HB   LYS  11          1HB       LYS  11 -27.223  59.477 -12.049
   84   2HB   LYS  11          2HB       LYS  11 -26.024  60.341 -13.001
   85   1HG   LYS  11          1HG       LYS  11 -26.694  62.255 -12.128
   86   2HG   LYS  11          2HG       LYS  11 -28.320  61.993 -12.764
   87   1HD   LYS  11          1HD       LYS  11 -29.091  61.664 -10.708
   88   2HD   LYS  11          2HD       LYS  11 -27.964  60.326 -10.486
   89   1HE   LYS  11          1HE       LYS  11 -27.622  61.960  -8.741
   90   2HE   LYS  11          2HE       LYS  11 -26.225  61.946  -9.816
   91   1HZ   LYS  11          1HZ       LYS  11 -26.589  64.044 -10.445
   92   2HZ   LYS  11          2HZ       LYS  11 -27.557  64.159  -9.057
   93   3HZ   LYS  11          3HZ       LYS  11 -28.268  63.843 -10.564
   94    H    LYS  12           H        LYS  12 -27.060  57.694 -13.076
   95    HA   LYS  12           HA       LYS  12 -26.664  56.265 -15.516
   96   1HB   LYS  12          1HB       LYS  12 -24.421  57.695 -14.346
   97   2HB   LYS  12          2HB       LYS  12 -24.120  55.967 -14.410
   98   1HG   LYS  12          1HG       LYS  12 -24.546  55.958 -16.802
   99   2HG   LYS  12          2HG       LYS  12 -24.914  57.684 -16.755
  100   1HD   LYS  12          1HD       LYS  12 -22.738  58.266 -16.682
  101   2HD   LYS  12          2HD       LYS  12 -22.326  56.949 -15.579
  102   1HE   LYS  12          1HE       LYS  12 -22.909  56.507 -18.495
  103   2HE   LYS  12          2HE       LYS  12 -21.290  56.851 -17.891
  104   1HZ   LYS  12          1HZ       LYS  12 -22.991  54.493 -17.360
  105   2HZ   LYS  12          2HZ       LYS  12 -21.694  54.890 -16.342
  106   3HZ   LYS  12          3HZ       LYS  12 -21.410  54.540 -17.974
  107    H    MET  13           H        MET  13 -26.454  54.045 -15.152
  108    HA   MET  13           HA       MET  13 -26.600  53.231 -12.318
  109   1HB   MET  13          1HB       MET  13 -28.537  52.794 -14.109
  110   2HB   MET  13          2HB       MET  13 -27.521  51.410 -14.484
  111   1HG   MET  13          1HG       MET  13 -27.930  51.718 -11.634
  112   2HG   MET  13          2HG       MET  13 -29.447  51.554 -12.517
  113   1HE   MET  13          1HE       MET  13 -29.767  49.431 -10.960
  114   2HE   MET  13          2HE       MET  13 -29.565  47.900 -11.814
  115   3HE   MET  13          3HE       MET  13 -30.465  49.219 -12.564
  116    H    THR  14           H        THR  14 -24.978  52.006 -11.584
  117    HA   THR  14           HA       THR  14 -22.782  51.441 -13.320
  118    HB   THR  14           HB       THR  14 -21.865  50.301 -11.218
  119    HG1  THR  14           HG1      THR  14 -23.566  49.989  -9.901
  120   1HG2  THR  14          1HG2      THR  14 -21.354  52.478 -10.178
  121   2HG2  THR  14          2HG2      THR  14 -22.590  53.231 -11.184
  122   3HG2  THR  14          3HG2      THR  14 -21.163  52.514 -11.930
  123    H    PHE  15           H        PHE  15 -21.820  49.422 -13.729
  124    HA   PHE  15           HA       PHE  15 -23.612  47.110 -13.416
  125   1HB   PHE  15          1HB       PHE  15 -22.960  46.310 -15.626
  126   2HB   PHE  15          2HB       PHE  15 -23.669  47.914 -15.749
  127    HD1  PHE  15           HD1      PHE  15 -20.725  45.889 -16.293
  128    HD2  PHE  15           HD2      PHE  15 -22.211  49.873 -16.155
  129    HE1  PHE  15           HE1      PHE  15 -18.739  46.669 -17.517
  130    HE2  PHE  15           HE2      PHE  15 -20.233  50.661 -17.382
  131    HZ   PHE  15           HZ       PHE  15 -18.480  49.031 -18.065
  132    H    GLY  16           H        GLY  16 -20.499  48.461 -13.138
  133   1HA   GLY  16          1HA       GLY  16 -19.174  47.087 -11.442
  134   2HA   GLY  16          2HA       GLY  16 -19.312  45.812 -12.647
  135    H    GLU  17           H        GLU  17 -16.947  45.862 -12.512
  136    HA   GLU  17           HA       GLU  17 -14.889  46.355 -13.328
  137   1HB   GLU  17          1HB       GLU  17 -16.773  47.039 -15.519
  138   2HB   GLU  17          2HB       GLU  17 -15.113  47.589 -15.698
  139   1HG   GLU  17          1HG       GLU  17 -15.215  45.511 -16.774
  140   2HG   GLU  17          2HG       GLU  17 -14.411  45.210 -15.234
  141    H    ASN  18           H        ASN  18 -14.735  47.900 -11.494
  142    HA   ASN  18           HA       ASN  18 -15.080  50.691 -11.948
  143   1HB   ASN  18          1HB       ASN  18 -15.063  49.951  -9.669
  144   2HB   ASN  18          2HB       ASN  18 -13.501  49.160  -9.876
  145   1HD2  ASN  18          1HD2      ASN  18 -11.888  50.215  -8.984
  146   2HD2  ASN  18          2HD2      ASN  18 -11.752  51.941  -8.831
  147    H    ARG  19           H        ARG  19 -12.202  48.626 -11.786
  148    HA   ARG  19           HA       ARG  19 -10.884  50.472 -13.656
  149   1HB   ARG  19          1HB       ARG  19 -10.136  50.405 -11.083
  150   2HB   ARG  19          2HB       ARG  19  -9.201  49.038 -11.672
  151   1HG   ARG  19          1HG       ARG  19  -7.654  50.535 -12.210
  152   2HG   ARG  19          2HG       ARG  19  -8.710  50.962 -13.560
  153   1HD   ARG  19          1HD       ARG  19  -9.194  52.218 -10.903
  154   2HD   ARG  19          2HD       ARG  19  -7.835  52.786 -11.872
  155    HE   ARG  19           HE       ARG  19 -10.672  53.093 -12.458
  156   1HH1  ARG  19          1HH1      ARG  19  -7.348  53.520 -13.512
  157   2HH1  ARG  19          2HH1      ARG  19  -7.779  54.544 -14.854
  158   1HH2  ARG  19          1HH2      ARG  19 -11.232  54.411 -14.221
  159   2HH2  ARG  19          2HH2      ARG  19  -9.986  55.059 -15.249
  160    H    ASP  20           H        ASP  20 -10.423  49.443 -15.458
  161    HA   ASP  20           HA       ASP  20 -10.327  46.534 -15.490
  162   1HB   ASP  20          1HB       ASP  20 -11.640  47.708 -17.211
  163   2HB   ASP  20          2HB       ASP  20 -10.184  48.526 -17.768
  164    H    LEU  21           H        LEU  21  -8.327  46.692 -14.155
  165    HA   LEU  21           HA       LEU  21  -5.979  46.518 -15.861
  166   1HB   LEU  21          1HB       LEU  21  -6.413  48.642 -13.816
  167   2HB   LEU  21          2HB       LEU  21  -4.817  47.928 -13.919
  168    HG   LEU  21           HG       LEU  21  -5.638  48.596 -16.558
  169   1HD1  LEU  21          1HD1      LEU  21  -6.471  50.681 -16.503
  170   2HD1  LEU  21          2HD1      LEU  21  -5.555  51.125 -15.064
  171   3HD1  LEU  21          3HD1      LEU  21  -7.043  50.196 -14.909
  172   1HD2  LEU  21          1HD2      LEU  21  -3.606  49.739 -16.617
  173   2HD2  LEU  21          2HD2      LEU  21  -3.341  48.454 -15.440
  174   3HD2  LEU  21          3HD2      LEU  21  -3.654  50.101 -14.892
  175    H    GLU  22           H        GLU  22  -7.637  44.702 -14.254
  176    HA   GLU  22           HA       GLU  22  -5.946  44.042 -11.978
  177   1HB   GLU  22          1HB       GLU  22  -8.564  42.944 -12.993
  178   2HB   GLU  22          2HB       GLU  22  -7.677  42.199 -11.668
  179   1HG   GLU  22          1HG       GLU  22  -8.381  45.102 -11.585
  180   2HG   GLU  22          2HG       GLU  22  -9.564  43.874 -11.142
  181    H    ARG  23           H        ARG  23  -5.058  41.911 -11.680
  182    HA   ARG  23           HA       ARG  23  -4.724  40.303 -14.095
  183   1HB   ARG  23          1HB       ARG  23  -2.823  42.167 -13.495
  184   2HB   ARG  23          2HB       ARG  23  -2.206  40.764 -12.635
  185   1HG   ARG  23          1HG       ARG  23  -1.193  40.673 -14.734
  186   2HG   ARG  23          2HG       ARG  23  -2.503  39.493 -14.818
  187   1HD   ARG  23          1HD       ARG  23  -3.602  41.949 -15.617
  188   2HD   ARG  23          2HD       ARG  23  -2.044  41.826 -16.431
  189    HE   ARG  23           HE       ARG  23  -3.936  39.576 -16.565
  190   1HH1  ARG  23          1HH1      ARG  23  -2.153  42.151 -18.149
  191   2HH1  ARG  23          2HH1      ARG  23  -2.522  41.584 -19.752
  192   1HH2  ARG  23          1HH2      ARG  23  -4.404  38.820 -18.671
  193   2HH2  ARG  23          2HH2      ARG  23  -3.787  39.681 -20.050
  194    H    VAL  24           H        VAL  24  -5.860  38.669 -13.087
  195    HA   VAL  24           HA       VAL  24  -4.886  37.612 -10.551
  196    HB   VAL  24           HB       VAL  24  -7.053  36.417 -12.284
  197   1HG1  VAL  24          1HG1      VAL  24  -5.927  35.846  -9.655
  198   2HG1  VAL  24          2HG1      VAL  24  -6.907  34.831 -10.714
  199   3HG1  VAL  24          3HG1      VAL  24  -7.684  35.998  -9.642
  200   1HG2  VAL  24          1HG2      VAL  24  -7.082  38.910 -10.822
  201   2HG2  VAL  24          2HG2      VAL  24  -8.283  37.782 -10.193
  202   3HG2  VAL  24          3HG2      VAL  24  -8.296  38.222 -11.901
  203    H    VAL  25           H        VAL  25  -2.789  37.033 -11.280
  204    HA   VAL  25           HA       VAL  25  -2.534  35.052 -13.386
  205    HB   VAL  25           HB       VAL  25  -0.306  36.000 -11.597
  206   1HG1  VAL  25          1HG1      VAL  25   1.069  35.550 -13.574
  207   2HG1  VAL  25          2HG1      VAL  25  -0.371  35.039 -14.455
  208   3HG1  VAL  25          3HG1      VAL  25   0.180  34.116 -13.057
  209   1HG2  VAL  25          1HG2      VAL  25  -1.865  37.759 -12.998
  210   2HG2  VAL  25          2HG2      VAL  25  -0.573  37.404 -14.145
  211   3HG2  VAL  25          3HG2      VAL  25  -0.183  38.026 -12.543
  212    H    THR  26           H        THR  26  -3.679  33.322 -12.410
  213    HA   THR  26           HA       THR  26  -2.844  32.261  -9.885
  214    HB   THR  26           HB       THR  26  -4.313  30.288 -11.240
  215    HG1  THR  26           HG1      THR  26  -4.989  31.622 -12.864
  216   1HG2  THR  26          1HG2      THR  26  -6.125  30.979  -9.726
  217   2HG2  THR  26          2HG2      THR  26  -5.240  32.459  -9.356
  218   3HG2  THR  26          3HG2      THR  26  -4.573  30.893  -8.893
  219    H    ALA  27           H        ALA  27  -1.323  30.798  -9.492
  220    HA   ALA  27           HA       ALA  27   0.367  29.875 -11.620
  221   1HB   ALA  27          1HB       ALA  27   0.395  29.793  -8.659
  222   2HB   ALA  27          2HB       ALA  27   1.662  30.256  -9.792
  223   3HB   ALA  27          3HB       ALA  27   1.317  28.554  -9.504
  224    HA   PRO  28           HA       PRO  28  -1.541  25.937 -12.310
  225   1HB   PRO  28          1HB       PRO  28   1.030  24.817 -13.089
  226   2HB   PRO  28          2HB       PRO  28  -0.349  25.234 -14.107
  227   1HG   PRO  28          1HG       PRO  28   2.000  26.594 -14.171
  228   2HG   PRO  28          2HG       PRO  28   0.434  27.347 -14.527
  229   1HD   PRO  28          1HD       PRO  28   2.049  27.432 -12.001
  230   2HD   PRO  28          2HD       PRO  28   1.162  28.740 -12.816
  231    H    VAL  29           H        VAL  29  -1.508  25.955  -9.786
  232    HA   VAL  29           HA       VAL  29   0.456  24.220  -8.585
  233    HB   VAL  29           HB       VAL  29  -2.040  25.216  -7.228
  234   1HG1  VAL  29          1HG1      VAL  29   0.692  24.372  -6.288
  235   2HG1  VAL  29          2HG1      VAL  29  -0.866  23.643  -5.904
  236   3HG1  VAL  29          3HG1      VAL  29  -0.452  25.232  -5.259
  237   1HG2  VAL  29          1HG2      VAL  29   0.396  26.816  -6.875
  238   2HG2  VAL  29          2HG2      VAL  29  -1.285  27.325  -7.056
  239   3HG2  VAL  29          3HG2      VAL  29  -0.328  26.919  -8.483
  240    H    SER  30           H        SER  30  -0.067  22.356  -9.934
  241    HA   SER  30           HA       SER  30  -2.552  20.996  -9.690
  242   1HB   SER  30          1HB       SER  30  -0.237  19.286 -10.217
  243   2HB   SER  30          2HB       SER  30  -1.646  19.609 -11.227
  244    HG   SER  30           HG       SER  30   0.819  20.958 -11.100
  245    H    SER  31           H        SER  31  -3.283  20.302  -7.782
  246    HA   SER  31           HA       SER  31  -1.476  19.748  -5.622
  247   1HB   SER  31          1HB       SER  31  -4.407  19.152  -5.494
  248   2HB   SER  31          2HB       SER  31  -3.346  19.797  -4.244
  249    HG   SER  31           HG       SER  31  -3.291  21.550  -6.191
  250    H    GLY  32           H        GLY  32  -0.652  17.975  -7.297
  251   1HA   GLY  32          1HA       GLY  32  -1.865  15.417  -6.436
  252   2HA   GLY  32          2HA       GLY  32  -1.047  15.632  -7.979
  253    H    LYS  33           H        LYS  33  -0.394  16.210  -4.537
  254    HA   LYS  33           HA       LYS  33   2.420  15.716  -4.970
  255   1HB   LYS  33          1HB       LYS  33   2.594  16.309  -2.531
  256   2HB   LYS  33          2HB       LYS  33   1.913  17.561  -3.559
  257   1HG   LYS  33          1HG       LYS  33  -0.276  17.157  -2.762
  258   2HG   LYS  33          2HG       LYS  33   0.216  15.659  -1.967
  259   1HD   LYS  33          1HD       LYS  33   0.248  17.020  -0.146
  260   2HD   LYS  33          2HD       LYS  33   1.877  17.358  -0.735
  261   1HE   LYS  33          1HE       LYS  33   1.354  19.502  -0.979
  262   2HE   LYS  33          2HE       LYS  33   0.065  19.069  -2.100
  263   1HZ   LYS  33          1HZ       LYS  33  -0.114  19.412   0.838
  264   2HZ   LYS  33          2HZ       LYS  33  -1.327  18.641  -0.062
  265   3HZ   LYS  33          3HZ       LYS  33  -0.949  20.262  -0.369
  266    H    ILE  34           H        ILE  34   0.027  13.624  -4.703
  267    HA   ILE  34           HA       ILE  34   1.584  11.776  -3.015
  268    HB   ILE  34           HB       ILE  34  -1.355  12.210  -3.242
  269   1HG1  ILE  34          1HG1      ILE  34  -0.671  11.031  -0.805
  270   2HG1  ILE  34          2HG1      ILE  34   0.715  12.040  -1.211
  271   1HG2  ILE  34          1HG2      ILE  34  -1.001   9.634  -2.103
  272   2HG2  ILE  34          2HG2      ILE  34  -0.257   9.632  -3.704
  273   3HG2  ILE  34          3HG2      ILE  34  -1.949  10.092  -3.520
  274   1HD1  ILE  34          1HD1      ILE  34  -0.741  13.355   0.098
  275   2HD1  ILE  34          2HD1      ILE  34  -2.143  12.887  -0.864
  276   3HD1  ILE  34          3HD1      ILE  34  -0.904  13.928  -1.562
  277    H    LYS  35           H        LYS  35   2.323  10.010  -3.936
  278    HA   LYS  35           HA       LYS  35   1.514   9.446  -6.715
  279   1HB   LYS  35          1HB       LYS  35   4.250   8.764  -5.709
  280   2HB   LYS  35          2HB       LYS  35   3.736   9.239  -7.326
  281   1HG   LYS  35          1HG       LYS  35   3.388  11.345  -5.337
  282   2HG   LYS  35          2HG       LYS  35   5.062  10.818  -5.520
  283   1HD   LYS  35          1HD       LYS  35   4.773  12.579  -7.060
  284   2HD   LYS  35          2HD       LYS  35   4.733  11.099  -8.014
  285   1HE   LYS  35          1HE       LYS  35   2.570  11.374  -8.593
  286   2HE   LYS  35          2HE       LYS  35   2.125  12.040  -7.022
  287   1HZ   LYS  35          1HZ       LYS  35   2.158  14.049  -7.917
  288   2HZ   LYS  35          2HZ       LYS  35   2.616  13.411  -9.419
  289   3HZ   LYS  35          3HZ       LYS  35   3.802  13.879  -8.301
  290    H    ARG  36           H        ARG  36   1.401   7.258  -7.365
  291    HA   ARG  36           HA       ARG  36   1.314   5.359  -5.103
  292   1HB   ARG  36          1HB       ARG  36  -0.317   5.273  -7.645
  293   2HB   ARG  36          2HB       ARG  36  -0.460   4.179  -6.280
  294   1HG   ARG  36          1HG       ARG  36  -1.788   5.578  -5.165
  295   2HG   ARG  36          2HG       ARG  36  -0.758   6.967  -5.516
  296   1HD   ARG  36          1HD       ARG  36  -2.819   5.755  -7.353
  297   2HD   ARG  36          2HD       ARG  36  -2.964   7.279  -6.479
  298    HE   ARG  36           HE       ARG  36  -1.411   6.760  -8.886
  299   1HH1  ARG  36          1HH1      ARG  36  -2.148   8.966  -6.257
  300   2HH1  ARG  36          2HH1      ARG  36  -1.479  10.353  -7.068
  301   1HH2  ARG  36          1HH2      ARG  36  -0.558   8.600  -9.961
  302   2HH2  ARG  36          2HH2      ARG  36  -0.570  10.146  -9.163
  303    H    VAL  37           H        VAL  37   2.963   4.011  -5.158
  304    HA   VAL  37           HA       VAL  37   3.926   3.055  -7.780
  305    HB   VAL  37           HB       VAL  37   5.516   3.455  -5.235
  306   1HG1  VAL  37          1HG1      VAL  37   6.774   2.787  -7.851
  307   2HG1  VAL  37          2HG1      VAL  37   6.061   1.487  -6.894
  308   3HG1  VAL  37          3HG1      VAL  37   7.347   2.482  -6.211
  309   1HG2  VAL  37          1HG2      VAL  37   6.152   4.811  -7.806
  310   2HG2  VAL  37          2HG2      VAL  37   6.423   5.347  -6.149
  311   3HG2  VAL  37          3HG2      VAL  37   4.805   5.421  -6.845
  312    H    ASN  38           H        ASN  38   3.553   0.976  -8.137
  313    HA   ASN  38           HA       ASN  38   3.246  -0.818  -5.812
  314   1HB   ASN  38          1HB       ASN  38   1.172  -1.072  -6.699
  315   2HB   ASN  38          2HB       ASN  38   1.662  -0.458  -8.273
  316   1HD2  ASN  38          1HD2      ASN  38   1.105  -3.241  -6.339
  317   2HD2  ASN  38          2HD2      ASN  38   1.386  -4.421  -7.574
  318    H    VAL  39           H        VAL  39   4.657  -2.448  -5.636
  319    HA   VAL  39           HA       VAL  39   6.178  -3.268  -8.023
  320    HB   VAL  39           HB       VAL  39   7.635  -3.149  -5.424
  321   1HG1  VAL  39          1HG1      VAL  39   8.253  -3.303  -8.289
  322   2HG1  VAL  39          2HG1      VAL  39   9.124  -3.945  -6.900
  323   3HG1  VAL  39          3HG1      VAL  39   9.319  -2.256  -7.354
  324   1HG2  VAL  39          1HG2      VAL  39   6.506  -0.808  -6.680
  325   2HG2  VAL  39          2HG2      VAL  39   8.267  -0.739  -6.666
  326   3HG2  VAL  39          3HG2      VAL  39   7.381  -0.960  -5.157
  327    H    ASN  40           H        ASN  40   7.284  -5.358  -7.756
  328    HA   ASN  40           HA       ASN  40   5.704  -7.166  -6.061
  329   1HB   ASN  40          1HB       ASN  40   6.822  -7.374  -8.772
  330   2HB   ASN  40          2HB       ASN  40   7.113  -8.790  -7.774
  331   1HD2  ASN  40          1HD2      ASN  40   4.882  -7.092  -9.658
  332   2HD2  ASN  40          2HD2      ASN  40   3.505  -8.113  -9.373
  333    H    PHE  41           H        PHE  41   6.634  -8.341  -4.523
  334    HA   PHE  41           HA       PHE  41   9.578  -8.382  -4.365
  335   1HB   PHE  41          1HB       PHE  41   7.685  -8.528  -2.012
  336   2HB   PHE  41          2HB       PHE  41   9.440  -8.384  -1.964
  337    HD1  PHE  41           HD1      PHE  41  10.254  -6.257  -3.501
  338    HD2  PHE  41           HD2      PHE  41   6.569  -6.635  -1.408
  339    HE1  PHE  41           HE1      PHE  41  10.052  -3.806  -3.426
  340    HE2  PHE  41           HE2      PHE  41   6.361  -4.185  -1.321
  341    HZ   PHE  41           HZ       PHE  41   8.106  -2.767  -2.325
  342    H    ASP  42           H        ASP  42  10.519 -10.376  -3.885
  343    HA   ASP  42           HA       ASP  42   8.981 -12.643  -4.629
  344   1HB   ASP  42          1HB       ASP  42  11.015 -13.950  -4.180
  345   2HB   ASP  42          2HB       ASP  42  11.339 -12.546  -5.183
  346    H    GLU  43           H        GLU  43   9.003 -14.664  -3.331
  347    HA   GLU  43           HA       GLU  43   7.367 -14.379  -1.147
  348   1HB   GLU  43          1HB       GLU  43   8.795 -16.581  -2.434
  349   2HB   GLU  43          2HB       GLU  43   8.495 -16.852  -0.723
  350   1HG   GLU  43          1HG       GLU  43   6.420 -16.181  -2.795
  351   2HG   GLU  43          2HG       GLU  43   6.711 -17.772  -2.092
  352    H    GLU  44           H        GLU  44  10.875 -14.827  -1.150
  353    HA   GLU  44           HA       GLU  44  11.254 -15.204   1.607
  354   1HB   GLU  44          1HB       GLU  44  12.909 -15.221  -0.494
  355   2HB   GLU  44          2HB       GLU  44  13.223 -13.584   0.079
  356   1HG   GLU  44          1HG       GLU  44  14.729 -15.484   0.899
  357   2HG   GLU  44          2HG       GLU  44  14.127 -14.323   2.078
  358    H    LYS  45           H        LYS  45  11.506 -12.256  -0.344
  359    HA   LYS  45           HA       LYS  45  11.922 -10.466   1.770
  360   1HB   LYS  45          1HB       LYS  45  10.588  -9.923  -0.889
  361   2HB   LYS  45          2HB       LYS  45  11.262  -8.710   0.196
  362   1HG   LYS  45          1HG       LYS  45  13.413 -10.284  -0.128
  363   2HG   LYS  45          2HG       LYS  45  12.610 -10.535  -1.679
  364   1HD   LYS  45          1HD       LYS  45  13.278  -8.545  -2.396
  365   2HD   LYS  45          2HD       LYS  45  12.554  -7.754  -0.992
  366   1HE   LYS  45          1HE       LYS  45  14.632  -7.242  -0.379
  367   2HE   LYS  45          2HE       LYS  45  14.809  -8.941   0.043
  368   1HZ   LYS  45          1HZ       LYS  45  16.602  -8.148  -1.402
  369   2HZ   LYS  45          2HZ       LYS  45  15.464  -7.782  -2.610
  370   3HZ   LYS  45          3HZ       LYS  45  15.701  -9.389  -2.131
  371    H    HIS  46           H        HIS  46   8.960 -11.638   0.273
  372    HA   HIS  46           HA       HIS  46   7.321  -9.758   1.660
  373   1HB   HIS  46          1HB       HIS  46   6.798 -10.982  -0.546
  374   2HB   HIS  46          2HB       HIS  46   6.238 -12.293   0.491
  375    HD1  HIS  46           HD1      HIS  46   3.902 -12.124   1.323
  376    HD2  HIS  46           HD2      HIS  46   5.364  -8.467  -0.024
  377    HE1  HIS  46           HE1      HIS  46   1.993 -10.496   1.558
  378    HE2  HIS  46           HE2      HIS  46   2.832  -8.352   0.534
  379    H    THR  47           H        THR  47   8.266 -13.089   2.291
  380    HA   THR  47           HA       THR  47   6.429 -13.528   4.408
  381    HB   THR  47           HB       THR  47   9.141 -14.821   4.017
  382    HG1  THR  47           HG1      THR  47   7.957 -15.239   2.188
  383   1HG2  THR  47          1HG2      THR  47   7.082 -15.124   6.015
  384   2HG2  THR  47          2HG2      THR  47   8.673 -15.882   5.924
  385   3HG2  THR  47          3HG2      THR  47   7.295 -16.625   5.110
  386    H    ARG  48           H        ARG  48   9.763 -12.320   4.294
  387    HA   ARG  48           HA       ARG  48   9.968 -11.928   7.116
  388   1HB   ARG  48          1HB       ARG  48  11.741 -11.885   4.996
  389   2HB   ARG  48          2HB       ARG  48  11.655 -10.197   5.478
  390   1HG   ARG  48          1HG       ARG  48  11.855 -11.634   7.861
  391   2HG   ARG  48          2HG       ARG  48  13.002 -12.394   6.750
  392   1HD   ARG  48          1HD       ARG  48  12.948  -9.437   6.829
  393   2HD   ARG  48          2HD       ARG  48  13.610 -10.260   8.241
  394    HE   ARG  48           HE       ARG  48  14.626 -10.648   5.489
  395   1HH1  ARG  48          1HH1      ARG  48  15.120 -10.533   8.960
  396   2HH1  ARG  48          2HH1      ARG  48  16.860 -10.519   8.843
  397   1HH2  ARG  48          1HH2      ARG  48  16.912 -10.656   5.325
  398   2HH2  ARG  48          2HH2      ARG  48  17.880 -10.616   6.776
  399    H    PHE  49           H        PHE  49   8.810 -10.064   4.416
  400    HA   PHE  49           HA       PHE  49   8.703  -7.501   5.526
  401   1HB   PHE  49          1HB       PHE  49   7.699  -8.823   3.223
  402   2HB   PHE  49          2HB       PHE  49   6.341  -7.999   3.978
  403    HD1  PHE  49           HD1      PHE  49   9.752  -6.730   4.237
  404    HD2  PHE  49           HD2      PHE  49   6.059  -6.456   2.144
  405    HE1  PHE  49           HE1      PHE  49  10.489  -4.613   3.231
  406    HE2  PHE  49           HE2      PHE  49   6.792  -4.338   1.129
  407    HZ   PHE  49           HZ       PHE  49   8.960  -3.431   1.608
  408    H    LYS  50           H        LYS  50   6.168  -9.986   5.400
  409    HA   LYS  50           HA       LYS  50   4.323  -8.661   7.042
  410   1HB   LYS  50          1HB       LYS  50   4.678 -11.617   6.506
  411   2HB   LYS  50          2HB       LYS  50   3.277 -10.908   7.300
  412   1HG   LYS  50          1HG       LYS  50   2.472  -9.988   5.367
  413   2HG   LYS  50          2HG       LYS  50   4.068  -9.881   4.622
  414   1HD   LYS  50          1HD       LYS  50   3.314 -11.649   3.434
  415   2HD   LYS  50          2HD       LYS  50   3.854 -12.547   4.856
  416   1HE   LYS  50          1HE       LYS  50   1.478 -12.153   5.753
  417   2HE   LYS  50          2HE       LYS  50   1.069 -11.731   4.090
  418   1HZ   LYS  50          1HZ       LYS  50   2.467 -14.257   4.673
  419   2HZ   LYS  50          2HZ       LYS  50   1.474 -13.861   3.358
  420   3HZ   LYS  50          3HZ       LYS  50   0.787 -14.154   4.881
  421    H    ALA  51           H        ALA  51   6.953 -10.869   7.783
  422    HA   ALA  51           HA       ALA  51   6.353 -11.323  10.496
  423   1HB   ALA  51          1HB       ALA  51   7.902 -12.797   9.609
  424   2HB   ALA  51          2HB       ALA  51   8.907 -11.746  10.604
  425   3HB   ALA  51          3HB       ALA  51   8.848 -11.515   8.856
  426    H    ALA  52           H        ALA  52   8.617  -9.025   8.979
  427    HA   ALA  52           HA       ALA  52   9.365  -7.709  11.345
  428   1HB   ALA  52          1HB       ALA  52   9.498  -5.829   9.266
  429   2HB   ALA  52          2HB       ALA  52   9.821  -7.400   8.538
  430   3HB   ALA  52          3HB       ALA  52  10.795  -6.841   9.896
  431    H    CYS  53           H        CYS  53   6.629  -7.237   9.185
  432    HA   CYS  53           HA       CYS  53   5.710  -4.777  10.191
  433   1HB   CYS  53          1HB       CYS  53   4.201  -7.096   8.974
  434   2HB   CYS  53          2HB       CYS  53   3.469  -5.539   9.345
  435    HG   CYS  53           HG       CYS  53   5.941  -6.136   7.056
  436    H    ALA  54           H        ALA  54   5.207  -8.107  11.261
  437    HA   ALA  54           HA       ALA  54   3.359  -7.379  13.336
  438   1HB   ALA  54          1HB       ALA  54   3.602  -9.690  14.085
  439   2HB   ALA  54          2HB       ALA  54   4.944  -9.917  12.965
  440   3HB   ALA  54          3HB       ALA  54   3.320  -9.612  12.346
  441    H    ARG  55           H        ARG  55   6.813  -7.906  13.077
  442    HA   ARG  55           HA       ARG  55   7.427  -8.045  15.808
  443   1HB   ARG  55          1HB       ARG  55   8.888  -7.760  13.295
  444   2HB   ARG  55          2HB       ARG  55   9.675  -6.938  14.637
  445   1HG   ARG  55          1HG       ARG  55   9.514  -9.075  15.928
  446   2HG   ARG  55          2HG       ARG  55   8.949  -9.851  14.448
  447   1HD   ARG  55          1HD       ARG  55  11.133 -10.263  14.110
  448   2HD   ARG  55          2HD       ARG  55  11.172  -8.592  13.549
  449    HE   ARG  55           HE       ARG  55  11.570  -8.777  16.369
  450   1HH1  ARG  55          1HH1      ARG  55  13.205  -9.263  13.313
  451   2HH1  ARG  55          2HH1      ARG  55  14.770  -8.808  13.932
  452   1HH2  ARG  55          1HH2      ARG  55  13.612  -8.181  17.192
  453   2HH2  ARG  55          2HH2      ARG  55  15.009  -8.224  16.155
  454    H    LYS  56           H        LYS  56   7.335  -5.257  13.609
  455    HA   LYS  56           HA       LYS  56   8.005  -3.515  15.866
  456   1HB   LYS  56          1HB       LYS  56   7.680  -2.478  13.087
  457   2HB   LYS  56          2HB       LYS  56   8.788  -1.962  14.351
  458   1HG   LYS  56          1HG       LYS  56  10.139  -3.957  14.000
  459   2HG   LYS  56          2HG       LYS  56   9.012  -4.508  12.759
  460   1HD   LYS  56          1HD       LYS  56  10.247  -3.403  11.272
  461   2HD   LYS  56          2HD       LYS  56   9.687  -1.906  12.020
  462   1HE   LYS  56          1HE       LYS  56  11.896  -3.258  13.410
  463   2HE   LYS  56          2HE       LYS  56  12.287  -2.635  11.807
  464   1HZ   LYS  56          1HZ       LYS  56  12.077  -1.216  14.202
  465   2HZ   LYS  56          2HZ       LYS  56  10.824  -0.686  13.191
  466   3HZ   LYS  56          3HZ       LYS  56  12.426  -0.617  12.656
  467    H    GLY  57           H        GLY  57   5.251  -4.693  14.593
  468   1HA   GLY  57          1HA       GLY  57   3.041  -4.057  14.762
  469   2HA   GLY  57          2HA       GLY  57   3.572  -2.709  15.762
  470    H    THR  58           H        THR  58   4.514  -3.491  12.486
  471    HA   THR  58           HA       THR  58   3.786  -0.783  11.675
  472    HB   THR  58           HB       THR  58   5.257  -2.060   9.650
  473    HG1  THR  58           HG1      THR  58   6.864  -3.130  10.685
  474   1HG2  THR  58          1HG2      THR  58   7.138  -0.599  10.639
  475   2HG2  THR  58          2HG2      THR  58   5.909  -0.055  11.781
  476   3HG2  THR  58          3HG2      THR  58   5.680   0.198  10.049
  477    H    SER  59           H        SER  59   2.688  -0.361   9.765
  478    HA   SER  59           HA       SER  59   0.954  -2.467   8.743
  479   1HB   SER  59          1HB       SER  59   0.999   0.190   7.436
  480   2HB   SER  59          2HB       SER  59  -0.376  -0.781   7.962
  481    HG   SER  59           HG       SER  59   0.462  -0.177  10.188
  482    H    ILE  60           H        ILE  60   1.179  -3.398   6.734
  483    HA   ILE  60           HA       ILE  60   3.725  -3.679   5.730
  484    HB   ILE  60           HB       ILE  60   2.084  -5.362   5.268
  485   1HG1  ILE  60          1HG1      ILE  60   2.317  -4.893   2.488
  486   2HG1  ILE  60          2HG1      ILE  60   3.753  -4.206   3.241
  487   1HG2  ILE  60          1HG2      ILE  60   0.415  -3.229   4.566
  488   2HG2  ILE  60          2HG2      ILE  60   0.020  -4.946   4.588
  489   3HG2  ILE  60          3HG2      ILE  60   0.612  -4.197   3.107
  490   1HD1  ILE  60          1HD1      ILE  60   4.199  -6.348   4.329
  491   2HD1  ILE  60          2HD1      ILE  60   4.139  -6.499   2.572
  492   3HD1  ILE  60          3HD1      ILE  60   2.770  -7.033   3.550
  493    H    THR  61           H        THR  61   1.189  -1.491   4.570
  494    HA   THR  61           HA       THR  61   2.615  -0.541   2.306
  495    HB   THR  61           HB       THR  61   0.597   1.043   3.897
  496    HG1  THR  61           HG1      THR  61  -0.429  -0.876   3.508
  497   1HG2  THR  61          1HG2      THR  61   0.911   1.014   0.913
  498   2HG2  THR  61          2HG2      THR  61   1.960   2.019   1.913
  499   3HG2  THR  61          3HG2      THR  61   0.213   2.260   1.948
  500    H    ASP  62           H        ASP  62   2.331   0.610   5.641
  501    HA   ASP  62           HA       ASP  62   3.957   2.904   5.347
  502   1HB   ASP  62          1HB       ASP  62   2.444   2.704   7.222
  503   2HB   ASP  62          2HB       ASP  62   3.263   1.251   7.782
  504    H    VAL  63           H        VAL  63   4.642  -0.453   5.999
  505    HA   VAL  63           HA       VAL  63   7.298  -0.229   6.873
  506    HB   VAL  63           HB       VAL  63   5.542  -2.371   5.955
  507   1HG1  VAL  63          1HG1      VAL  63   8.497  -2.798   5.523
  508   2HG1  VAL  63          2HG1      VAL  63   7.321  -2.575   4.225
  509   3HG1  VAL  63          3HG1      VAL  63   7.202  -3.974   5.294
  510   1HG2  VAL  63          1HG2      VAL  63   6.860  -1.652   8.243
  511   2HG2  VAL  63          2HG2      VAL  63   7.784  -3.044   7.681
  512   3HG2  VAL  63          3HG2      VAL  63   6.050  -3.193   7.958
  513    H    VAL  64           H        VAL  64   5.961  -0.662   3.595
  514    HA   VAL  64           HA       VAL  64   8.464  -0.683   2.279
  515    HB   VAL  64           HB       VAL  64   6.033   0.457   0.944
  516   1HG1  VAL  64          1HG1      VAL  64   7.796  -1.621  -0.238
  517   2HG1  VAL  64          2HG1      VAL  64   8.460  -0.002  -0.023
  518   3HG1  VAL  64          3HG1      VAL  64   7.009  -0.239  -0.997
  519   1HG2  VAL  64          1HG2      VAL  64   6.439  -2.399   1.783
  520   2HG2  VAL  64          2HG2      VAL  64   5.431  -1.962   0.402
  521   3HG2  VAL  64          3HG2      VAL  64   5.022  -1.376   2.016
  522    H    ASN  65           H        ASN  65   6.223   1.910   3.133
  523    HA   ASN  65           HA       ASN  65   7.565   3.998   1.826
  524   1HB   ASN  65          1HB       ASN  65   5.326   3.762   3.485
  525   2HB   ASN  65          2HB       ASN  65   6.410   4.869   4.329
  526   1HD2  ASN  65          1HD2      ASN  65   3.825   5.182   2.807
  527   2HD2  ASN  65          2HD2      ASN  65   4.152   6.465   1.682
  528    H    GLN  66           H        GLN  66   8.022   2.535   4.992
  529    HA   GLN  66           HA       GLN  66   9.853   4.390   6.031
  530   1HB   GLN  66          1HB       GLN  66   8.610   2.424   7.187
  531   2HB   GLN  66          2HB       GLN  66   9.985   1.459   6.674
  532   1HG   GLN  66          1HG       GLN  66  11.428   3.205   7.833
  533   2HG   GLN  66          2HG       GLN  66   9.934   3.776   8.574
  534   1HE2  GLN  66          1HE2      GLN  66   8.769   2.317   9.942
  535   2HE2  GLN  66          2HE2      GLN  66   9.606   1.036  10.754
  536    H    LEU  67           H        LEU  67  10.423   1.340   4.250
  537    HA   LEU  67           HA       LEU  67  13.248   1.606   4.350
  538   1HB   LEU  67          1HB       LEU  67  13.078  -0.019   2.299
  539   2HB   LEU  67          2HB       LEU  67  12.738  -0.564   3.929
  540    HG   LEU  67           HG       LEU  67  10.272   0.279   2.994
  541   1HD1  LEU  67          1HD1      LEU  67  11.548   0.274   0.732
  542   2HD1  LEU  67          2HD1      LEU  67   9.958  -0.481   0.838
  543   3HD1  LEU  67          3HD1      LEU  67  11.410  -1.479   0.864
  544   1HD2  LEU  67          1HD2      LEU  67  10.425  -1.624   4.341
  545   2HD2  LEU  67          2HD2      LEU  67  11.607  -2.391   3.281
  546   3HD2  LEU  67          3HD2      LEU  67   9.926  -2.249   2.770
  547    H    VAL  68           H        VAL  68  10.816   2.649   2.014
  548    HA   VAL  68           HA       VAL  68  12.648   3.461  -0.003
  549    HB   VAL  68           HB       VAL  68   9.938   4.693   0.543
  550   1HG1  VAL  68          1HG1      VAL  68  10.859   6.116  -0.987
  551   2HG1  VAL  68          2HG1      VAL  68  10.237   4.888  -2.091
  552   3HG1  VAL  68          3HG1      VAL  68  11.943   4.887  -1.641
  553   1HG2  VAL  68          1HG2      VAL  68   9.666   3.010  -1.619
  554   2HG2  VAL  68          2HG2      VAL  68   9.098   2.692   0.022
  555   3HG2  VAL  68          3HG2      VAL  68  10.668   2.079  -0.504
  556    H    ASP  69           H        ASP  69  11.083   5.167   2.678
  557    HA   ASP  69           HA       ASP  69  12.149   7.721   2.243
  558   1HB   ASP  69          1HB       ASP  69  10.442   6.662   4.056
  559   2HB   ASP  69          2HB       ASP  69  11.881   6.832   5.055
  560    H    ASN  70           H        ASN  70  13.381   4.983   4.093
  561    HA   ASN  70           HA       ASN  70  15.711   6.217   5.092
  562   1HB   ASN  70          1HB       ASN  70  15.039   4.211   6.138
  563   2HB   ASN  70          2HB       ASN  70  14.911   3.352   4.610
  564   1HD2  ASN  70          1HD2      ASN  70  16.335   1.772   4.673
  565   2HD2  ASN  70          2HD2      ASN  70  18.003   1.912   5.125
  566    H    TRP  71           H        TRP  71  15.342   3.981   2.327
  567    HA   TRP  71           HA       TRP  71  17.956   4.122   1.380
  568   1HB   TRP  71          1HB       TRP  71  16.221   2.504   0.625
  569   2HB   TRP  71          2HB       TRP  71  15.444   3.800  -0.272
  570    HD1  TRP  71           HD1      TRP  71  18.449   1.471  -0.366
  571    HE1  TRP  71           HE1      TRP  71  19.545   1.591  -2.692
  572    HE3  TRP  71           HE3      TRP  71  15.763   5.372  -2.344
  573    HZ2  TRP  71           HZ2      TRP  71  19.292   3.095  -5.054
  574    HZ3  TRP  71           HZ3      TRP  71  16.249   6.056  -4.671
  575    HH2  TRP  71           HH2      TRP  71  17.980   4.948  -5.990
  576    H    LEU  72           H        LEU  72  15.128   5.924   0.254
  577    HA   LEU  72           HA       LEU  72  16.322   7.365  -1.749
  578   1HB   LEU  72          1HB       LEU  72  13.827   7.204  -0.722
  579   2HB   LEU  72          2HB       LEU  72  14.281   8.808  -0.180
  580    HG   LEU  72           HG       LEU  72  14.997   8.750  -2.878
  581   1HD1  LEU  72          1HD1      LEU  72  12.960   8.049  -4.010
  582   2HD1  LEU  72          2HD1      LEU  72  12.280   7.510  -2.471
  583   3HD1  LEU  72          3HD1      LEU  72  13.695   6.699  -3.143
  584   1HD2  LEU  72          1HD2      LEU  72  13.699  10.607  -2.960
  585   2HD2  LEU  72          2HD2      LEU  72  13.742  10.423  -1.206
  586   3HD2  LEU  72          3HD2      LEU  72  12.352   9.836  -2.123
  587    H    LYS  73           H        LYS  73  15.677   8.571   1.533
  588    HA   LYS  73           HA       LYS  73  17.102  10.965   0.941
  589   1HB   LYS  73          1HB       LYS  73  15.926  10.034   3.552
  590   2HB   LYS  73          2HB       LYS  73  16.393  11.683   3.142
  591   1HG   LYS  73          1HG       LYS  73  14.582  12.015   1.805
  592   2HG   LYS  73          2HG       LYS  73  14.493  10.311   1.328
  593   1HD   LYS  73          1HD       LYS  73  12.584  10.772   2.674
  594   2HD   LYS  73          2HD       LYS  73  13.695   9.814   3.657
  595   1HE   LYS  73          1HE       LYS  73  14.517  12.280   4.319
  596   2HE   LYS  73          2HE       LYS  73  12.826  12.622   3.951
  597   1HZ   LYS  73          1HZ       LYS  73  13.963  10.913   6.057
  598   2HZ   LYS  73          2HZ       LYS  73  12.415  10.564   5.454
  599   3HZ   LYS  73          3HZ       LYS  73  12.730  12.075   6.163
  600    H    GLU  74           H        GLU  74  18.181   7.969   2.018
  601    HA   GLU  74           HA       GLU  74  20.400   9.072   3.548
  602   1HB   GLU  74          1HB       GLU  74  19.273   6.413   3.101
  603   2HB   GLU  74          2HB       GLU  74  21.031   6.432   3.023
  604   1HG   GLU  74          1HG       GLU  74  19.273   7.266   5.310
  605   2HG   GLU  74          2HG       GLU  74  20.438   5.945   5.261
  606    H    ASN  75           H        ASN  75  19.673   8.151   0.291
  607    HA   ASN  75           HA       ASN  75  22.529   8.354  -0.382
  608   1HB   ASN  75          1HB       ASN  75  22.345   6.631  -1.838
  609   2HB   ASN  75          2HB       ASN  75  20.966   6.217  -0.830
  610   1HD2  ASN  75          1HD2      ASN  75  18.926   6.404  -1.627
  611   2HD2  ASN  75          2HD2      ASN  75  18.594   6.720  -3.297
  612    H    GLU  76           H        GLU  76  19.459   9.814  -0.930
  613    HA   GLU  76           HA       GLU  76  20.388  11.192  -3.330
  614   1HB   GLU  76          1HB       GLU  76  17.786  10.785  -2.015
  615   2HB   GLU  76          2HB       GLU  76  18.023  12.404  -2.656
  616   1HG   GLU  76          1HG       GLU  76  18.526   9.963  -4.321
  617   2HG   GLU  76          2HG       GLU  76  16.918  10.667  -4.161
  618   1H    MET   1          1H        MET   1  -7.408 -57.266 -51.338
  619   2H    MET   1          2H        MET   1  -7.253 -57.506 -49.670
  620   3H    MET   1          3H        MET   1  -6.025 -58.027 -50.714
  621    HA   MET   1           HA       MET   1  -5.185 -56.088 -49.803
  622   1HB   MET   1          1HB       MET   1  -5.285 -56.328 -52.373
  623   2HB   MET   1          2HB       MET   1  -6.503 -55.061 -52.305
  624   1HG   MET   1          1HG       MET   1  -4.906 -53.568 -51.233
  625   2HG   MET   1          2HG       MET   1  -3.686 -54.838 -51.268
  626   1HE   MET   1          1HE       MET   1  -3.359 -51.818 -52.511
  627   2HE   MET   1          2HE       MET   1  -5.076 -51.824 -52.904
  628   3HE   MET   1          3HE       MET   1  -3.881 -51.655 -54.188
  629    H    SER   2           H        SER   2  -8.577 -55.654 -50.737
  630    HA   SER   2           HA       SER   2  -8.886 -53.042 -49.744
  631   1HB   SER   2          1HB       SER   2 -11.176 -54.949 -49.618
  632   2HB   SER   2          2HB       SER   2 -11.122 -53.299 -50.237
  633    HG   SER   2           HG       SER   2  -9.819 -54.185 -52.001
  634    H    LEU   3           H        LEU   3  -9.219 -56.194 -48.207
  635    HA   LEU   3           HA       LEU   3  -9.703 -54.883 -45.622
  636   1HB   LEU   3          1HB       LEU   3 -10.495 -57.421 -46.791
  637   2HB   LEU   3          2HB       LEU   3  -9.712 -57.646 -45.239
  638    HG   LEU   3           HG       LEU   3 -11.824 -55.570 -45.370
  639   1HD1  LEU   3          1HD1      LEU   3 -13.135 -57.064 -46.503
  640   2HD1  LEU   3          2HD1      LEU   3 -13.423 -57.586 -44.844
  641   3HD1  LEU   3          3HD1      LEU   3 -12.285 -58.468 -45.860
  642   1HD2  LEU   3          1HD2      LEU   3 -12.224 -57.256 -43.221
  643   2HD2  LEU   3          2HD2      LEU   3 -11.350 -55.725 -43.194
  644   3HD2  LEU   3          3HD2      LEU   3 -10.474 -57.238 -43.415
  645    H    GLU   4           H        GLU   4  -7.589 -54.103 -45.370
  646    HA   GLU   4           HA       GLU   4  -5.356 -55.918 -45.495
  647   1HB   GLU   4          1HB       GLU   4  -5.759 -53.037 -45.181
  648   2HB   GLU   4          2HB       GLU   4  -4.451 -53.665 -44.187
  649   1HG   GLU   4          1HG       GLU   4  -4.599 -54.398 -47.074
  650   2HG   GLU   4          2HG       GLU   4  -3.978 -52.819 -46.594
  651    H    LYS   5           H        LYS   5  -5.589 -57.492 -43.999
  652    HA   LYS   5           HA       LYS   5  -5.410 -58.548 -42.002
  653   1HB   LYS   5          1HB       LYS   5  -4.306 -55.876 -41.385
  654   2HB   LYS   5          2HB       LYS   5  -4.877 -56.795 -39.998
  655   1HG   LYS   5          1HG       LYS   5  -3.143 -58.187 -40.070
  656   2HG   LYS   5          2HG       LYS   5  -3.244 -58.373 -41.823
  657   1HD   LYS   5          1HD       LYS   5  -2.158 -56.147 -42.053
  658   2HD   LYS   5          2HD       LYS   5  -1.938 -56.120 -40.302
  659   1HE   LYS   5          1HE       LYS   5   0.072 -56.998 -40.878
  660   2HE   LYS   5          2HE       LYS   5  -0.854 -58.497 -40.805
  661   1HZ   LYS   5          1HZ       LYS   5  -0.008 -56.972 -43.189
  662   2HZ   LYS   5          2HZ       LYS   5  -1.281 -58.085 -43.268
  663   3HZ   LYS   5          3HZ       LYS   5   0.269 -58.605 -42.821
  664    H    ALA   6           H        ALA   6  -7.540 -59.153 -41.861
  665    HA   ALA   6           HA       ALA   6  -9.578 -57.399 -40.845
  666   1HB   ALA   6          1HB       ALA   6  -9.424 -60.239 -41.691
  667   2HB   ALA   6          2HB       ALA   6 -10.572 -58.979 -42.148
  668   3HB   ALA   6          3HB       ALA   6 -10.721 -59.785 -40.586
  669    H    HIS   7           H        HIS   7  -9.085 -56.665 -38.848
  670    HA   HIS   7           HA       HIS   7  -8.389 -58.644 -36.785
  671   1HB   HIS   7          1HB       HIS   7  -6.800 -56.738 -37.253
  672   2HB   HIS   7          2HB       HIS   7  -8.037 -55.646 -36.639
  673    HD1  HIS   7           HD1      HIS   7  -8.363 -55.520 -34.112
  674    HD2  HIS   7           HD2      HIS   7  -5.564 -58.371 -35.284
  675    HE1  HIS   7           HE1      HIS   7  -7.178 -56.222 -32.003
  676    HE2  HIS   7           HE2      HIS   7  -5.452 -57.905 -32.737
  677    H    THR   8           H        THR   8  -9.782 -59.097 -35.257
  678    HA   THR   8           HA       THR   8 -12.009 -57.228 -34.752
  679    HB   THR   8           HB       THR   8 -12.276 -60.033 -33.840
  680    HG1  THR   8           HG1      THR   8 -12.075 -60.914 -35.748
  681   1HG2  THR   8          1HG2      THR   8 -14.426 -59.453 -33.751
  682   2HG2  THR   8          2HG2      THR   8 -14.426 -58.990 -35.454
  683   3HG2  THR   8          3HG2      THR   8 -13.947 -57.823 -34.222
  684    H    SER   9           H        SER   9 -12.612 -56.976 -32.506
  685    HA   SER   9           HA       SER   9 -10.321 -57.125 -30.759
  686   1HB   SER   9          1HB       SER   9 -13.090 -56.233 -29.969
  687   2HB   SER   9          2HB       SER   9 -11.543 -55.745 -29.275
  688    HG   SER   9           HG       SER   9 -11.111 -54.522 -31.054
  689    H    VAL  10           H        VAL  10 -10.427 -59.549 -31.071
  690    HA   VAL  10           HA       VAL  10 -12.408 -61.036 -29.646
  691    HB   VAL  10           HB       VAL  10 -10.856 -62.964 -29.956
  692   1HG1  VAL  10          1HG1      VAL  10 -12.228 -63.017 -31.736
  693   2HG1  VAL  10          2HG1      VAL  10 -10.793 -62.504 -32.625
  694   3HG1  VAL  10          3HG1      VAL  10 -11.982 -61.309 -32.105
  695   1HG2  VAL  10          1HG2      VAL  10  -9.125 -61.134 -31.587
  696   2HG2  VAL  10          2HG2      VAL  10  -8.796 -62.782 -31.052
  697   3HG2  VAL  10          3HG2      VAL  10  -8.788 -61.460 -29.887
  698    H    LYS  11           H        LYS  11 -11.837 -62.511 -27.854
  699    HA   LYS  11           HA       LYS  11 -11.224 -62.876 -25.709
  700   1HB   LYS  11          1HB       LYS  11  -8.876 -62.645 -26.889
  701   2HB   LYS  11          2HB       LYS  11  -8.789 -61.159 -25.953
  702   1HG   LYS  11          1HG       LYS  11  -8.779 -62.285 -23.927
  703   2HG   LYS  11          2HG       LYS  11  -9.477 -63.747 -24.629
  704   1HD   LYS  11          1HD       LYS  11  -7.466 -64.432 -25.537
  705   2HD   LYS  11          2HD       LYS  11  -6.796 -62.798 -25.548
  706   1HE   LYS  11          1HE       LYS  11  -7.379 -63.488 -22.861
  707   2HE   LYS  11          2HE       LYS  11  -6.503 -64.835 -23.583
  708   1HZ   LYS  11          1HZ       LYS  11  -5.449 -62.180 -24.132
  709   2HZ   LYS  11          2HZ       LYS  11  -4.630 -63.623 -23.788
  710   3HZ   LYS  11          3HZ       LYS  11  -5.309 -62.717 -22.529
  711    H    LYS  12           H        LYS  12  -9.589 -59.786 -25.751
  712    HA   LYS  12           HA       LYS  12 -11.710 -58.163 -25.033
  713   1HB   LYS  12          1HB       LYS  12 -10.801 -59.738 -22.859
  714   2HB   LYS  12          2HB       LYS  12 -10.225 -58.102 -22.576
  715   1HG   LYS  12          1HG       LYS  12 -13.039 -58.298 -23.402
  716   2HG   LYS  12          2HG       LYS  12 -12.654 -59.022 -21.840
  717   1HD   LYS  12          1HD       LYS  12 -11.350 -56.474 -22.112
  718   2HD   LYS  12          2HD       LYS  12 -13.081 -56.312 -22.406
  719   1HE   LYS  12          1HE       LYS  12 -12.295 -57.968 -20.094
  720   2HE   LYS  12          2HE       LYS  12 -11.976 -56.241 -19.954
  721   1HZ   LYS  12          1HZ       LYS  12 -14.416 -56.041 -20.767
  722   2HZ   LYS  12          2HZ       LYS  12 -14.103 -56.409 -19.142
  723   3HZ   LYS  12          3HZ       LYS  12 -14.551 -57.641 -20.213
  724    H    MET  13           H        MET  13 -10.911 -56.510 -26.164
  725    HA   MET  13           HA       MET  13  -8.144 -55.879 -26.326
  726   1HB   MET  13          1HB       MET  13  -8.917 -54.749 -28.095
  727   2HB   MET  13          2HB       MET  13 -10.569 -55.035 -27.567
  728   1HG   MET  13          1HG       MET  13 -10.804 -52.958 -26.699
  729   2HG   MET  13          2HG       MET  13  -9.110 -52.834 -26.232
  730   1HE   MET  13          1HE       MET  13  -9.215 -49.938 -27.574
  731   2HE   MET  13          2HE       MET  13 -10.751 -50.668 -27.106
  732   3HE   MET  13          3HE       MET  13 -10.540 -50.017 -28.731
  733    H    THR  14           H        THR  14  -6.971 -54.198 -25.363
  734    HA   THR  14           HA       THR  14  -7.835 -53.507 -22.705
  735    HB   THR  14           HB       THR  14  -5.557 -52.015 -23.423
  736    HG1  THR  14           HG1      THR  14  -4.633 -54.511 -23.887
  737   1HG2  THR  14          1HG2      THR  14  -4.449 -53.373 -21.764
  738   2HG2  THR  14          2HG2      THR  14  -5.710 -54.602 -21.879
  739   3HG2  THR  14          3HG2      THR  14  -6.087 -53.011 -21.215
  740    H    PHE  15           H        PHE  15  -9.463 -52.080 -22.725
  741    HA   PHE  15           HA       PHE  15  -9.456 -49.797 -24.496
  742   1HB   PHE  15          1HB       PHE  15 -11.624 -49.281 -23.144
  743   2HB   PHE  15          2HB       PHE  15 -11.614 -50.631 -24.270
  744    HD1  PHE  15           HD1      PHE  15 -11.749 -49.636 -20.762
  745    HD2  PHE  15           HD2      PHE  15 -11.625 -52.923 -23.463
  746    HE1  PHE  15           HE1      PHE  15 -12.446 -51.149 -18.951
  747    HE2  PHE  15           HE2      PHE  15 -12.337 -54.437 -21.661
  748    HZ   PHE  15           HZ       PHE  15 -12.767 -53.536 -19.394
  749    H    GLY  16           H        GLY  16  -8.411 -50.526 -21.343
  750   1HA   GLY  16          1HA       GLY  16  -6.914 -48.869 -20.328
  751   2HA   GLY  16          2HA       GLY  16  -8.082 -47.641 -20.796
  752    H    GLU  17           H        GLU  17  -7.094 -48.033 -18.179
  753    HA   GLU  17           HA       GLU  17  -7.752 -48.242 -16.017
  754   1HB   GLU  17          1HB       GLU  17  -9.750 -46.888 -17.166
  755   2HB   GLU  17          2HB       GLU  17 -10.642 -48.343 -16.747
  756   1HG   GLU  17          1HG       GLU  17 -10.889 -46.683 -15.022
  757   2HG   GLU  17          2HG       GLU  17  -9.987 -48.066 -14.405
  758    H    ASN  18           H        ASN  18  -7.161 -50.543 -17.467
  759    HA   ASN  18           HA       ASN  18  -9.105 -52.582 -17.132
  760   1HB   ASN  18          1HB       ASN  18  -6.245 -52.438 -17.952
  761   2HB   ASN  18          2HB       ASN  18  -6.857 -53.999 -17.417
  762   1HD2  ASN  18          1HD2      ASN  18  -7.779 -55.228 -18.872
  763   2HD2  ASN  18          2HD2      ASN  18  -8.363 -54.710 -20.421
  764    H    ARG  19           H        ARG  19  -6.292 -51.518 -15.335
  765    HA   ARG  19           HA       ARG  19  -7.055 -53.329 -13.142
  766   1HB   ARG  19          1HB       ARG  19  -4.549 -52.851 -14.272
  767   2HB   ARG  19          2HB       ARG  19  -4.539 -51.939 -12.767
  768   1HG   ARG  19          1HG       ARG  19  -5.662 -54.461 -12.200
  769   2HG   ARG  19          2HG       ARG  19  -4.207 -54.731 -13.163
  770   1HD   ARG  19          1HD       ARG  19  -2.830 -53.914 -11.564
  771   2HD   ARG  19          2HD       ARG  19  -4.006 -52.723 -11.009
  772    HE   ARG  19           HE       ARG  19  -5.108 -54.512  -9.782
  773   1HH1  ARG  19          1HH1      ARG  19  -1.888 -55.168 -10.999
  774   2HH1  ARG  19          2HH1      ARG  19  -1.541 -56.369  -9.793
  775   1HH2  ARG  19          1HH2      ARG  19  -4.649 -56.101  -8.187
  776   2HH2  ARG  19          2HH2      ARG  19  -3.082 -56.865  -8.175
  777    H    ASP  20           H        ASP  20  -7.949 -52.465 -11.415
  778    HA   ASP  20           HA       ASP  20  -8.469 -49.648 -11.410
  779   1HB   ASP  20          1HB       ASP  20 -10.279 -50.176 -10.152
  780   2HB   ASP  20          2HB       ASP  20  -9.919 -51.809 -10.693
  781    H    LEU  21           H        LEU  21  -6.104 -51.591  -9.948
  782    HA   LEU  21           HA       LEU  21  -5.750 -49.948  -7.607
  783   1HB   LEU  21          1HB       LEU  21  -4.551 -52.403  -8.704
  784   2HB   LEU  21          2HB       LEU  21  -3.449 -51.388  -7.796
  785    HG   LEU  21           HG       LEU  21  -6.093 -52.338  -6.698
  786   1HD1  LEU  21          1HD1      LEU  21  -5.125 -54.210  -5.820
  787   2HD1  LEU  21          2HD1      LEU  21  -3.502 -53.520  -5.846
  788   3HD1  LEU  21          3HD1      LEU  21  -4.239 -54.093  -7.342
  789   1HD2  LEU  21          1HD2      LEU  21  -5.593 -51.183  -4.858
  790   2HD2  LEU  21          2HD2      LEU  21  -4.387 -50.352  -5.837
  791   3HD2  LEU  21          3HD2      LEU  21  -3.924 -51.745  -4.860
  792    H    GLU  22           H        GLU  22  -5.638 -47.971  -8.984
  793    HA   GLU  22           HA       GLU  22  -2.847 -47.450  -9.784
  794   1HB   GLU  22          1HB       GLU  22  -5.279 -47.145 -11.294
  795   2HB   GLU  22          2HB       GLU  22  -4.541 -45.569 -11.045
  796   1HG   GLU  22          1HG       GLU  22  -3.060 -47.946 -12.129
  797   2HG   GLU  22          2HG       GLU  22  -3.874 -46.751 -13.139
  798    H    ARG  23           H        ARG  23  -1.887 -45.913  -8.578
  799    HA   ARG  23           HA       ARG  23  -3.547 -43.832  -7.358
  800   1HB   ARG  23          1HB       ARG  23  -2.848 -46.059  -5.930
  801   2HB   ARG  23          2HB       ARG  23  -1.554 -44.941  -5.516
  802   1HG   ARG  23          1HG       ARG  23  -3.344 -44.780  -3.908
  803   2HG   ARG  23          2HG       ARG  23  -3.228 -43.281  -4.831
  804   1HD   ARG  23          1HD       ARG  23  -5.080 -45.398  -5.798
  805   2HD   ARG  23          2HD       ARG  23  -5.555 -44.461  -4.383
  806    HE   ARG  23           HE       ARG  23  -5.343 -43.527  -7.121
  807   1HH1  ARG  23          1HH1      ARG  23  -5.574 -42.640  -3.738
  808   2HH1  ARG  23          2HH1      ARG  23  -6.212 -41.055  -4.067
  809   1HH2  ARG  23          1HH2      ARG  23  -6.157 -41.448  -7.560
  810   2HH2  ARG  23          2HH2      ARG  23  -6.530 -40.367  -6.245
  811    H    VAL  24           H        VAL  24  -2.198 -42.906  -9.269
  812    HA   VAL  24           HA       VAL  24   0.296 -41.833  -8.113
  813    HB   VAL  24           HB       VAL  24  -0.385 -41.772 -11.055
  814   1HG1  VAL  24          1HG1      VAL  24   2.262 -41.674 -10.986
  815   2HG1  VAL  24          2HG1      VAL  24   1.948 -41.026  -9.375
  816   3HG1  VAL  24          3HG1      VAL  24   1.272 -40.226 -10.794
  817   1HG2  VAL  24          1HG2      VAL  24   0.145 -43.918 -11.278
  818   2HG2  VAL  24          2HG2      VAL  24   0.329 -44.061  -9.530
  819   3HG2  VAL  24          3HG2      VAL  24   1.715 -43.617 -10.528
  820    H    VAL  25           H        VAL  25  -0.180 -39.927  -7.205
  821    HA   VAL  25           HA       VAL  25  -1.906 -38.081  -8.725
  822    HB   VAL  25           HB       VAL  25  -2.523 -37.129  -6.413
  823   1HG1  VAL  25          1HG1      VAL  25  -4.123 -38.218  -7.867
  824   2HG1  VAL  25          2HG1      VAL  25  -4.401 -38.697  -6.191
  825   3HG1  VAL  25          3HG1      VAL  25  -3.592 -39.802  -7.304
  826   1HG2  VAL  25          1HG2      VAL  25  -0.973 -38.314  -5.027
  827   2HG2  VAL  25          2HG2      VAL  25  -1.542 -39.870  -5.629
  828   3HG2  VAL  25          3HG2      VAL  25  -2.596 -38.873  -4.626
  829    H    THR  26           H        THR  26  -1.249 -36.001  -8.889
  830    HA   THR  26           HA       THR  26   1.469 -35.432  -7.965
  831    HB   THR  26           HB       THR  26   0.009 -33.484  -9.667
  832    HG1  THR  26           HG1      THR  26   0.836 -36.065 -10.589
  833   1HG2  THR  26          1HG2      THR  26   2.713 -34.708 -10.132
  834   2HG2  THR  26          2HG2      THR  26   2.476 -33.431  -8.938
  835   3HG2  THR  26          3HG2      THR  26   2.113 -33.130 -10.638
  836    H    ALA  27           H        ALA  27   1.969 -33.756  -6.598
  837    HA   ALA  27           HA       ALA  27  -0.195 -32.719  -4.992
  838   1HB   ALA  27          1HB       ALA  27   2.283 -33.464  -4.339
  839   2HB   ALA  27          2HB       ALA  27   1.365 -32.276  -3.410
  840   3HB   ALA  27          3HB       ALA  27   2.569 -31.741  -4.585
  841    HA   PRO  28           HA       PRO  28  -0.426 -29.061  -7.596
  842   1HB   PRO  28          1HB       PRO  28  -2.590 -28.251  -5.808
  843   2HB   PRO  28          2HB       PRO  28  -2.656 -28.655  -7.524
  844   1HG   PRO  28          1HG       PRO  28  -3.742 -30.234  -5.613
  845   2HG   PRO  28          2HG       PRO  28  -3.074 -30.878  -7.123
  846   1HD   PRO  28          1HD       PRO  28  -1.850 -30.801  -4.391
  847   2HD   PRO  28          2HD       PRO  28  -1.820 -32.100  -5.604
  848    H    VAL  29           H        VAL  29   1.385 -27.920  -7.018
  849    HA   VAL  29           HA       VAL  29   1.635 -26.768  -4.384
  850    HB   VAL  29           HB       VAL  29   3.678 -25.618  -5.650
  851   1HG1  VAL  29          1HG1      VAL  29   3.556 -28.508  -4.803
  852   2HG1  VAL  29          2HG1      VAL  29   3.904 -27.116  -3.776
  853   3HG1  VAL  29          3HG1      VAL  29   5.040 -27.585  -5.041
  854   1HG2  VAL  29          1HG2      VAL  29   3.514 -28.154  -7.227
  855   2HG2  VAL  29          2HG2      VAL  29   4.480 -26.708  -7.524
  856   3HG2  VAL  29          3HG2      VAL  29   2.745 -26.687  -7.831
  857    H    SER  30           H        SER  30   2.019 -24.472  -4.040
  858    HA   SER  30           HA       SER  30   0.107 -22.890  -5.557
  859   1HB   SER  30          1HB       SER  30   1.567 -21.591  -3.349
  860   2HB   SER  30          2HB       SER  30  -0.170 -21.692  -3.646
  861    HG   SER  30           HG       SER  30   0.015 -23.944  -2.921
  862    H    SER  31           H        SER  31   0.809 -21.880  -7.307
  863    HA   SER  31           HA       SER  31   3.611 -21.204  -7.586
  864   1HB   SER  31          1HB       SER  31   1.644 -20.507  -9.702
  865   2HB   SER  31          2HB       SER  31   3.245 -21.239  -9.839
  866    HG   SER  31           HG       SER  31   2.282 -23.166  -8.906
  867    H    GLY  32           H        GLY  32   3.384 -19.573  -5.817
  868   1HA   GLY  32          1HA       GLY  32   2.795 -16.962  -7.039
  869   2HA   GLY  32          2HA       GLY  32   2.141 -17.330  -5.447
  870    H    LYS  33           H        LYS  33   5.184 -17.219  -7.254
  871    HA   LYS  33           HA       LYS  33   6.719 -17.112  -4.810
  872   1HB   LYS  33          1HB       LYS  33   8.669 -17.189  -6.249
  873   2HB   LYS  33          2HB       LYS  33   7.501 -18.400  -6.757
  874   1HG   LYS  33          1HG       LYS  33   6.721 -16.656  -8.464
  875   2HG   LYS  33          2HG       LYS  33   8.235 -15.826  -8.099
  876   1HD   LYS  33          1HD       LYS  33   8.940 -18.501  -8.483
  877   2HD   LYS  33          2HD       LYS  33   7.761 -18.148  -9.746
  878   1HE   LYS  33          1HE       LYS  33   9.693 -16.008  -9.401
  879   2HE   LYS  33          2HE       LYS  33  10.457 -17.545  -9.803
  880   1HZ   LYS  33          1HZ       LYS  33   8.902 -17.721 -11.694
  881   2HZ   LYS  33          2HZ       LYS  33   9.939 -16.381 -11.810
  882   3HZ   LYS  33          3HZ       LYS  33   8.323 -16.165 -11.342
  883    H    ILE  34           H        ILE  34   5.122 -14.811  -6.577
  884    HA   ILE  34           HA       ILE  34   6.872 -12.709  -5.496
  885    HB   ILE  34           HB       ILE  34   5.620 -11.414  -7.559
  886   1HG1  ILE  34          1HG1      ILE  34   6.745 -13.755  -8.993
  887   2HG1  ILE  34          2HG1      ILE  34   5.153 -13.968  -8.271
  888   1HG2  ILE  34          1HG2      ILE  34   8.194 -11.903  -6.698
  889   2HG2  ILE  34          2HG2      ILE  34   7.717 -10.810  -8.001
  890   3HG2  ILE  34          3HG2      ILE  34   8.203 -12.468  -8.370
  891   1HD1  ILE  34          1HD1      ILE  34   4.182 -12.768  -9.861
  892   2HD1  ILE  34          2HD1      ILE  34   5.711 -12.870 -10.735
  893   3HD1  ILE  34          3HD1      ILE  34   5.369 -11.470  -9.715
  894    H    LYS  35           H        LYS  35   5.891 -11.118  -4.423
  895    HA   LYS  35           HA       LYS  35   2.945 -11.055  -4.389
  896   1HB   LYS  35          1HB       LYS  35   4.755 -10.664  -1.995
  897   2HB   LYS  35          2HB       LYS  35   2.995 -10.698  -1.992
  898   1HG   LYS  35          1HG       LYS  35   4.402 -13.089  -3.031
  899   2HG   LYS  35          2HG       LYS  35   4.477 -12.786  -1.295
  900   1HD   LYS  35          1HD       LYS  35   2.355 -13.399  -0.995
  901   2HD   LYS  35          2HD       LYS  35   1.796 -12.455  -2.378
  902   1HE   LYS  35          1HE       LYS  35   1.300 -14.654  -2.965
  903   2HE   LYS  35          2HE       LYS  35   2.812 -14.328  -3.808
  904   1HZ   LYS  35          1HZ       LYS  35   2.288 -16.095  -1.535
  905   2HZ   LYS  35          2HZ       LYS  35   3.796 -15.319  -1.588
  906   3HZ   LYS  35          3HZ       LYS  35   3.311 -16.316  -2.870
  907    H    ARG  36           H        ARG  36   2.123  -9.056  -4.708
  908    HA   ARG  36           HA       ARG  36   4.085  -6.895  -4.981
  909   1HB   ARG  36          1HB       ARG  36   2.445  -5.835  -6.460
  910   2HB   ARG  36          2HB       ARG  36   2.827  -7.469  -6.984
  911   1HG   ARG  36          1HG       ARG  36   0.545  -7.433  -5.212
  912   2HG   ARG  36          2HG       ARG  36   0.312  -6.377  -6.606
  913   1HD   ARG  36          1HD       ARG  36   0.677  -8.145  -8.129
  914   2HD   ARG  36          2HD       ARG  36   1.304  -9.200  -6.864
  915    HE   ARG  36           HE       ARG  36  -1.387  -8.415  -6.333
  916   1HH1  ARG  36          1HH1      ARG  36   0.615 -10.670  -8.114
  917   2HH1  ARG  36          2HH1      ARG  36  -0.683 -11.801  -8.394
  918   1HH2  ARG  36          1HH2      ARG  36  -3.085  -9.935  -6.647
  919   2HH2  ARG  36          2HH2      ARG  36  -2.771 -11.391  -7.535
  920    H    VAL  37           H        VAL  37   3.826  -4.883  -4.153
  921    HA   VAL  37           HA       VAL  37   1.547  -4.370  -2.367
  922    HB   VAL  37           HB       VAL  37   4.334  -3.529  -1.580
  923   1HG1  VAL  37          1HG1      VAL  37   3.410  -3.018   0.509
  924   2HG1  VAL  37          2HG1      VAL  37   1.969  -3.988   0.210
  925   3HG1  VAL  37          3HG1      VAL  37   2.198  -2.464  -0.645
  926   1HG2  VAL  37          1HG2      VAL  37   3.197  -5.746  -0.052
  927   2HG2  VAL  37          2HG2      VAL  37   4.847  -5.487  -0.620
  928   3HG2  VAL  37          3HG2      VAL  37   3.636  -6.168  -1.706
  929    H    ASN  38           H        ASN  38   0.858  -2.253  -2.370
  930    HA   ASN  38           HA       ASN  38   2.254  -0.451  -4.250
  931   1HB   ASN  38          1HB       ASN  38   0.074  -0.835  -5.115
  932   2HB   ASN  38          2HB       ASN  38  -0.667  -0.687  -3.527
  933   1HD2  ASN  38          1HD2      ASN  38  -1.355   1.253  -2.857
  934   2HD2  ASN  38          2HD2      ASN  38  -1.140   2.736  -3.727
  935    H    VAL  39           H        VAL  39   3.039   1.418  -3.495
  936    HA   VAL  39           HA       VAL  39   2.470   2.063  -0.679
  937    HB   VAL  39           HB       VAL  39   4.826   3.356  -1.811
  938   1HG1  VAL  39          1HG1      VAL  39   4.124   3.175   0.603
  939   2HG1  VAL  39          2HG1      VAL  39   5.801   2.758   0.261
  940   3HG1  VAL  39          3HG1      VAL  39   4.612   1.485   0.532
  941   1HG2  VAL  39          1HG2      VAL  39   6.196   1.229  -1.701
  942   2HG2  VAL  39          2HG2      VAL  39   5.166   1.419  -3.120
  943   3HG2  VAL  39          3HG2      VAL  39   4.667   0.352  -1.807
  944    H    ASN  40           H        ASN  40   2.562   4.311  -0.065
  945    HA   ASN  40           HA       ASN  40   1.498   6.101  -2.144
  946   1HB   ASN  40          1HB       ASN  40   0.104   5.609  -0.078
  947   2HB   ASN  40          2HB       ASN  40   1.329   6.459   0.857
  948   1HD2  ASN  40          1HD2      ASN  40  -1.503   6.741  -0.903
  949   2HD2  ASN  40          2HD2      ASN  40  -1.549   8.469  -1.037
  950    H    PHE  41           H        PHE  41   3.062   7.316  -2.971
  951    HA   PHE  41           HA       PHE  41   5.360   8.015  -1.289
  952   1HB   PHE  41          1HB       PHE  41   4.921   7.735  -4.242
  953   2HB   PHE  41          2HB       PHE  41   6.241   8.737  -3.659
  954    HD1  PHE  41           HD1      PHE  41   5.464   5.917  -1.564
  955    HD2  PHE  41           HD2      PHE  41   7.663   7.168  -4.982
  956    HE1  PHE  41           HE1      PHE  41   6.877   3.916  -1.382
  957    HE2  PHE  41           HE2      PHE  41   9.081   5.168  -4.808
  958    HZ   PHE  41           HZ       PHE  41   8.684   3.534  -3.012
  959    H    ASP  42           H        ASP  42   6.284  10.116  -1.434
  960    HA   ASP  42           HA       ASP  42   4.343  12.262  -1.647
  961   1HB   ASP  42          1HB       ASP  42   6.114  12.130   0.170
  962   2HB   ASP  42          2HB       ASP  42   7.304  12.479  -1.080
  963    H    GLU  43           H        GLU  43   5.094  14.261  -2.854
  964    HA   GLU  43           HA       GLU  43   5.547  13.708  -5.591
  965   1HB   GLU  43          1HB       GLU  43   4.854  15.951  -4.015
  966   2HB   GLU  43          2HB       GLU  43   6.312  16.389  -4.893
  967   1HG   GLU  43          1HG       GLU  43   3.775  15.337  -6.123
  968   2HG   GLU  43          2HG       GLU  43   4.293  17.023  -6.102
  969    H    GLU  44           H        GLU  44   7.591  14.818  -2.948
  970    HA   GLU  44           HA       GLU  44  10.003  15.181  -4.351
  971   1HB   GLU  44          1HB       GLU  44   9.384  15.744  -1.900
  972   2HB   GLU  44          2HB       GLU  44   9.852  14.083  -1.557
  973   1HG   GLU  44          1HG       GLU  44  11.710  15.504  -1.094
  974   2HG   GLU  44          2HG       GLU  44  12.078  14.561  -2.538
  975    H    LYS  45           H        LYS  45   8.605  12.367  -2.754
  976    HA   LYS  45           HA       LYS  45  10.731  10.614  -2.961
  977   1HB   LYS  45          1HB       LYS  45   7.780  10.287  -2.723
  978   2HB   LYS  45          2HB       LYS  45   8.752   8.865  -3.084
  979   1HG   LYS  45          1HG       LYS  45  10.168   9.577  -1.057
  980   2HG   LYS  45          2HG       LYS  45   8.792  10.601  -0.646
  981   1HD   LYS  45          1HD       LYS  45   7.416   8.812  -0.209
  982   2HD   LYS  45          2HD       LYS  45   8.300   7.732  -1.290
  983   1HE   LYS  45          1HE       LYS  45   9.257   6.886   0.527
  984   2HE   LYS  45          2HE       LYS  45  10.161   8.395   0.643
  985   1HZ   LYS  45          1HZ       LYS  45   9.212   8.549   2.650
  986   2HZ   LYS  45          2HZ       LYS  45   8.007   7.408   2.287
  987   3HZ   LYS  45          3HZ       LYS  45   7.808   9.023   1.817
  988    H    HIS  46           H        HIS  46   8.213  11.333  -5.320
  989    HA   HIS  46           HA       HIS  46   9.049   9.244  -7.099
  990   1HB   HIS  46          1HB       HIS  46   6.753  10.652  -6.885
  991   2HB   HIS  46          2HB       HIS  46   7.512  11.497  -8.230
  992    HD1  HIS  46           HD1      HIS  46   5.891  10.618  -9.996
  993    HD2  HIS  46           HD2      HIS  46   7.836   7.608  -7.875
  994    HE1  HIS  46           HE1      HIS  46   5.394   8.480 -11.234
  995    HE2  HIS  46           HE2      HIS  46   6.589   6.670  -9.947
  996    H    THR  47           H        THR  47   9.540  12.755  -6.983
  997    HA   THR  47           HA       THR  47  10.918  12.922  -9.441
  998    HB   THR  47           HB       THR  47  11.513  14.840  -7.226
  999    HG1  THR  47           HG1      THR  47   9.459  15.262  -6.967
 1000   1HG2  THR  47          1HG2      THR  47  12.437  15.098  -9.535
 1001   2HG2  THR  47          2HG2      THR  47  11.457  16.464  -8.996
 1002   3HG2  THR  47          3HG2      THR  47  10.784  15.281 -10.122
 1003    H    ARG  48           H        ARG  48  12.099  12.660  -6.075
 1004    HA   ARG  48           HA       ARG  48  14.850  12.677  -6.799
 1005   1HB   ARG  48          1HB       ARG  48  13.638  11.431  -4.336
 1006   2HB   ARG  48          2HB       ARG  48  15.307  11.927  -4.553
 1007   1HG   ARG  48          1HG       ARG  48  13.067  13.903  -4.743
 1008   2HG   ARG  48          2HG       ARG  48  13.770  13.444  -3.190
 1009   1HD   ARG  48          1HD       ARG  48  15.996  13.954  -4.679
 1010   2HD   ARG  48          2HD       ARG  48  14.852  15.132  -5.329
 1011    HE   ARG  48           HE       ARG  48  14.570  15.969  -3.059
 1012   1HH1  ARG  48          1HH1      ARG  48  17.389  14.004  -3.759
 1013   2HH1  ARG  48          2HH1      ARG  48  18.281  14.557  -2.368
 1014   1HH2  ARG  48          1HH2      ARG  48  15.728  16.690  -1.219
 1015   2HH2  ARG  48          2HH2      ARG  48  17.342  16.092  -0.931
 1016    H    PHE  49           H        PHE  49  12.423  10.149  -6.524
 1017    HA   PHE  49           HA       PHE  49  14.174   7.949  -6.562
 1018   1HB   PHE  49          1HB       PHE  49  11.477   8.194  -6.363
 1019   2HB   PHE  49          2HB       PHE  49  11.625   7.615  -8.018
 1020    HD1  PHE  49           HD1      PHE  49  14.344   6.461  -6.102
 1021    HD2  PHE  49           HD2      PHE  49  10.224   5.732  -6.881
 1022    HE1  PHE  49           HE1      PHE  49  14.597   4.158  -5.269
 1023    HE2  PHE  49           HE2      PHE  49  10.471   3.432  -6.047
 1024    HZ   PHE  49           HZ       PHE  49  12.686   2.639  -5.259
 1025    H    LYS  50           H        LYS  50  12.654   9.794  -9.167
 1026    HA   LYS  50           HA       LYS  50  13.626   8.241 -11.311
 1027   1HB   LYS  50          1HB       LYS  50  12.152  10.653 -10.978
 1028   2HB   LYS  50          2HB       LYS  50  13.475  10.980 -12.091
 1029   1HG   LYS  50          1HG       LYS  50  11.653  10.318 -13.420
 1030   2HG   LYS  50          2HG       LYS  50  12.737   8.927 -13.365
 1031   1HD   LYS  50          1HD       LYS  50  10.839   7.809 -12.866
 1032   2HD   LYS  50          2HD       LYS  50  11.179   8.394 -11.236
 1033   1HE   LYS  50          1HE       LYS  50   8.855   8.802 -11.825
 1034   2HE   LYS  50          2HE       LYS  50   9.722  10.324 -11.626
 1035   1HZ   LYS  50          1HZ       LYS  50   9.527  10.828 -13.807
 1036   2HZ   LYS  50          2HZ       LYS  50   8.167   9.821 -13.696
 1037   3HZ   LYS  50          3HZ       LYS  50   9.623   9.212 -14.322
 1038    H    ALA  51           H        ALA  51  14.949  11.038  -9.603
 1039    HA   ALA  51           HA       ALA  51  17.277  11.319 -11.201
 1040   1HB   ALA  51          1HB       ALA  51  16.470  13.132  -9.800
 1041   2HB   ALA  51          2HB       ALA  51  18.121  12.698  -9.354
 1042   3HB   ALA  51          3HB       ALA  51  16.770  12.171  -8.352
 1043    H    ALA  52           H        ALA  52  16.742   9.813  -8.015
 1044    HA   ALA  52           HA       ALA  52  19.337   8.887  -7.611
 1045   1HB   ALA  52          1HB       ALA  52  16.714   7.790  -6.614
 1046   2HB   ALA  52          2HB       ALA  52  17.785   8.928  -5.794
 1047   3HB   ALA  52          3HB       ALA  52  18.291   7.256  -6.039
 1048    H    CYS  53           H        CYS  53  16.623   7.323  -9.277
 1049    HA   CYS  53           HA       CYS  53  17.909   4.834  -9.657
 1050   1HB   CYS  53          1HB       CYS  53  15.702   6.167 -11.241
 1051   2HB   CYS  53          2HB       CYS  53  16.228   4.506 -11.494
 1052    HG   CYS  53           HG       CYS  53  14.593   5.812  -8.813
 1053    H    ALA  54           H        ALA  54  17.721   7.770 -11.634
 1054    HA   ALA  54           HA       ALA  54  19.122   6.757 -13.870
 1055   1HB   ALA  54          1HB       ALA  54  18.576   8.733 -14.718
 1056   2HB   ALA  54          2HB       ALA  54  19.587   9.564 -13.536
 1057   3HB   ALA  54          3HB       ALA  54  17.909   9.185 -13.150
 1058    H    ARG  55           H        ARG  55  20.150   8.406 -10.932
 1059    HA   ARG  55           HA       ARG  55  22.892   8.647 -11.620
 1060   1HB   ARG  55          1HB       ARG  55  21.476   9.756  -9.700
 1061   2HB   ARG  55          2HB       ARG  55  21.981   8.345  -8.783
 1062   1HG   ARG  55          1HG       ARG  55  24.359   9.090  -9.730
 1063   2HG   ARG  55          2HG       ARG  55  23.555  10.660  -9.727
 1064   1HD   ARG  55          1HD       ARG  55  24.149   8.837  -7.427
 1065   2HD   ARG  55          2HD       ARG  55  24.536  10.546  -7.620
 1066    HE   ARG  55           HE       ARG  55  21.902  10.692  -7.567
 1067   1HH1  ARG  55          1HH1      ARG  55  24.065   8.803  -5.544
 1068   2HH1  ARG  55          2HH1      ARG  55  22.973   8.779  -4.194
 1069   1HH2  ARG  55          1HH2      ARG  55  20.468  10.658  -5.783
 1070   2HH2  ARG  55          2HH2      ARG  55  20.940   9.824  -4.329
 1071    H    LYS  56           H        LYS  56  21.085   6.254  -9.713
 1072    HA   LYS  56           HA       LYS  56  23.334   4.640  -9.111
 1073   1HB   LYS  56          1HB       LYS  56  20.978   4.734  -8.007
 1074   2HB   LYS  56          2HB       LYS  56  20.532   3.564  -9.240
 1075   1HG   LYS  56          1HG       LYS  56  22.197   2.019  -8.439
 1076   2HG   LYS  56          2HG       LYS  56  22.789   3.213  -7.282
 1077   1HD   LYS  56          1HD       LYS  56  21.270   2.587  -5.792
 1078   2HD   LYS  56          2HD       LYS  56  19.967   2.868  -6.949
 1079   1HE   LYS  56          1HE       LYS  56  20.062   0.540  -6.066
 1080   2HE   LYS  56          2HE       LYS  56  20.172   0.648  -7.823
 1081   1HZ   LYS  56          1HZ       LYS  56  22.547   0.408  -6.050
 1082   2HZ   LYS  56          2HZ       LYS  56  22.495   0.251  -7.742
 1083   3HZ   LYS  56          3HZ       LYS  56  21.768  -0.923  -6.759
 1084    H    GLY  57           H        GLY  57  21.067   4.713 -11.774
 1085   1HA   GLY  57          1HA       GLY  57  21.271   3.756 -13.874
 1086   2HA   GLY  57          2HA       GLY  57  22.789   3.027 -13.361
 1087    H    THR  58           H        THR  58  19.295   2.800 -12.733
 1088    HA   THR  58           HA       THR  58  19.307  -0.037 -13.135
 1089    HB   THR  58           HB       THR  58  20.295   0.314 -10.808
 1090    HG1  THR  58           HG1      THR  58  18.838  -1.397  -9.947
 1091   1HG2  THR  58          1HG2      THR  58  17.837   1.775 -10.494
 1092   2HG2  THR  58          2HG2      THR  58  19.196   1.625  -9.380
 1093   3HG2  THR  58          3HG2      THR  58  17.896   0.435  -9.345
 1094    H    SER  59           H        SER  59  17.161  -0.987 -12.768
 1095    HA   SER  59           HA       SER  59  15.108   0.720 -13.782
 1096   1HB   SER  59          1HB       SER  59  13.932  -1.688 -13.021
 1097   2HB   SER  59          2HB       SER  59  14.596  -1.309 -14.615
 1098    HG   SER  59           HG       SER  59  15.617  -3.154 -13.919
 1099    H    ILE  60           H        ILE  60  13.009   1.046 -12.806
 1100    HA   ILE  60           HA       ILE  60  13.150   1.908 -10.127
 1101    HB   ILE  60           HB       ILE  60  11.525   2.620 -12.050
 1102   1HG1  ILE  60          1HG1      ILE  60   9.859   2.766  -9.734
 1103   2HG1  ILE  60          2HG1      ILE  60  11.539   2.907  -9.224
 1104   1HG2  ILE  60          1HG2      ILE  60   9.942   1.165 -12.586
 1105   2HG2  ILE  60          2HG2      ILE  60   9.245   1.408 -10.985
 1106   3HG2  ILE  60          3HG2      ILE  60  10.397   0.102 -11.255
 1107   1HD1  ILE  60          1HD1      ILE  60  10.377   5.063  -9.726
 1108   2HD1  ILE  60          2HD1      ILE  60  10.339   4.567 -11.420
 1109   3HD1  ILE  60          3HD1      ILE  60  11.887   4.798 -10.603
 1110    H    THR  61           H        THR  61  12.550  -1.186 -11.443
 1111    HA   THR  61           HA       THR  61  11.046  -2.227  -9.247
 1112    HB   THR  61           HB       THR  61  12.442  -4.290 -10.651
 1113    HG1  THR  61           HG1      THR  61  12.296  -3.692 -12.703
 1114   1HG2  THR  61          1HG2      THR  61  10.012  -3.992  -9.609
 1115   2HG2  THR  61          2HG2      THR  61  10.349  -5.164 -10.885
 1116   3HG2  THR  61          3HG2      THR  61   9.625  -3.607 -11.287
 1117    H    ASP  62           H        ASP  62  14.453  -2.276 -10.235
 1118    HA   ASP  62           HA       ASP  62  15.307  -4.005  -8.171
 1119   1HB   ASP  62          1HB       ASP  62  16.678  -3.832 -10.111
 1120   2HB   ASP  62          2HB       ASP  62  16.815  -2.085  -9.937
 1121    H    VAL  63           H        VAL  63  15.230  -0.468  -8.437
 1122    HA   VAL  63           HA       VAL  63  16.692   0.081  -6.115
 1123    HB   VAL  63           HB       VAL  63  15.017   2.169  -6.049
 1124   1HG1  VAL  63          1HG1      VAL  63  17.094   1.942  -8.206
 1125   2HG1  VAL  63          2HG1      VAL  63  17.494   2.076  -6.496
 1126   3HG1  VAL  63          3HG1      VAL  63  16.612   3.373  -7.297
 1127   1HG2  VAL  63          1HG2      VAL  63  15.005   1.670  -8.978
 1128   2HG2  VAL  63          2HG2      VAL  63  13.927   2.660  -7.991
 1129   3HG2  VAL  63          3HG2      VAL  63  13.762   0.903  -7.987
 1130    H    VAL  64           H        VAL  64  13.185  -0.351  -6.537
 1131    HA   VAL  64           HA       VAL  64  12.521   0.054  -3.831
 1132    HB   VAL  64           HB       VAL  64  11.046  -1.652  -5.845
 1133   1HG1  VAL  64          1HG1      VAL  64  10.413  -2.041  -3.485
 1134   2HG1  VAL  64          2HG1      VAL  64   9.110  -1.327  -4.439
 1135   3HG1  VAL  64          3HG1      VAL  64  10.044  -0.321  -3.328
 1136   1HG2  VAL  64          1HG2      VAL  64   9.598   0.483  -5.926
 1137   2HG2  VAL  64          2HG2      VAL  64  11.116   0.461  -6.824
 1138   3HG2  VAL  64          3HG2      VAL  64  11.023   1.292  -5.269
 1139    H    ASN  65           H        ASN  65  13.463  -2.807  -5.646
 1140    HA   ASN  65           HA       ASN  65  13.074  -4.684  -3.558
 1141   1HB   ASN  65          1HB       ASN  65  13.593  -4.978  -6.145
 1142   2HB   ASN  65          2HB       ASN  65  15.255  -5.055  -5.565
 1143   1HD2  ASN  65          1HD2      ASN  65  12.628  -6.842  -6.328
 1144   2HD2  ASN  65          2HD2      ASN  65  12.988  -8.279  -5.431
 1145    H    GLN  66           H        GLN  66  15.583  -2.400  -4.322
 1146    HA   GLN  66           HA       GLN  66  17.571  -3.566  -2.624
 1147   1HB   GLN  66          1HB       GLN  66  17.870  -1.995  -4.684
 1148   2HB   GLN  66          2HB       GLN  66  17.636  -0.706  -3.509
 1149   1HG   GLN  66          1HG       GLN  66  19.705  -0.911  -2.746
 1150   2HG   GLN  66          2HG       GLN  66  19.546  -2.655  -2.568
 1151   1HE2  GLN  66          1HE2      GLN  66  19.096  -3.365  -5.216
 1152   2HE2  GLN  66          2HE2      GLN  66  20.526  -3.032  -6.135
 1153    H    LEU  67           H        LEU  67  15.275  -0.850  -2.295
 1154    HA   LEU  67           HA       LEU  67  16.252  -0.043   0.244
 1155   1HB   LEU  67          1HB       LEU  67  13.548   0.556   0.310
 1156   2HB   LEU  67          2HB       LEU  67  14.851   1.624  -0.160
 1157    HG   LEU  67           HG       LEU  67  14.087   0.050  -2.424
 1158   1HD1  LEU  67          1HD1      LEU  67  11.920   0.765  -0.660
 1159   2HD1  LEU  67          2HD1      LEU  67  11.899  -0.192  -2.142
 1160   3HD1  LEU  67          3HD1      LEU  67  11.770   1.566  -2.226
 1161   1HD2  LEU  67          1HD2      LEU  67  13.229   2.678  -2.763
 1162   2HD2  LEU  67          2HD2      LEU  67  14.787   2.000  -3.239
 1163   3HD2  LEU  67          3HD2      LEU  67  14.609   2.789  -1.671
 1164    H    VAL  68           H        VAL  68  13.813  -2.347  -0.809
 1165    HA   VAL  68           HA       VAL  68  12.900  -3.149   1.753
 1166    HB   VAL  68           HB       VAL  68  13.001  -4.670  -0.861
 1167   1HG1  VAL  68          1HG1      VAL  68  11.974  -5.436   1.836
 1168   2HG1  VAL  68          2HG1      VAL  68  12.837  -6.410   0.642
 1169   3HG1  VAL  68          3HG1      VAL  68  11.137  -6.011   0.390
 1170   1HG2  VAL  68          1HG2      VAL  68  11.484  -2.971  -1.209
 1171   2HG2  VAL  68          2HG2      VAL  68  10.973  -2.941   0.481
 1172   3HG2  VAL  68          3HG2      VAL  68  10.445  -4.251  -0.575
 1173    H    ASP  69           H        ASP  69  15.447  -4.307  -0.392
 1174    HA   ASP  69           HA       ASP  69  16.368  -6.516   0.998
 1175   1HB   ASP  69          1HB       ASP  69  17.083  -5.410  -1.284
 1176   2HB   ASP  69          2HB       ASP  69  18.307  -4.623  -0.290
 1177    H    ASN  70           H        ASN  70  17.685  -3.237   1.140
 1178    HA   ASN  70           HA       ASN  70  19.482  -3.650   3.231
 1179   1HB   ASN  70          1HB       ASN  70  18.103  -1.221   2.138
 1180   2HB   ASN  70          2HB       ASN  70  19.124  -1.090   3.566
 1181   1HD2  ASN  70          1HD2      ASN  70  19.104  -2.179   0.210
 1182   2HD2  ASN  70          2HD2      ASN  70  20.789  -1.887  -0.084
 1183    H    TRP  71           H        TRP  71  16.178  -2.367   3.304
 1184    HA   TRP  71           HA       TRP  71  15.957  -1.917   6.044
 1185   1HB   TRP  71          1HB       TRP  71  14.318  -1.167   4.346
 1186   2HB   TRP  71          2HB       TRP  71  13.792  -2.834   4.140
 1187    HD1  TRP  71           HD1      TRP  71  13.766  -0.027   6.768
 1188    HE1  TRP  71           HE1      TRP  71  11.800  -0.442   8.376
 1189    HE3  TRP  71           HE3      TRP  71  12.245  -4.564   4.994
 1190    HZ2  TRP  71           HZ2      TRP  71   9.865  -2.448   8.829
 1191    HZ3  TRP  71           HZ3      TRP  71  10.328  -5.666   6.059
 1192    HH2  TRP  71           HH2      TRP  71   9.160  -4.629   7.947
 1193    H    LEU  72           H        LEU  72  15.179  -4.829   4.176
 1194    HA   LEU  72           HA       LEU  72  14.086  -6.412   6.132
 1195   1HB   LEU  72          1HB       LEU  72  15.150  -6.764   3.527
 1196   2HB   LEU  72          2HB       LEU  72  15.828  -8.027   4.537
 1197    HG   LEU  72           HG       LEU  72  13.723  -8.963   4.994
 1198   1HD1  LEU  72          1HD1      LEU  72  12.105  -7.518   5.529
 1199   2HD1  LEU  72          2HD1      LEU  72  11.734  -7.516   3.806
 1200   3HD1  LEU  72          3HD1      LEU  72  12.758  -6.252   4.490
 1201   1HD2  LEU  72          1HD2      LEU  72  14.506  -8.431   2.313
 1202   2HD2  LEU  72          2HD2      LEU  72  12.746  -8.420   2.398
 1203   3HD2  LEU  72          3HD2      LEU  72  13.646  -9.827   2.959
 1204    H    LYS  73           H        LYS  73  17.538  -6.169   5.295
 1205    HA   LYS  73           HA       LYS  73  18.279  -7.927   7.449
 1206   1HB   LYS  73          1HB       LYS  73  20.118  -6.149   5.857
 1207   2HB   LYS  73          2HB       LYS  73  20.532  -7.622   6.724
 1208   1HG   LYS  73          1HG       LYS  73  20.021  -8.899   4.980
 1209   2HG   LYS  73          2HG       LYS  73  18.471  -8.084   4.734
 1210   1HD   LYS  73          1HD       LYS  73  19.347  -6.577   3.258
 1211   2HD   LYS  73          2HD       LYS  73  20.957  -6.639   3.978
 1212   1HE   LYS  73          1HE       LYS  73  21.202  -8.936   3.043
 1213   2HE   LYS  73          2HE       LYS  73  19.675  -8.697   2.194
 1214   1HZ   LYS  73          1HZ       LYS  73  20.594  -7.220   0.756
 1215   2HZ   LYS  73          2HZ       LYS  73  21.979  -8.139   1.085
 1216   3HZ   LYS  73          3HZ       LYS  73  21.741  -6.657   1.870
 1217    H    GLU  74           H        GLU  74  18.175  -4.447   7.000
 1218    HA   GLU  74           HA       GLU  74  19.799  -3.920   9.301
 1219   1HB   GLU  74          1HB       GLU  74  18.131  -2.125   7.548
 1220   2HB   GLU  74          2HB       GLU  74  19.096  -1.535   8.892
 1221   1HG   GLU  74          1HG       GLU  74  20.001  -2.711   6.298
 1222   2HG   GLU  74          2HG       GLU  74  20.448  -1.179   7.046
 1223    H    ASN  75           H        ASN  75  16.339  -3.979   8.668
 1224    HA   ASN  75           HA       ASN  75  15.684  -2.704  11.152
 1225   1HB   ASN  75          1HB       ASN  75  13.599  -2.501  10.303
 1226   2HB   ASN  75          2HB       ASN  75  14.383  -2.941   8.788
 1227   1HD2  ASN  75          1HD2      ASN  75  14.191  -5.113   8.047
 1228   2HD2  ASN  75          2HD2      ASN  75  12.879  -6.111   8.573
 1229    H    GLU  76           H        GLU  76  15.984  -6.010  10.087
 1230    HA   GLU  76           HA       GLU  76  14.482  -7.033  12.320
 1231   1HB   GLU  76          1HB       GLU  76  15.639  -8.100   9.846
 1232   2HB   GLU  76          2HB       GLU  76  15.728  -9.205  11.210
 1233   1HG   GLU  76          1HG       GLU  76  13.132  -8.109  11.206
 1234   2HG   GLU  76          2HG       GLU  76  13.502  -8.578   9.549
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1 -76.379  42.196 -37.821
    2   2H    MET   1          2H        MET   1 -77.984  42.037 -38.342
    3   3H    MET   1          3H        MET   1 -76.721  42.032 -39.473
    4    HA   MET   1           HA       MET   1 -76.389  40.022 -37.469
    5   1HB   MET   1          1HB       MET   1 -78.880  40.148 -37.593
    6   2HB   MET   1          2HB       MET   1 -78.778  39.849 -39.323
    7   1HG   MET   1          1HG       MET   1 -77.767  37.667 -38.886
    8   2HG   MET   1          2HG       MET   1 -77.882  37.968 -37.152
    9   1HE   MET   1          1HE       MET   1 -80.273  36.057 -39.992
   10   2HE   MET   1          2HE       MET   1 -79.405  37.537 -40.414
   11   3HE   MET   1          3HE       MET   1 -81.155  37.572 -40.196
   12    H    SER   2           H        SER   2 -74.426  39.697 -38.466
   13    HA   SER   2           HA       SER   2 -74.409  39.200 -41.350
   14   1HB   SER   2          1HB       SER   2 -71.794  39.074 -40.558
   15   2HB   SER   2          2HB       SER   2 -72.610  40.551 -41.077
   16    HG   SER   2           HG       SER   2 -71.913  39.685 -38.502
   17    H    LEU   3           H        LEU   3 -72.803  37.437 -42.045
   18    HA   LEU   3           HA       LEU   3 -73.612  34.973 -40.765
   19   1HB   LEU   3          1HB       LEU   3 -72.508  35.785 -43.334
   20   2HB   LEU   3          2HB       LEU   3 -71.726  34.348 -42.707
   21    HG   LEU   3           HG       LEU   3 -73.775  34.089 -44.262
   22   1HD1  LEU   3          1HD1      LEU   3 -72.858  32.161 -43.298
   23   2HD1  LEU   3          2HD1      LEU   3 -74.565  32.120 -42.853
   24   3HD1  LEU   3          3HD1      LEU   3 -73.358  32.632 -41.674
   25   1HD2  LEU   3          1HD2      LEU   3 -74.994  35.164 -41.780
   26   2HD2  LEU   3          2HD2      LEU   3 -75.832  33.848 -42.599
   27   3HD2  LEU   3          3HD2      LEU   3 -75.493  35.349 -43.462
   28    H    GLU   4           H        GLU   4 -72.568  35.409 -38.740
   29    HA   GLU   4           HA       GLU   4 -69.857  35.907 -38.418
   30   1HB   GLU   4          1HB       GLU   4 -71.759  34.468 -36.559
   31   2HB   GLU   4          2HB       GLU   4 -70.178  35.082 -36.097
   32   1HG   GLU   4          1HG       GLU   4 -72.553  36.692 -37.000
   33   2HG   GLU   4          2HG       GLU   4 -71.855  36.629 -35.383
   34    H    LYS   5           H        LYS   5 -68.220  34.744 -39.083
   35    HA   LYS   5           HA       LYS   5 -68.457  31.820 -39.182
   36   1HB   LYS   5          1HB       LYS   5 -66.448  33.679 -40.465
   37   2HB   LYS   5          2HB       LYS   5 -66.440  31.928 -40.627
   38   1HG   LYS   5          1HG       LYS   5 -68.897  32.328 -41.476
   39   2HG   LYS   5          2HG       LYS   5 -68.269  33.938 -41.828
   40   1HD   LYS   5          1HD       LYS   5 -66.284  32.406 -42.832
   41   2HD   LYS   5          2HD       LYS   5 -67.670  31.348 -43.097
   42   1HE   LYS   5          1HE       LYS   5 -68.169  32.535 -44.910
   43   2HE   LYS   5          2HE       LYS   5 -68.499  33.916 -43.864
   44   1HZ   LYS   5          1HZ       LYS   5 -65.735  33.741 -44.174
   45   2HZ   LYS   5          2HZ       LYS   5 -66.775  34.942 -44.764
   46   3HZ   LYS   5          3HZ       LYS   5 -66.414  33.588 -45.721
   47    H    ALA   6           H        ALA   6 -66.121  34.338 -38.272
   48    HA   ALA   6           HA       ALA   6 -64.544  34.480 -36.656
   49   1HB   ALA   6          1HB       ALA   6 -65.368  34.008 -34.657
   50   2HB   ALA   6          2HB       ALA   6 -65.175  32.277 -34.948
   51   3HB   ALA   6          3HB       ALA   6 -66.662  33.093 -35.435
   52    H    HIS   7           H        HIS   7 -63.016  32.767 -35.255
   53    HA   HIS   7           HA       HIS   7 -62.213  30.583 -37.009
   54   1HB   HIS   7          1HB       HIS   7 -60.868  33.107 -37.001
   55   2HB   HIS   7          2HB       HIS   7 -59.803  31.908 -36.273
   56    HD1  HIS   7           HD1      HIS   7 -58.418  32.500 -38.586
   57    HD2  HIS   7           HD2      HIS   7 -61.897  30.240 -38.947
   58    HE1  HIS   7           HE1      HIS   7 -58.279  31.384 -40.838
   59    HE2  HIS   7           HE2      HIS   7 -60.407  30.051 -41.059
   60    H    THR   8           H        THR   8 -63.342  29.916 -34.861
   61    HA   THR   8           HA       THR   8 -61.746  29.999 -32.492
   62    HB   THR   8           HB       THR   8 -63.654  28.024 -32.108
   63    HG1  THR   8           HG1      THR   8 -65.076  28.288 -33.652
   64   1HG2  THR   8          1HG2      THR   8 -63.236  29.805 -30.544
   65   2HG2  THR   8          2HG2      THR   8 -64.941  29.855 -30.995
   66   3HG2  THR   8          3HG2      THR   8 -63.809  31.013 -31.694
   67    H    SER   9           H        SER   9 -59.937  29.026 -33.993
   68    HA   SER   9           HA       SER   9 -59.634  26.279 -33.105
   69   1HB   SER   9          1HB       SER   9 -58.583  26.277 -35.735
   70   2HB   SER   9          2HB       SER   9 -59.947  25.340 -35.121
   71    HG   SER   9           HG       SER   9 -61.348  26.921 -35.790
   72    H    VAL  10           H        VAL  10 -57.949  26.721 -31.813
   73    HA   VAL  10           HA       VAL  10 -55.494  27.734 -33.054
   74    HB   VAL  10           HB       VAL  10 -55.163  28.930 -30.708
   75   1HG1  VAL  10          1HG1      VAL  10 -56.395  29.866 -33.235
   76   2HG1  VAL  10          2HG1      VAL  10 -54.876  30.333 -32.473
   77   3HG1  VAL  10          3HG1      VAL  10 -56.401  30.970 -31.861
   78   1HG2  VAL  10          1HG2      VAL  10 -57.727  28.092 -30.345
   79   2HG2  VAL  10          2HG2      VAL  10 -57.970  29.735 -30.941
   80   3HG2  VAL  10          3HG2      VAL  10 -56.983  29.454 -29.506
   81    H    LYS  11           H        LYS  11 -54.034  27.811 -30.581
   82    HA   LYS  11           HA       LYS  11 -54.181  24.989 -29.756
   83   1HB   LYS  11          1HB       LYS  11 -51.906  26.513 -30.881
   84   2HB   LYS  11          2HB       LYS  11 -51.538  25.485 -29.502
   85   1HG   LYS  11          1HG       LYS  11 -51.298  23.848 -30.987
   86   2HG   LYS  11          2HG       LYS  11 -53.061  23.847 -31.088
   87   1HD   LYS  11          1HD       LYS  11 -51.940  25.914 -32.758
   88   2HD   LYS  11          2HD       LYS  11 -51.241  24.343 -33.153
   89   1HE   LYS  11          1HE       LYS  11 -54.101  25.225 -33.276
   90   2HE   LYS  11          2HE       LYS  11 -53.113  24.463 -34.522
   91   1HZ   LYS  11          1HZ       LYS  11 -54.286  23.190 -32.115
   92   2HZ   LYS  11          2HZ       LYS  11 -53.099  22.442 -33.065
   93   3HZ   LYS  11          3HZ       LYS  11 -54.603  22.830 -33.742
   94    H    LYS  12           H        LYS  12 -55.495  26.239 -28.091
   95    HA   LYS  12           HA       LYS  12 -53.993  27.781 -26.176
   96   1HB   LYS  12          1HB       LYS  12 -56.694  27.494 -26.820
   97   2HB   LYS  12          2HB       LYS  12 -56.544  26.798 -25.211
   98   1HG   LYS  12          1HG       LYS  12 -56.926  28.944 -24.620
   99   2HG   LYS  12          2HG       LYS  12 -55.174  29.037 -24.794
  100   1HD   LYS  12          1HD       LYS  12 -56.949  29.588 -27.144
  101   2HD   LYS  12          2HD       LYS  12 -56.679  30.835 -25.924
  102   1HE   LYS  12          1HE       LYS  12 -54.307  29.430 -27.033
  103   2HE   LYS  12          2HE       LYS  12 -55.134  30.594 -28.065
  104   1HZ   LYS  12          1HZ       LYS  12 -53.969  31.116 -25.384
  105   2HZ   LYS  12          2HZ       LYS  12 -54.886  32.239 -26.264
  106   3HZ   LYS  12          3HZ       LYS  12 -53.400  31.696 -26.871
  107    H    MET  13           H        MET  13 -53.724  27.200 -23.958
  108    HA   MET  13           HA       MET  13 -52.993  25.871 -22.286
  109   1HB   MET  13          1HB       MET  13 -55.341  24.806 -22.740
  110   2HB   MET  13          2HB       MET  13 -54.406  23.485 -23.420
  111   1HG   MET  13          1HG       MET  13 -55.126  23.773 -20.790
  112   2HG   MET  13          2HG       MET  13 -53.876  22.698 -21.411
  113   1HE   MET  13          1HE       MET  13 -52.149  22.651 -19.276
  114   2HE   MET  13          2HE       MET  13 -50.830  23.740 -19.708
  115   3HE   MET  13          3HE       MET  13 -51.596  22.750 -20.949
  116    H    THR  14           H        THR  14 -51.276  26.269 -24.325
  117    HA   THR  14           HA       THR  14 -50.128  23.731 -25.137
  118    HB   THR  14           HB       THR  14 -48.341  25.809 -25.735
  119    HG1  THR  14           HG1      THR  14 -50.898  26.563 -26.676
  120   1HG2  THR  14          1HG2      THR  14 -48.968  25.339 -28.047
  121   2HG2  THR  14          2HG2      THR  14 -50.413  24.494 -27.489
  122   3HG2  THR  14          3HG2      THR  14 -48.817  23.843 -27.126
  123    H    PHE  15           H        PHE  15 -48.243  22.861 -24.381
  124    HA   PHE  15           HA       PHE  15 -47.524  23.438 -21.711
  125   1HB   PHE  15          1HB       PHE  15 -47.310  21.191 -22.529
  126   2HB   PHE  15          2HB       PHE  15 -46.246  21.704 -23.833
  127    HD1  PHE  15           HD1      PHE  15 -44.101  20.984 -23.569
  128    HD2  PHE  15           HD2      PHE  15 -46.306  22.138 -20.118
  129    HE1  PHE  15           HE1      PHE  15 -42.146  20.487 -22.162
  130    HE2  PHE  15           HE2      PHE  15 -44.359  21.641 -18.702
  131    HZ   PHE  15           HZ       PHE  15 -42.275  20.816 -19.724
  132    H    GLY  16           H        GLY  16 -45.598  23.734 -24.713
  133   1HA   GLY  16          1HA       GLY  16 -44.156  25.530 -25.250
  134   2HA   GLY  16          2HA       GLY  16 -44.283  26.104 -23.591
  135    H    GLU  17           H        GLU  17 -42.409  24.416 -25.811
  136    HA   GLU  17           HA       GLU  17 -41.016  22.724 -23.954
  137   1HB   GLU  17          1HB       GLU  17 -41.192  23.024 -26.785
  138   2HB   GLU  17          2HB       GLU  17 -39.496  23.109 -26.326
  139   1HG   GLU  17          1HG       GLU  17 -40.717  20.976 -24.900
  140   2HG   GLU  17          2HG       GLU  17 -41.127  20.831 -26.609
  141    H    ASN  18           H        ASN  18 -40.742  24.794 -22.594
  142    HA   ASN  18           HA       ASN  18 -38.729  26.668 -23.234
  143   1HB   ASN  18          1HB       ASN  18 -40.236  27.262 -21.506
  144   2HB   ASN  18          2HB       ASN  18 -39.971  25.750 -20.648
  145   1HD2  ASN  18          1HD2      ASN  18 -39.078  26.209 -18.772
  146   2HD2  ASN  18          2HD2      ASN  18 -37.749  27.289 -18.516
  147    H    ARG  19           H        ARG  19 -38.700  23.666 -21.396
  148    HA   ARG  19           HA       ARG  19 -37.066  22.225 -20.788
  149   1HB   ARG  19          1HB       ARG  19 -36.676  22.819 -23.445
  150   2HB   ARG  19          2HB       ARG  19 -35.084  23.102 -22.756
  151   1HG   ARG  19          1HG       ARG  19 -35.214  20.824 -21.728
  152   2HG   ARG  19          2HG       ARG  19 -36.687  20.558 -22.664
  153   1HD   ARG  19          1HD       ARG  19 -34.126  21.422 -23.962
  154   2HD   ARG  19          2HD       ARG  19 -34.464  19.724 -23.635
  155    HE   ARG  19           HE       ARG  19 -36.685  20.532 -24.960
  156   1HH1  ARG  19          1HH1      ARG  19 -33.253  20.790 -25.654
  157   2HH1  ARG  19          2HH1      ARG  19 -33.473  20.745 -27.383
  158   1HH2  ARG  19          1HH2      ARG  19 -36.975  20.449 -27.212
  159   2HH2  ARG  19          2HH2      ARG  19 -35.585  20.500 -28.268
  160    H    ASP  20           H        ASP  20 -36.732  23.334 -18.819
  161    HA   ASP  20           HA       ASP  20 -34.123  24.711 -18.693
  162   1HB   ASP  20          1HB       ASP  20 -36.233  25.983 -17.928
  163   2HB   ASP  20          2HB       ASP  20 -36.241  24.881 -16.555
  164    H    LEU  21           H        LEU  21 -33.319  22.464 -18.771
  165    HA   LEU  21           HA       LEU  21 -33.211  21.332 -16.066
  166   1HB   LEU  21          1HB       LEU  21 -34.456  20.147 -18.346
  167   2HB   LEU  21          2HB       LEU  21 -33.027  19.212 -17.955
  168    HG   LEU  21           HG       LEU  21 -34.060  19.362 -15.503
  169   1HD1  LEU  21          1HD1      LEU  21 -36.000  20.707 -16.718
  170   2HD1  LEU  21          2HD1      LEU  21 -36.304  19.644 -15.347
  171   3HD1  LEU  21          3HD1      LEU  21 -36.606  19.075 -16.988
  172   1HD2  LEU  21          1HD2      LEU  21 -34.526  17.155 -15.744
  173   2HD2  LEU  21          2HD2      LEU  21 -33.631  17.403 -17.244
  174   3HD2  LEU  21          3HD2      LEU  21 -35.395  17.385 -17.259
  175    H    GLU  22           H        GLU  22 -31.174  22.539 -16.100
  176    HA   GLU  22           HA       GLU  22 -29.050  20.968 -17.397
  177   1HB   GLU  22          1HB       GLU  22 -29.571  23.882 -17.570
  178   2HB   GLU  22          2HB       GLU  22 -27.895  23.402 -17.339
  179   1HG   GLU  22          1HG       GLU  22 -28.299  21.813 -19.316
  180   2HG   GLU  22          2HG       GLU  22 -29.726  22.802 -19.625
  181    H    ARG  23           H        ARG  23 -27.172  20.714 -16.204
  182    HA   ARG  23           HA       ARG  23 -27.053  21.971 -13.562
  183   1HB   ARG  23          1HB       ARG  23 -27.907  19.321 -13.948
  184   2HB   ARG  23          2HB       ARG  23 -26.252  19.205 -13.367
  185   1HG   ARG  23          1HG       ARG  23 -27.876  21.123 -11.884
  186   2HG   ARG  23          2HG       ARG  23 -28.475  19.465 -11.801
  187   1HD   ARG  23          1HD       ARG  23 -25.564  19.963 -11.393
  188   2HD   ARG  23          2HD       ARG  23 -26.682  20.359 -10.089
  189    HE   ARG  23           HE       ARG  23 -26.003  17.716 -11.091
  190   1HH1  ARG  23          1HH1      ARG  23 -28.049  19.665  -9.010
  191   2HH1  ARG  23          2HH1      ARG  23 -28.606  18.298  -8.085
  192   1HH2  ARG  23          1HH2      ARG  23 -26.690  15.945  -9.833
  193   2HH2  ARG  23          2HH2      ARG  23 -27.817  16.203  -8.531
  194    H    VAL  24           H        VAL  24 -25.169  22.967 -13.542
  195    HA   VAL  24           HA       VAL  24 -22.930  22.132 -15.135
  196    HB   VAL  24           HB       VAL  24 -22.933  24.177 -12.908
  197   1HG1  VAL  24          1HG1      VAL  24 -20.763  24.311 -13.365
  198   2HG1  VAL  24          2HG1      VAL  24 -21.193  24.913 -14.966
  199   3HG1  VAL  24          3HG1      VAL  24 -20.924  23.189 -14.714
  200   1HG2  VAL  24          1HG2      VAL  24 -24.554  25.056 -14.283
  201   2HG2  VAL  24          2HG2      VAL  24 -23.856  24.344 -15.739
  202   3HG2  VAL  24          3HG2      VAL  24 -23.095  25.748 -14.990
  203    H    VAL  25           H        VAL  25 -21.524  20.611 -14.616
  204    HA   VAL  25           HA       VAL  25 -21.423  19.558 -11.920
  205    HB   VAL  25           HB       VAL  25 -19.629  18.699 -14.181
  206   1HG1  VAL  25          1HG1      VAL  25 -19.414  17.948 -11.701
  207   2HG1  VAL  25          2HG1      VAL  25 -19.315  16.743 -12.985
  208   3HG1  VAL  25          3HG1      VAL  25 -20.809  16.936 -12.072
  209   1HG2  VAL  25          1HG2      VAL  25 -21.779  18.574 -15.166
  210   2HG2  VAL  25          2HG2      VAL  25 -22.497  17.930 -13.690
  211   3HG2  VAL  25          3HG2      VAL  25 -21.385  16.942 -14.632
  212    H    THR  26           H        THR  26 -20.365  20.837 -10.530
  213    HA   THR  26           HA       THR  26 -17.852  22.093 -11.335
  214    HB   THR  26           HB       THR  26 -18.619  22.662  -8.618
  215    HG1  THR  26           HG1      THR  26 -20.604  23.731 -10.210
  216   1HG2  THR  26          1HG2      THR  26 -18.523  24.938  -9.368
  217   2HG2  THR  26          2HG2      THR  26 -18.702  24.446 -11.054
  218   3HG2  THR  26          3HG2      THR  26 -17.227  24.053 -10.169
  219    H    ALA  27           H        ALA  27 -17.410  19.478 -11.209
  220    HA   ALA  27           HA       ALA  27 -16.687  18.503  -8.627
  221   1HB   ALA  27          1HB       ALA  27 -15.290  17.221 -10.816
  222   2HB   ALA  27          2HB       ALA  27 -17.013  17.395 -11.148
  223   3HB   ALA  27          3HB       ALA  27 -16.477  16.558  -9.692
  224    HA   PRO  28           HA       PRO  28 -12.844  20.756  -8.440
  225   1HB   PRO  28          1HB       PRO  28 -11.978  19.760  -6.076
  226   2HB   PRO  28          2HB       PRO  28 -13.256  20.975  -6.186
  227   1HG   PRO  28          1HG       PRO  28 -13.477  18.020  -5.785
  228   2HG   PRO  28          2HG       PRO  28 -14.389  19.330  -5.010
  229   1HD   PRO  28          1HD       PRO  28 -15.367  17.839  -7.072
  230   2HD   PRO  28          2HD       PRO  28 -15.851  19.517  -6.769
  231    H    VAL  29           H        VAL  29 -10.726  20.357  -8.924
  232    HA   VAL  29           HA       VAL  29 -10.093  17.650  -9.784
  233    HB   VAL  29           HB       VAL  29  -8.425  20.160 -10.045
  234   1HG1  VAL  29          1HG1      VAL  29  -6.924  18.972 -11.244
  235   2HG1  VAL  29          2HG1      VAL  29  -8.162  17.952 -11.981
  236   3HG1  VAL  29          3HG1      VAL  29  -7.592  17.608 -10.348
  237   1HG2  VAL  29          1HG2      VAL  29  -9.469  20.685 -12.002
  238   2HG2  VAL  29          2HG2      VAL  29 -10.822  19.928 -11.164
  239   3HG2  VAL  29          3HG2      VAL  29  -9.898  19.012 -12.352
  240    H    SER  30           H        SER  30  -9.234  16.291  -8.372
  241    HA   SER  30           HA       SER  30  -7.940  17.161  -5.978
  242   1HB   SER  30          1HB       SER  30  -7.531  14.357  -6.728
  243   2HB   SER  30          2HB       SER  30  -8.294  15.035  -5.291
  244    HG   SER  30           HG       SER  30  -9.426  14.083  -7.594
  245    H    SER  31           H        SER  31  -5.855  17.579  -5.657
  246    HA   SER  31           HA       SER  31  -4.023  17.600  -7.806
  247   1HB   SER  31          1HB       SER  31  -2.591  17.765  -5.366
  248   2HB   SER  31          2HB       SER  31  -3.084  19.087  -6.423
  249    HG   SER  31           HG       SER  31  -4.335  18.070  -4.116
  250    H    GLY  32           H        GLY  32  -2.151  16.378  -8.149
  251   1HA   GLY  32          1HA       GLY  32  -2.197  13.729  -6.841
  252   2HA   GLY  32          2HA       GLY  32  -1.725  13.988  -8.514
  253    H    LYS  33           H        LYS  33  -0.850  15.114  -5.243
  254    HA   LYS  33           HA       LYS  33   1.878  15.566  -6.113
  255   1HB   LYS  33          1HB       LYS  33   0.263  16.202  -3.713
  256   2HB   LYS  33          2HB       LYS  33   1.988  15.974  -3.451
  257   1HG   LYS  33          1HG       LYS  33   0.714  17.926  -5.356
  258   2HG   LYS  33          2HG       LYS  33   1.494  18.309  -3.819
  259   1HD   LYS  33          1HD       LYS  33   3.621  17.468  -4.692
  260   2HD   LYS  33          2HD       LYS  33   2.839  17.080  -6.225
  261   1HE   LYS  33          1HE       LYS  33   3.792  19.125  -6.692
  262   2HE   LYS  33          2HE       LYS  33   2.163  19.593  -6.201
  263   1HZ   LYS  33          1HZ       LYS  33   3.605  21.027  -5.070
  264   2HZ   LYS  33          2HZ       LYS  33   4.667  19.776  -4.634
  265   3HZ   LYS  33          3HZ       LYS  33   3.140  19.883  -3.906
  266    H    ILE  34           H        ILE  34   0.219  12.894  -5.314
  267    HA   ILE  34           HA       ILE  34   2.632  11.603  -4.253
  268    HB   ILE  34           HB       ILE  34   0.363  11.708  -2.828
  269   1HG1  ILE  34          1HG1      ILE  34   1.353   9.100  -2.350
  270   2HG1  ILE  34          2HG1      ILE  34   2.718  10.075  -2.888
  271   1HG2  ILE  34          1HG2      ILE  34  -1.281  10.425  -3.570
  272   2HG2  ILE  34          2HG2      ILE  34  -0.231   9.018  -3.435
  273   3HG2  ILE  34          3HG2      ILE  34  -0.301   9.923  -4.945
  274   1HD1  ILE  34          1HD1      ILE  34   2.752  11.287  -1.006
  275   2HD1  ILE  34          2HD1      ILE  34   1.877   9.911  -0.338
  276   3HD1  ILE  34          3HD1      ILE  34   0.994  11.339  -0.877
  277    H    LYS  35           H        LYS  35   3.059   9.501  -5.049
  278    HA   LYS  35           HA       LYS  35   1.762   8.922  -7.631
  279   1HB   LYS  35          1HB       LYS  35   4.651   8.362  -6.936
  280   2HB   LYS  35          2HB       LYS  35   3.888   8.258  -8.518
  281   1HG   LYS  35          1HG       LYS  35   3.690  10.902  -7.301
  282   2HG   LYS  35          2HG       LYS  35   5.348  10.371  -7.594
  283   1HD   LYS  35          1HD       LYS  35   4.800  11.396  -9.601
  284   2HD   LYS  35          2HD       LYS  35   4.444   9.700  -9.933
  285   1HE   LYS  35          1HE       LYS  35   2.647  11.099 -10.755
  286   2HE   LYS  35          2HE       LYS  35   2.082  10.102  -9.414
  287   1HZ   LYS  35          1HZ       LYS  35   3.095  12.744  -8.714
  288   2HZ   LYS  35          2HZ       LYS  35   1.762  11.890  -8.101
  289   3HZ   LYS  35          3HZ       LYS  35   1.632  12.711  -9.577
  290    H    ARG  36           H        ARG  36   1.113   6.857  -7.980
  291    HA   ARG  36           HA       ARG  36   1.529   4.975  -5.748
  292   1HB   ARG  36          1HB       ARG  36  -0.541   4.439  -7.812
  293   2HB   ARG  36          2HB       ARG  36  -0.574   4.123  -6.084
  294   1HG   ARG  36          1HG       ARG  36  -1.852   5.902  -5.813
  295   2HG   ARG  36          2HG       ARG  36  -0.533   6.920  -6.395
  296   1HD   ARG  36          1HD       ARG  36  -2.960   6.774  -7.572
  297   2HD   ARG  36          2HD       ARG  36  -1.478   7.204  -8.423
  298    HE   ARG  36           HE       ARG  36  -2.156   4.373  -8.344
  299   1HH1  ARG  36          1HH1      ARG  36  -2.312   7.387 -10.118
  300   2HH1  ARG  36          2HH1      ARG  36  -2.515   6.619 -11.670
  301   1HH2  ARG  36          1HH2      ARG  36  -2.400   3.349 -10.381
  302   2HH2  ARG  36          2HH2      ARG  36  -2.553   4.320 -11.816
  303    H    VAL  37           H        VAL  37   3.027   3.505  -6.118
  304    HA   VAL  37           HA       VAL  37   3.319   2.467  -8.860
  305    HB   VAL  37           HB       VAL  37   5.496   2.642  -6.768
  306   1HG1  VAL  37          1HG1      VAL  37   5.545   0.817  -8.591
  307   2HG1  VAL  37          2HG1      VAL  37   6.985   1.801  -8.341
  308   3HG1  VAL  37          3HG1      VAL  37   5.905   2.147  -9.693
  309   1HG2  VAL  37          1HG2      VAL  37   5.586   4.235  -9.269
  310   2HG2  VAL  37          2HG2      VAL  37   6.252   4.589  -7.674
  311   3HG2  VAL  37          3HG2      VAL  37   4.525   4.792  -7.977
  312    H    ASN  38           H        ASN  38   3.473   0.289  -9.153
  313    HA   ASN  38           HA       ASN  38   2.841  -1.367  -6.806
  314   1HB   ASN  38          1HB       ASN  38   1.120  -1.926  -8.190
  315   2HB   ASN  38          2HB       ASN  38   1.978  -1.414  -9.636
  316   1HD2  ASN  38          1HD2      ASN  38   1.287  -4.048  -7.492
  317   2HD2  ASN  38          2HD2      ASN  38   1.974  -5.295  -8.476
  318    H    VAL  39           H        VAL  39   4.342  -2.699  -6.084
  319    HA   VAL  39           HA       VAL  39   6.695  -3.185  -7.783
  320    HB   VAL  39           HB       VAL  39   6.955  -3.747  -4.911
  321   1HG1  VAL  39          1HG1      VAL  39   9.109  -3.378  -5.351
  322   2HG1  VAL  39          2HG1      VAL  39   8.775  -1.848  -6.159
  323   3HG1  VAL  39          3HG1      VAL  39   8.630  -3.363  -7.047
  324   1HG2  VAL  39          1HG2      VAL  39   6.462  -0.937  -5.883
  325   2HG2  VAL  39          2HG2      VAL  39   7.245  -1.327  -4.349
  326   3HG2  VAL  39          3HG2      VAL  39   5.577  -1.820  -4.637
  327    H    ASN  40           H        ASN  40   7.846  -5.228  -7.365
  328    HA   ASN  40           HA       ASN  40   6.008  -7.411  -6.654
  329   1HB   ASN  40          1HB       ASN  40   7.596  -8.796  -8.205
  330   2HB   ASN  40          2HB       ASN  40   6.324  -7.817  -8.927
  331   1HD2  ASN  40          1HD2      ASN  40   6.881  -5.913 -10.016
  332   2HD2  ASN  40          2HD2      ASN  40   8.502  -5.619 -10.564
  333    H    PHE  41           H        PHE  41   6.573  -8.239  -4.794
  334    HA   PHE  41           HA       PHE  41   9.379  -8.071  -3.926
  335   1HB   PHE  41          1HB       PHE  41   6.748  -8.142  -2.502
  336   2HB   PHE  41          2HB       PHE  41   8.161  -8.779  -1.676
  337    HD1  PHE  41           HD1      PHE  41   9.048  -6.148  -3.894
  338    HD2  PHE  41           HD2      PHE  41   7.425  -6.962  -0.046
  339    HE1  PHE  41           HE1      PHE  41   9.636  -3.869  -3.168
  340    HE2  PHE  41           HE2      PHE  41   8.000  -4.688   0.686
  341    HZ   PHE  41           HZ       PHE  41   9.098  -3.138  -0.875
  342    H    ASP  42           H        ASP  42  10.564  -9.866  -3.601
  343    HA   ASP  42           HA       ASP  42   9.649 -12.424  -4.395
  344   1HB   ASP  42          1HB       ASP  42  12.036 -11.736  -4.377
  345   2HB   ASP  42          2HB       ASP  42  12.004 -11.750  -2.620
  346    H    GLU  43           H        GLU  43   9.214 -14.277  -3.118
  347    HA   GLU  43           HA       GLU  43   7.444 -13.850  -1.038
  348   1HB   GLU  43          1HB       GLU  43   8.559 -16.114  -2.417
  349   2HB   GLU  43          2HB       GLU  43   8.415 -16.464  -0.699
  350   1HG   GLU  43          1HG       GLU  43   6.108 -15.217  -2.101
  351   2HG   GLU  43          2HG       GLU  43   6.440 -16.930  -2.359
  352    H    GLU  44           H        GLU  44  10.905 -14.442  -0.915
  353    HA   GLU  44           HA       GLU  44  11.156 -14.967   1.850
  354   1HB   GLU  44          1HB       GLU  44  12.919 -14.970  -0.137
  355   2HB   GLU  44          2HB       GLU  44  13.206 -13.324   0.431
  356   1HG   GLU  44          1HG       GLU  44  14.243 -14.012   2.298
  357   2HG   GLU  44          2HG       GLU  44  13.155 -15.381   2.527
  358    H    LYS  45           H        LYS  45  11.310 -11.982  -0.005
  359    HA   LYS  45           HA       LYS  45  11.781 -10.239   2.135
  360   1HB   LYS  45          1HB       LYS  45  10.371  -9.636  -0.471
  361   2HB   LYS  45          2HB       LYS  45  11.170  -8.472   0.585
  362   1HG   LYS  45          1HG       LYS  45  13.241 -10.040   0.174
  363   2HG   LYS  45          2HG       LYS  45  12.337 -10.458  -1.278
  364   1HD   LYS  45          1HD       LYS  45  12.866  -8.534  -2.263
  365   2HD   LYS  45          2HD       LYS  45  12.377  -7.603  -0.846
  366   1HE   LYS  45          1HE       LYS  45  14.503  -7.223  -0.342
  367   2HE   LYS  45          2HE       LYS  45  14.802  -8.956  -0.242
  368   1HZ   LYS  45          1HZ       LYS  45  14.750  -7.622  -2.871
  369   2HZ   LYS  45          2HZ       LYS  45  15.541  -9.049  -2.409
  370   3HZ   LYS  45          3HZ       LYS  45  16.147  -7.548  -1.909
  371    H    HIS  46           H        HIS  46   8.844 -11.640   0.875
  372    HA   HIS  46           HA       HIS  46   7.212  -9.800   2.399
  373   1HB   HIS  46          1HB       HIS  46   6.712 -11.152   0.097
  374   2HB   HIS  46          2HB       HIS  46   5.841 -12.130   1.279
  375    HD1  HIS  46           HD1      HIS  46   3.594 -11.297   1.969
  376    HD2  HIS  46           HD2      HIS  46   5.929  -8.302   0.244
  377    HE1  HIS  46           HE1      HIS  46   2.123  -9.255   1.857
  378    HE2  HIS  46           HE2      HIS  46   3.582  -7.432   0.910
  379    H    THR  47           H        THR  47   8.323 -13.112   2.684
  380    HA   THR  47           HA       THR  47   6.651 -13.833   4.874
  381    HB   THR  47           HB       THR  47   9.418 -14.908   4.299
  382    HG1  THR  47           HG1      THR  47   8.320 -15.237   2.411
  383   1HG2  THR  47          1HG2      THR  47   7.029 -16.251   5.561
  384   2HG2  THR  47          2HG2      THR  47   8.354 -15.523   6.471
  385   3HG2  THR  47          3HG2      THR  47   8.661 -16.901   5.413
  386    H    ARG  48           H        ARG  48   9.884 -12.445   4.587
  387    HA   ARG  48           HA       ARG  48  10.420 -12.162   7.357
  388   1HB   ARG  48          1HB       ARG  48  11.986 -11.863   5.287
  389   2HB   ARG  48          2HB       ARG  48  11.379 -10.212   5.296
  390   1HG   ARG  48          1HG       ARG  48  13.206  -9.921   6.586
  391   2HG   ARG  48          2HG       ARG  48  12.054 -10.367   7.848
  392   1HD   ARG  48          1HD       ARG  48  13.373 -12.059   8.402
  393   2HD   ARG  48          2HD       ARG  48  13.078 -12.767   6.814
  394    HE   ARG  48           HE       ARG  48  15.146 -12.027   6.104
  395   1HH1  ARG  48          1HH1      ARG  48  14.389 -10.787   9.289
  396   2HH1  ARG  48          2HH1      ARG  48  15.967 -10.093   9.541
  397   1HH2  ARG  48          1HH2      ARG  48  17.244 -11.161   6.451
  398   2HH2  ARG  48          2HH2      ARG  48  17.582 -10.305   7.924
  399    H    PHE  49           H        PHE  49   8.882 -10.116   4.932
  400    HA   PHE  49           HA       PHE  49   8.545  -7.774   6.335
  401   1HB   PHE  49          1HB       PHE  49   7.436  -8.972   4.000
  402   2HB   PHE  49          2HB       PHE  49   6.121  -8.268   4.929
  403    HD1  PHE  49           HD1      PHE  49   9.574  -6.986   4.828
  404    HD2  PHE  49           HD2      PHE  49   5.566  -6.497   3.487
  405    HE1  PHE  49           HE1      PHE  49  10.144  -4.761   3.950
  406    HE2  PHE  49           HE2      PHE  49   6.130  -4.281   2.590
  407    HZ   PHE  49           HZ       PHE  49   8.425  -3.403   2.832
  408    H    LYS  50           H        LYS  50   6.248 -10.495   6.202
  409    HA   LYS  50           HA       LYS  50   4.391  -9.488   8.002
  410   1HB   LYS  50          1HB       LYS  50   5.150 -12.394   7.666
  411   2HB   LYS  50          2HB       LYS  50   3.627 -11.776   8.291
  412   1HG   LYS  50          1HG       LYS  50   4.277 -10.750   5.644
  413   2HG   LYS  50          2HG       LYS  50   4.123 -12.506   5.694
  414   1HD   LYS  50          1HD       LYS  50   2.049 -10.901   7.088
  415   2HD   LYS  50          2HD       LYS  50   2.033 -10.902   5.322
  416   1HE   LYS  50          1HE       LYS  50   0.865 -12.798   5.478
  417   2HE   LYS  50          2HE       LYS  50   2.381 -13.561   5.951
  418   1HZ   LYS  50          1HZ       LYS  50   1.825 -13.489   8.180
  419   2HZ   LYS  50          2HZ       LYS  50   0.337 -13.853   7.451
  420   3HZ   LYS  50          3HZ       LYS  50   0.660 -12.271   7.971
  421    H    ALA  51           H        ALA  51   7.222 -11.554   8.671
  422    HA   ALA  51           HA       ALA  51   6.756 -11.727  11.456
  423   1HB   ALA  51          1HB       ALA  51   8.250 -13.162   9.890
  424   2HB   ALA  51          2HB       ALA  51   8.715 -12.928  11.575
  425   3HB   ALA  51          3HB       ALA  51   9.496 -11.983  10.308
  426    H    ALA  52           H        ALA  52   9.255  -9.857   9.721
  427    HA   ALA  52           HA       ALA  52  10.345  -8.578  11.947
  428   1HB   ALA  52          1HB       ALA  52  10.756  -8.574   9.189
  429   2HB   ALA  52          2HB       ALA  52  11.758  -7.823  10.430
  430   3HB   ALA  52          3HB       ALA  52  10.490  -6.890   9.636
  431    H    CYS  53           H        CYS  53   7.898  -7.318   9.659
  432    HA   CYS  53           HA       CYS  53   7.615  -4.853  10.979
  433   1HB   CYS  53          1HB       CYS  53   5.500  -6.140   9.271
  434   2HB   CYS  53          2HB       CYS  53   5.807  -4.421   9.511
  435    HG   CYS  53           HG       CYS  53   7.382  -6.624   7.508
  436    H    ALA  54           H        ALA  54   5.988  -7.953  11.455
  437    HA   ALA  54           HA       ALA  54   3.857  -6.995  13.040
  438   1HB   ALA  54          1HB       ALA  54   3.344  -9.159  13.398
  439   2HB   ALA  54          2HB       ALA  54   5.005  -9.599  13.791
  440   3HB   ALA  54          3HB       ALA  54   4.515  -9.427  12.107
  441    H    ARG  55           H        ARG  55   7.153  -7.975  13.843
  442    HA   ARG  55           HA       ARG  55   6.923  -7.684  16.651
  443   1HB   ARG  55          1HB       ARG  55   8.747  -8.938  15.654
  444   2HB   ARG  55          2HB       ARG  55   9.329  -7.498  14.829
  445   1HG   ARG  55          1HG       ARG  55   9.475  -6.563  17.288
  446   2HG   ARG  55          2HG       ARG  55   9.564  -8.282  17.684
  447   1HD   ARG  55          1HD       ARG  55  11.753  -8.092  17.291
  448   2HD   ARG  55          2HD       ARG  55  11.311  -8.060  15.584
  449    HE   ARG  55           HE       ARG  55  11.606  -5.586  17.176
  450   1HH1  ARG  55          1HH1      ARG  55  12.254  -7.502  14.314
  451   2HH1  ARG  55          2HH1      ARG  55  13.191  -6.259  13.527
  452   1HH2  ARG  55          1HH2      ARG  55  12.832  -3.935  16.145
  453   2HH2  ARG  55          2HH2      ARG  55  13.530  -4.235  14.577
  454    H    LYS  56           H        LYS  56   7.916  -5.466  14.081
  455    HA   LYS  56           HA       LYS  56   8.580  -3.352  15.889
  456   1HB   LYS  56          1HB       LYS  56   8.297  -3.550  12.904
  457   2HB   LYS  56          2HB       LYS  56   8.584  -2.003  13.689
  458   1HG   LYS  56          1HG       LYS  56  10.724  -2.516  14.231
  459   2HG   LYS  56          2HG       LYS  56  10.383  -4.241  14.401
  460   1HD   LYS  56          1HD       LYS  56  11.641  -4.193  12.466
  461   2HD   LYS  56          2HD       LYS  56   9.996  -4.143  11.830
  462   1HE   LYS  56          1HE       LYS  56  10.825  -2.411  10.641
  463   2HE   LYS  56          2HE       LYS  56  10.442  -1.518  12.113
  464   1HZ   LYS  56          1HZ       LYS  56  13.089  -2.744  11.599
  465   2HZ   LYS  56          2HZ       LYS  56  12.679  -1.637  12.820
  466   3HZ   LYS  56          3HZ       LYS  56  12.712  -1.135  11.199
  467    H    GLY  57           H        GLY  57   5.672  -4.426  14.420
  468   1HA   GLY  57          1HA       GLY  57   3.504  -3.663  14.808
  469   2HA   GLY  57          2HA       GLY  57   4.170  -2.280  15.671
  470    H    THR  58           H        THR  58   4.671  -3.513  12.384
  471    HA   THR  58           HA       THR  58   3.954  -0.834  11.381
  472    HB   THR  58           HB       THR  58   5.791  -2.693   9.913
  473    HG1  THR  58           HG1      THR  58   6.281  -1.382  12.301
  474   1HG2  THR  58          1HG2      THR  58   5.495   0.305  10.056
  475   2HG2  THR  58          2HG2      THR  58   5.039  -0.743   8.714
  476   3HG2  THR  58          3HG2      THR  58   6.738  -0.535   9.131
  477    H    SER  59           H        SER  59   2.393  -0.689   9.907
  478    HA   SER  59           HA       SER  59   0.972  -3.004   8.985
  479   1HB   SER  59          1HB       SER  59   0.548  -0.442   7.579
  480   2HB   SER  59          2HB       SER  59  -0.625  -1.520   8.336
  481    HG   SER  59           HG       SER  59   0.273  -0.702  10.393
  482    H    ILE  60           H        ILE  60   0.982  -3.928   6.974
  483    HA   ILE  60           HA       ILE  60   3.361  -4.243   5.716
  484    HB   ILE  60           HB       ILE  60   0.850  -5.319   5.418
  485   1HG1  ILE  60          1HG1      ILE  60   2.076  -6.848   3.752
  486   2HG1  ILE  60          2HG1      ILE  60   3.471  -5.809   4.027
  487   1HG2  ILE  60          1HG2      ILE  60   0.046  -5.160   3.283
  488   2HG2  ILE  60          2HG2      ILE  60   1.605  -4.679   2.611
  489   3HG2  ILE  60          3HG2      ILE  60   0.641  -3.517   3.527
  490   1HD1  ILE  60          1HD1      ILE  60   3.957  -7.181   5.707
  491   2HD1  ILE  60          2HD1      ILE  60   2.349  -7.907   5.687
  492   3HD1  ILE  60          3HD1      ILE  60   2.629  -6.409   6.574
  493    H    THR  61           H        THR  61   0.988  -1.754   4.916
  494    HA   THR  61           HA       THR  61   2.406  -0.937   2.536
  495    HB   THR  61           HB       THR  61   0.211   0.479   4.071
  496    HG1  THR  61           HG1      THR  61  -0.666  -0.361   1.744
  497   1HG2  THR  61          1HG2      THR  61   1.387   1.018   1.345
  498   2HG2  THR  61          2HG2      THR  61   1.436   2.081   2.749
  499   3HG2  THR  61          3HG2      THR  61  -0.099   1.745   1.951
  500    H    ASP  62           H        ASP  62   2.162   0.097   5.880
  501    HA   ASP  62           HA       ASP  62   3.586   2.510   5.697
  502   1HB   ASP  62          1HB       ASP  62   2.177   1.686   7.640
  503   2HB   ASP  62          2HB       ASP  62   3.558   0.699   8.107
  504    H    VAL  63           H        VAL  63   4.684  -0.818   6.003
  505    HA   VAL  63           HA       VAL  63   7.335  -0.323   6.774
  506    HB   VAL  63           HB       VAL  63   6.811  -2.505   4.810
  507   1HG1  VAL  63          1HG1      VAL  63   8.572  -3.527   5.822
  508   2HG1  VAL  63          2HG1      VAL  63   8.194  -2.855   7.408
  509   3HG1  VAL  63          3HG1      VAL  63   8.979  -1.850   6.191
  510   1HG2  VAL  63          1HG2      VAL  63   5.049  -2.118   6.898
  511   2HG2  VAL  63          2HG2      VAL  63   6.205  -3.290   7.533
  512   3HG2  VAL  63          3HG2      VAL  63   5.335  -3.630   6.034
  513    H    VAL  64           H        VAL  64   6.029  -0.837   3.500
  514    HA   VAL  64           HA       VAL  64   8.404  -0.373   2.122
  515    HB   VAL  64           HB       VAL  64   5.837   0.507   0.888
  516   1HG1  VAL  64          1HG1      VAL  64   7.185   0.427  -0.881
  517   2HG1  VAL  64          2HG1      VAL  64   7.171  -1.329  -0.723
  518   3HG1  VAL  64          3HG1      VAL  64   8.449  -0.386   0.043
  519   1HG2  VAL  64          1HG2      VAL  64   5.388  -1.548   2.306
  520   2HG2  VAL  64          2HG2      VAL  64   6.480  -2.412   1.223
  521   3HG2  VAL  64          3HG2      VAL  64   5.006  -1.680   0.588
  522    H    ASN  65           H        ASN  65   5.937   1.837   3.284
  523    HA   ASN  65           HA       ASN  65   6.925   4.190   2.061
  524   1HB   ASN  65          1HB       ASN  65   4.663   3.787   3.240
  525   2HB   ASN  65          2HB       ASN  65   5.532   4.137   4.732
  526   1HD2  ASN  65          1HD2      ASN  65   4.857   5.450   1.517
  527   2HD2  ASN  65          2HD2      ASN  65   4.852   7.110   2.004
  528    H    GLN  66           H        GLN  66   7.666   2.543   5.087
  529    HA   GLN  66           HA       GLN  66   9.341   4.542   6.184
  530   1HB   GLN  66          1HB       GLN  66   8.412   1.978   6.926
  531   2HB   GLN  66          2HB       GLN  66  10.169   1.920   6.993
  532   1HG   GLN  66          1HG       GLN  66  10.203   3.080   8.878
  533   2HG   GLN  66          2HG       GLN  66   9.175   4.334   8.198
  534   1HE2  GLN  66          1HE2      GLN  66   6.867   3.928   8.190
  535   2HE2  GLN  66          2HE2      GLN  66   6.167   2.996   9.471
  536    H    LEU  67           H        LEU  67  10.175   1.472   4.537
  537    HA   LEU  67           HA       LEU  67  12.935   1.972   4.588
  538   1HB   LEU  67          1HB       LEU  67  12.871   0.275   2.553
  539   2HB   LEU  67          2HB       LEU  67  12.655  -0.232   4.214
  540    HG   LEU  67           HG       LEU  67  10.076   0.344   3.319
  541   1HD1  LEU  67          1HD1      LEU  67  10.382  -1.517   1.343
  542   2HD1  LEU  67          2HD1      LEU  67  11.796  -0.490   1.110
  543   3HD1  LEU  67          3HD1      LEU  67  10.180   0.216   1.089
  544   1HD2  LEU  67          1HD2      LEU  67  10.137  -1.456   4.681
  545   2HD2  LEU  67          2HD2      LEU  67  11.689  -2.012   4.057
  546   3HD2  LEU  67          3HD2      LEU  67  10.209  -2.336   3.156
  547    H    VAL  68           H        VAL  68  10.503   2.801   2.151
  548    HA   VAL  68           HA       VAL  68  12.372   3.589   0.168
  549    HB   VAL  68           HB       VAL  68   9.916   3.204  -0.238
  550   1HG1  VAL  68          1HG1      VAL  68   8.472   4.352   0.976
  551   2HG1  VAL  68          2HG1      VAL  68   8.839   5.713  -0.083
  552   3HG1  VAL  68          3HG1      VAL  68   9.690   5.533   1.453
  553   1HG2  VAL  68          1HG2      VAL  68   9.780   4.847  -2.029
  554   2HG2  VAL  68          2HG2      VAL  68  11.392   4.137  -1.925
  555   3HG2  VAL  68          3HG2      VAL  68  11.098   5.755  -1.289
  556    H    ASP  69           H        ASP  69  10.877   5.239   2.873
  557    HA   ASP  69           HA       ASP  69  11.920   7.825   2.315
  558   1HB   ASP  69          1HB       ASP  69  10.130   6.921   4.097
  559   2HB   ASP  69          2HB       ASP  69  11.545   6.979   5.144
  560    H    ASN  70           H        ASN  70  13.045   5.103   4.245
  561    HA   ASN  70           HA       ASN  70  15.338   6.276   5.326
  562   1HB   ASN  70          1HB       ASN  70  14.125   3.949   5.743
  563   2HB   ASN  70          2HB       ASN  70  15.365   3.375   4.636
  564   1HD2  ASN  70          1HD2      ASN  70  14.880   2.932   7.530
  565   2HD2  ASN  70          2HD2      ASN  70  16.384   3.336   8.297
  566    H    TRP  71           H        TRP  71  15.168   4.003   2.577
  567    HA   TRP  71           HA       TRP  71  17.863   4.193   1.901
  568   1HB   TRP  71          1HB       TRP  71  16.340   2.392   1.117
  569   2HB   TRP  71          2HB       TRP  71  15.577   3.545   0.027
  570    HD1  TRP  71           HD1      TRP  71  18.968   1.789   0.580
  571    HE1  TRP  71           HE1      TRP  71  20.225   1.749  -1.667
  572    HE3  TRP  71           HE3      TRP  71  15.690   4.510  -2.256
  573    HZ2  TRP  71           HZ2      TRP  71  19.876   2.715  -4.275
  574    HZ3  TRP  71           HZ3      TRP  71  16.220   4.885  -4.627
  575    HH2  TRP  71           HH2      TRP  71  18.271   3.999  -5.619
  576    H    LEU  72           H        LEU  72  15.094   5.999   0.598
  577    HA   LEU  72           HA       LEU  72  16.536   7.294  -1.432
  578   1HB   LEU  72          1HB       LEU  72  13.898   7.222  -0.580
  579   2HB   LEU  72          2HB       LEU  72  14.363   8.898  -0.378
  580    HG   LEU  72           HG       LEU  72  14.266   9.299  -2.579
  581   1HD1  LEU  72          1HD1      LEU  72  16.179   7.150  -2.626
  582   2HD1  LEU  72          2HD1      LEU  72  16.016   8.534  -3.705
  583   3HD1  LEU  72          3HD1      LEU  72  15.107   7.059  -4.020
  584   1HD2  LEU  72          1HD2      LEU  72  13.209   6.955  -3.687
  585   2HD2  LEU  72          2HD2      LEU  72  12.326   8.367  -3.102
  586   3HD2  LEU  72          3HD2      LEU  72  12.636   7.008  -2.018
  587    H    LYS  73           H        LYS  73  15.969   8.191   1.930
  588    HA   LYS  73           HA       LYS  73  17.132  10.798   1.527
  589   1HB   LYS  73          1HB       LYS  73  16.113   9.367   3.973
  590   2HB   LYS  73          2HB       LYS  73  16.845  10.966   4.042
  591   1HG   LYS  73          1HG       LYS  73  15.119  11.795   2.477
  592   2HG   LYS  73          2HG       LYS  73  14.366  10.197   2.504
  593   1HD   LYS  73          1HD       LYS  73  13.613  10.445   4.664
  594   2HD   LYS  73          2HD       LYS  73  14.882  11.595   5.089
  595   1HE   LYS  73          1HE       LYS  73  13.430  13.242   4.754
  596   2HE   LYS  73          2HE       LYS  73  13.388  12.806   3.048
  597   1HZ   LYS  73          1HZ       LYS  73  11.664  11.074   3.812
  598   2HZ   LYS  73          2HZ       LYS  73  11.187  12.696   3.674
  599   3HZ   LYS  73          3HZ       LYS  73  11.524  12.043   5.198
  600    H    GLU  74           H        GLU  74  18.339   7.692   2.313
  601    HA   GLU  74           HA       GLU  74  20.739   8.801   3.559
  602   1HB   GLU  74          1HB       GLU  74  19.767   5.981   3.149
  603   2HB   GLU  74          2HB       GLU  74  21.383   6.344   3.736
  604   1HG   GLU  74          1HG       GLU  74  18.753   6.703   5.075
  605   2HG   GLU  74          2HG       GLU  74  20.246   6.003   5.693
  606    H    ASN  75           H        ASN  75  19.924   6.664   0.833
  607    HA   ASN  75           HA       ASN  75  22.557   6.647  -0.221
  608   1HB   ASN  75          1HB       ASN  75  21.770   4.961  -1.440
  609   2HB   ASN  75          2HB       ASN  75  20.213   5.209  -0.660
  610   1HD2  ASN  75          1HD2      ASN  75  18.592   6.259  -1.749
  611   2HD2  ASN  75          2HD2      ASN  75  18.642   6.500  -3.456
  612    H    GLU  76           H        GLU  76  19.824   8.744  -0.701
  613    HA   GLU  76           HA       GLU  76  21.339  10.171  -2.777
  614   1HB   GLU  76          1HB       GLU  76  18.615   9.268  -2.726
  615   2HB   GLU  76          2HB       GLU  76  18.639  11.025  -2.803
  616   1HG   GLU  76          1HG       GLU  76  20.411   9.518  -4.650
  617   2HG   GLU  76          2HG       GLU  76  18.677   9.530  -4.971
  618   1H    MET   1          1H        MET   1 -49.161 -55.991 -52.979
  619   2H    MET   1          2H        MET   1 -47.832 -56.725 -53.736
  620   3H    MET   1          3H        MET   1 -49.201 -57.646 -53.349
  621    HA   MET   1           HA       MET   1 -48.858 -55.633 -55.470
  622   1HB   MET   1          1HB       MET   1 -48.399 -58.090 -55.797
  623   2HB   MET   1          2HB       MET   1 -50.103 -58.386 -55.481
  624   1HG   MET   1          1HG       MET   1 -50.193 -56.471 -57.432
  625   2HG   MET   1          2HG       MET   1 -48.780 -57.422 -57.889
  626   1HE   MET   1          1HE       MET   1 -53.111 -58.183 -58.003
  627   2HE   MET   1          2HE       MET   1 -52.336 -57.670 -59.504
  628   3HE   MET   1          3HE       MET   1 -52.116 -56.728 -58.029
  629    H    SER   2           H        SER   2 -51.233 -57.138 -53.334
  630    HA   SER   2           HA       SER   2 -53.486 -56.092 -54.727
  631   1HB   SER   2          1HB       SER   2 -53.938 -56.755 -51.916
  632   2HB   SER   2          2HB       SER   2 -54.661 -57.446 -53.368
  633    HG   SER   2           HG       SER   2 -53.234 -58.844 -51.996
  634    H    LEU   3           H        LEU   3 -52.491 -55.386 -51.363
  635    HA   LEU   3           HA       LEU   3 -53.232 -52.578 -51.864
  636   1HB   LEU   3          1HB       LEU   3 -54.537 -54.357 -50.158
  637   2HB   LEU   3          2HB       LEU   3 -53.539 -53.379 -49.097
  638    HG   LEU   3           HG       LEU   3 -54.568 -51.335 -50.121
  639   1HD1  LEU   3          1HD1      LEU   3 -56.402 -51.459 -51.559
  640   2HD1  LEU   3          2HD1      LEU   3 -56.642 -53.179 -51.252
  641   3HD1  LEU   3          3HD1      LEU   3 -55.261 -52.639 -52.210
  642   1HD2  LEU   3          1HD2      LEU   3 -55.347 -52.399 -47.990
  643   2HD2  LEU   3          2HD2      LEU   3 -56.600 -53.211 -48.929
  644   3HD2  LEU   3          3HD2      LEU   3 -56.570 -51.451 -48.834
  645    H    GLU   4           H        GLU   4 -51.370 -51.506 -51.903
  646    HA   GLU   4           HA       GLU   4 -49.369 -52.127 -49.832
  647   1HB   GLU   4          1HB       GLU   4 -49.003 -52.012 -52.548
  648   2HB   GLU   4          2HB       GLU   4 -48.516 -50.398 -52.045
  649   1HG   GLU   4          1HG       GLU   4 -46.585 -51.792 -52.081
  650   2HG   GLU   4          2HG       GLU   4 -46.981 -51.437 -50.400
  651    H    LYS   5           H        LYS   5 -48.674 -50.576 -48.478
  652    HA   LYS   5           HA       LYS   5 -50.330 -48.288 -48.121
  653   1HB   LYS   5          1HB       LYS   5 -48.002 -49.502 -46.738
  654   2HB   LYS   5          2HB       LYS   5 -48.282 -47.789 -46.455
  655   1HG   LYS   5          1HG       LYS   5 -49.940 -48.225 -45.055
  656   2HG   LYS   5          2HG       LYS   5 -50.742 -49.260 -46.236
  657   1HD   LYS   5          1HD       LYS   5 -49.933 -51.155 -45.312
  658   2HD   LYS   5          2HD       LYS   5 -48.362 -50.429 -44.957
  659   1HE   LYS   5          1HE       LYS   5 -48.969 -49.843 -42.869
  660   2HE   LYS   5          2HE       LYS   5 -50.587 -49.358 -43.376
  661   1HZ   LYS   5          1HZ       LYS   5 -49.944 -51.607 -41.958
  662   2HZ   LYS   5          2HZ       LYS   5 -50.228 -52.191 -43.525
  663   3HZ   LYS   5          3HZ       LYS   5 -51.424 -51.296 -42.724
  664    H    ALA   6           H        ALA   6 -46.950 -48.732 -49.116
  665    HA   ALA   6           HA       ALA   6 -45.458 -47.389 -50.172
  666   1HB   ALA   6          1HB       ALA   6 -48.032 -46.850 -51.458
  667   2HB   ALA   6          2HB       ALA   6 -46.461 -47.228 -52.168
  668   3HB   ALA   6          3HB       ALA   6 -46.830 -45.576 -51.675
  669    H    HIS   7           H        HIS   7 -45.698 -46.687 -47.654
  670    HA   HIS   7           HA       HIS   7 -46.215 -43.813 -47.535
  671   1HB   HIS   7          1HB       HIS   7 -46.200 -46.018 -45.563
  672   2HB   HIS   7          2HB       HIS   7 -45.606 -44.465 -44.986
  673    HD1  HIS   7           HD1      HIS   7 -48.242 -45.691 -43.909
  674    HD2  HIS   7           HD2      HIS   7 -48.012 -42.950 -47.035
  675    HE1  HIS   7           HE1      HIS   7 -50.500 -44.584 -44.015
  676    HE2  HIS   7           HE2      HIS   7 -50.289 -42.833 -45.817
  677    H    THR   8           H        THR   8 -44.640 -42.410 -47.593
  678    HA   THR   8           HA       THR   8 -41.930 -43.240 -46.806
  679    HB   THR   8           HB       THR   8 -42.087 -41.243 -48.980
  680    HG1  THR   8           HG1      THR   8 -43.589 -42.603 -49.883
  681   1HG2  THR   8          1HG2      THR   8 -40.451 -43.767 -48.787
  682   2HG2  THR   8          2HG2      THR   8 -39.998 -42.264 -47.982
  683   3HG2  THR   8          3HG2      THR   8 -40.115 -42.323 -49.741
  684    H    SER   9           H        SER   9 -44.038 -41.849 -45.404
  685    HA   SER   9           HA       SER   9 -43.382 -39.048 -45.379
  686   1HB   SER   9          1HB       SER   9 -44.962 -40.075 -43.140
  687   2HB   SER   9          2HB       SER   9 -45.372 -38.844 -44.333
  688    HG   SER   9           HG       SER   9 -46.135 -41.427 -44.218
  689    H    VAL  10           H        VAL  10 -41.050 -39.909 -44.938
  690    HA   VAL  10           HA       VAL  10 -40.625 -40.044 -42.030
  691    HB   VAL  10           HB       VAL  10 -38.200 -40.687 -42.879
  692   1HG1  VAL  10          1HG1      VAL  10 -40.251 -42.850 -43.086
  693   2HG1  VAL  10          2HG1      VAL  10 -40.007 -42.003 -41.556
  694   3HG1  VAL  10          3HG1      VAL  10 -38.669 -42.872 -42.307
  695   1HG2  VAL  10          1HG2      VAL  10 -38.632 -40.431 -45.245
  696   2HG2  VAL  10          2HG2      VAL  10 -39.969 -41.576 -45.157
  697   3HG2  VAL  10          3HG2      VAL  10 -38.316 -42.128 -44.883
  698    H    LYS  11           H        LYS  11 -39.641 -38.393 -41.048
  699    HA   LYS  11           HA       LYS  11 -39.127 -35.992 -42.477
  700   1HB   LYS  11          1HB       LYS  11 -39.181 -36.865 -39.700
  701   2HB   LYS  11          2HB       LYS  11 -37.899 -35.702 -40.008
  702   1HG   LYS  11          1HG       LYS  11 -39.711 -34.389 -39.383
  703   2HG   LYS  11          2HG       LYS  11 -39.706 -34.291 -41.145
  704   1HD   LYS  11          1HD       LYS  11 -41.388 -36.153 -41.155
  705   2HD   LYS  11          2HD       LYS  11 -41.494 -35.979 -39.403
  706   1HE   LYS  11          1HE       LYS  11 -42.268 -33.716 -39.617
  707   2HE   LYS  11          2HE       LYS  11 -41.995 -33.739 -41.359
  708   1HZ   LYS  11          1HZ       LYS  11 -44.307 -34.042 -40.941
  709   2HZ   LYS  11          2HZ       LYS  11 -44.016 -35.305 -39.846
  710   3HZ   LYS  11          3HZ       LYS  11 -43.690 -35.521 -41.496
  711    H    LYS  12           H        LYS  12 -37.055 -38.383 -40.911
  712    HA   LYS  12           HA       LYS  12 -34.812 -38.765 -40.960
  713   1HB   LYS  12          1HB       LYS  12 -35.620 -38.261 -43.793
  714   2HB   LYS  12          2HB       LYS  12 -33.945 -38.639 -43.413
  715   1HG   LYS  12          1HG       LYS  12 -35.637 -40.510 -42.087
  716   2HG   LYS  12          2HG       LYS  12 -36.111 -40.408 -43.783
  717   1HD   LYS  12          1HD       LYS  12 -34.096 -41.198 -44.535
  718   2HD   LYS  12          2HD       LYS  12 -33.213 -40.604 -43.128
  719   1HE   LYS  12          1HE       LYS  12 -34.218 -42.354 -41.756
  720   2HE   LYS  12          2HE       LYS  12 -35.119 -42.940 -43.152
  721   1HZ   LYS  12          1HZ       LYS  12 -32.189 -42.750 -43.316
  722   2HZ   LYS  12          2HZ       LYS  12 -33.248 -43.810 -44.115
  723   3HZ   LYS  12          3HZ       LYS  12 -32.887 -44.047 -42.473
  724    H    MET  13           H        MET  13 -35.146 -36.336 -39.916
  725    HA   MET  13           HA       MET  13 -33.011 -34.727 -41.168
  726   1HB   MET  13          1HB       MET  13 -35.539 -33.863 -40.986
  727   2HB   MET  13          2HB       MET  13 -34.992 -33.413 -39.377
  728   1HG   MET  13          1HG       MET  13 -34.803 -31.605 -41.072
  729   2HG   MET  13          2HG       MET  13 -33.291 -32.005 -40.259
  730   1HE   MET  13          1HE       MET  13 -34.459 -32.819 -44.595
  731   2HE   MET  13          2HE       MET  13 -35.527 -32.520 -43.219
  732   3HE   MET  13          3HE       MET  13 -34.846 -34.128 -43.479
  733    H    THR  14           H        THR  14 -32.474 -36.787 -39.453
  734    HA   THR  14           HA       THR  14 -32.267 -35.962 -36.735
  735    HB   THR  14           HB       THR  14 -30.425 -37.990 -37.125
  736    HG1  THR  14           HG1      THR  14 -31.020 -39.074 -38.850
  737   1HG2  THR  14          1HG2      THR  14 -33.353 -38.084 -36.417
  738   2HG2  THR  14          2HG2      THR  14 -31.988 -37.959 -35.306
  739   3HG2  THR  14          3HG2      THR  14 -32.251 -39.444 -36.221
  740    H    PHE  15           H        PHE  15 -30.619 -35.041 -35.673
  741    HA   PHE  15           HA       PHE  15 -28.047 -34.701 -37.025
  742   1HB   PHE  15          1HB       PHE  15 -27.944 -32.320 -36.262
  743   2HB   PHE  15          2HB       PHE  15 -29.153 -32.615 -37.503
  744    HD1  PHE  15           HD1      PHE  15 -28.544 -31.497 -34.124
  745    HD2  PHE  15           HD2      PHE  15 -31.552 -32.691 -36.886
  746    HE1  PHE  15           HE1      PHE  15 -30.261 -30.471 -32.693
  747    HE2  PHE  15           HE2      PHE  15 -33.273 -31.657 -35.468
  748    HZ   PHE  15           HZ       PHE  15 -32.609 -30.506 -33.368
  749    H    GLY  16           H        GLY  16 -29.967 -34.725 -34.108
  750   1HA   GLY  16          1HA       GLY  16 -29.374 -35.653 -32.071
  751   2HA   GLY  16          2HA       GLY  16 -27.726 -35.813 -32.655
  752    H    GLU  17           H        GLU  17 -28.973 -34.720 -30.122
  753    HA   GLU  17           HA       GLU  17 -27.838 -32.007 -30.205
  754   1HB   GLU  17          1HB       GLU  17 -30.115 -33.136 -28.899
  755   2HB   GLU  17          2HB       GLU  17 -28.991 -32.583 -27.666
  756   1HG   GLU  17          1HG       GLU  17 -29.789 -30.829 -29.961
  757   2HG   GLU  17          2HG       GLU  17 -30.770 -30.952 -28.501
  758    H    ASN  18           H        ASN  18 -25.946 -33.825 -30.396
  759    HA   ASN  18           HA       ASN  18 -24.991 -34.884 -27.944
  760   1HB   ASN  18          1HB       ASN  18 -24.384 -35.326 -30.564
  761   2HB   ASN  18          2HB       ASN  18 -22.993 -34.374 -30.052
  762   1HD2  ASN  18          1HD2      ASN  18 -24.589 -37.383 -29.913
  763   2HD2  ASN  18          2HD2      ASN  18 -23.434 -38.215 -28.916
  764    H    ARG  19           H        ARG  19 -24.115 -32.044 -29.870
  765    HA   ARG  19           HA       ARG  19 -22.883 -30.184 -29.410
  766   1HB   ARG  19          1HB       ARG  19 -24.779 -30.352 -27.494
  767   2HB   ARG  19          2HB       ARG  19 -23.337 -30.372 -26.491
  768   1HG   ARG  19          1HG       ARG  19 -23.790 -28.132 -26.582
  769   2HG   ARG  19          2HG       ARG  19 -22.652 -28.304 -27.921
  770   1HD   ARG  19          1HD       ARG  19 -24.419 -26.985 -28.757
  771   2HD   ARG  19          2HD       ARG  19 -24.675 -28.599 -29.419
  772    HE   ARG  19           HE       ARG  19 -26.599 -28.807 -28.162
  773   1HH1  ARG  19          1HH1      ARG  19 -24.864 -25.900 -27.216
  774   2HH1  ARG  19          2HH1      ARG  19 -26.173 -25.292 -26.238
  775   1HH2  ARG  19          1HH2      ARG  19 -28.305 -28.017 -26.891
  776   2HH2  ARG  19          2HH2      ARG  19 -28.129 -26.496 -26.053
  777    H    ASP  20           H        ASP  20 -21.324 -32.327 -29.708
  778    HA   ASP  20           HA       ASP  20 -19.627 -32.834 -27.463
  779   1HB   ASP  20          1HB       ASP  20 -20.070 -34.531 -29.200
  780   2HB   ASP  20          2HB       ASP  20 -19.246 -33.526 -30.385
  781    H    LEU  21           H        LEU  21 -19.275 -30.415 -27.213
  782    HA   LEU  21           HA       LEU  21 -16.748 -29.754 -28.554
  783   1HB   LEU  21          1HB       LEU  21 -19.042 -28.485 -29.218
  784   2HB   LEU  21          2HB       LEU  21 -18.512 -27.482 -27.882
  785    HG   LEU  21           HG       LEU  21 -16.220 -27.759 -29.408
  786   1HD1  LEU  21          1HD1      LEU  21 -16.987 -27.060 -31.674
  787   2HD1  LEU  21          2HD1      LEU  21 -18.627 -27.502 -31.199
  788   3HD1  LEU  21          3HD1      LEU  21 -17.365 -28.733 -31.264
  789   1HD2  LEU  21          1HD2      LEU  21 -18.196 -25.514 -29.696
  790   2HD2  LEU  21          2HD2      LEU  21 -16.437 -25.444 -29.781
  791   3HD2  LEU  21          3HD2      LEU  21 -17.232 -25.756 -28.239
  792    H    GLU  22           H        GLU  22 -16.206 -30.824 -26.398
  793    HA   GLU  22           HA       GLU  22 -16.509 -29.174 -24.045
  794   1HB   GLU  22          1HB       GLU  22 -14.822 -31.633 -24.539
  795   2HB   GLU  22          2HB       GLU  22 -15.031 -30.852 -22.978
  796   1HG   GLU  22          1HG       GLU  22 -17.263 -31.507 -22.818
  797   2HG   GLU  22          2HG       GLU  22 -17.373 -31.878 -24.538
  798    H    ARG  23           H        ARG  23 -15.533 -27.332 -25.354
  799    HA   ARG  23           HA       ARG  23 -12.660 -27.413 -25.677
  800   1HB   ARG  23          1HB       ARG  23 -14.659 -25.996 -26.915
  801   2HB   ARG  23          2HB       ARG  23 -13.965 -24.788 -25.842
  802   1HG   ARG  23          1HG       ARG  23 -11.992 -26.358 -27.335
  803   2HG   ARG  23          2HG       ARG  23 -13.059 -25.370 -28.333
  804   1HD   ARG  23          1HD       ARG  23 -11.795 -23.606 -27.853
  805   2HD   ARG  23          2HD       ARG  23 -12.306 -23.745 -26.173
  806    HE   ARG  23           HE       ARG  23 -10.314 -25.469 -26.163
  807   1HH1  ARG  23          1HH1      ARG  23 -10.480 -22.294 -27.642
  808   2HH1  ARG  23          2HH1      ARG  23  -8.769 -22.013 -27.522
  809   1HH2  ARG  23          1HH2      ARG  23  -8.060 -25.098 -26.010
  810   2HH2  ARG  23          2HH2      ARG  23  -7.394 -23.600 -26.602
  811    H    VAL  24           H        VAL  24 -12.768 -27.989 -23.221
  812    HA   VAL  24           HA       VAL  24 -12.929 -25.727 -21.447
  813    HB   VAL  24           HB       VAL  24 -13.518 -27.901 -20.558
  814   1HG1  VAL  24          1HG1      VAL  24 -12.402 -29.560 -21.655
  815   2HG1  VAL  24          2HG1      VAL  24 -11.449 -29.489 -20.173
  816   3HG1  VAL  24          3HG1      VAL  24 -10.866 -28.694 -21.634
  817   1HG2  VAL  24          1HG2      VAL  24 -11.024 -27.645 -19.073
  818   2HG2  VAL  24          2HG2      VAL  24 -12.691 -27.443 -18.536
  819   3HG2  VAL  24          3HG2      VAL  24 -11.852 -26.111 -19.326
  820    H    VAL  25           H        VAL  25 -11.339 -24.383 -20.916
  821    HA   VAL  25           HA       VAL  25  -8.645 -25.000 -21.952
  822    HB   VAL  25           HB       VAL  25  -9.456 -22.181 -21.390
  823   1HG1  VAL  25          1HG1      VAL  25  -7.586 -21.707 -22.507
  824   2HG1  VAL  25          2HG1      VAL  25  -8.027 -22.766 -23.846
  825   3HG1  VAL  25          3HG1      VAL  25  -7.217 -23.428 -22.428
  826   1HG2  VAL  25          1HG2      VAL  25 -11.312 -23.253 -22.733
  827   2HG2  VAL  25          2HG2      VAL  25 -10.125 -23.500 -24.012
  828   3HG2  VAL  25          3HG2      VAL  25 -10.521 -21.866 -23.483
  829    H    THR  26           H        THR  26  -7.749 -25.893 -20.146
  830    HA   THR  26           HA       THR  26  -8.073 -24.788 -17.541
  831    HB   THR  26           HB       THR  26  -5.709 -26.386 -17.673
  832    HG1  THR  26           HG1      THR  26  -7.678 -28.039 -18.653
  833   1HG2  THR  26          1HG2      THR  26  -7.156 -26.348 -15.752
  834   2HG2  THR  26          2HG2      THR  26  -7.137 -27.989 -16.396
  835   3HG2  THR  26          3HG2      THR  26  -8.517 -26.939 -16.708
  836    H    ALA  27           H        ALA  27  -7.188 -22.946 -16.895
  837    HA   ALA  27           HA       ALA  27  -4.909 -21.780 -18.221
  838   1HB   ALA  27          1HB       ALA  27  -6.943 -20.611 -17.056
  839   2HB   ALA  27          2HB       ALA  27  -5.340 -19.871 -17.008
  840   3HB   ALA  27          3HB       ALA  27  -5.943 -20.765 -15.611
  841    HA   PRO  28           HA       PRO  28  -1.677 -23.617 -15.840
  842   1HB   PRO  28          1HB       PRO  28  -0.370 -20.956 -15.830
  843   2HB   PRO  28          2HB       PRO  28   0.225 -22.498 -16.453
  844   1HG   PRO  28          1HG       PRO  28  -0.571 -20.559 -18.109
  845   2HG   PRO  28          2HG       PRO  28  -0.882 -22.268 -18.470
  846   1HD   PRO  28          1HD       PRO  28  -2.750 -20.181 -17.417
  847   2HD   PRO  28          2HD       PRO  28  -3.052 -21.474 -18.595
  848    H    VAL  29           H        VAL  29  -1.461 -23.980 -13.723
  849    HA   VAL  29           HA       VAL  29  -2.726 -22.218 -11.832
  850    HB   VAL  29           HB       VAL  29  -1.008 -24.589 -11.121
  851   1HG1  VAL  29          1HG1      VAL  29  -1.607 -23.848  -9.091
  852   2HG1  VAL  29          2HG1      VAL  29  -3.167 -24.582  -9.462
  853   3HG1  VAL  29          3HG1      VAL  29  -2.917 -22.857  -9.734
  854   1HG2  VAL  29          1HG2      VAL  29  -3.706 -25.383 -11.184
  855   2HG2  VAL  29          2HG2      VAL  29  -2.383 -25.963 -12.193
  856   3HG2  VAL  29          3HG2      VAL  29  -3.372 -24.606 -12.730
  857    H    SER  30           H        SER  30  -1.365 -20.357 -12.280
  858    HA   SER  30           HA       SER  30   1.398 -20.324 -11.866
  859   1HB   SER  30          1HB       SER  30   0.312 -17.759 -11.251
  860   2HB   SER  30          2HB       SER  30   1.085 -18.286 -12.747
  861    HG   SER  30           HG       SER  30  -1.660 -18.316 -12.051
  862    H    SER  31           H        SER  31   2.602 -20.310 -10.110
  863    HA   SER  31           HA       SER  31   1.380 -20.327  -7.502
  864   1HB   SER  31          1HB       SER  31   4.317 -20.238  -7.656
  865   2HB   SER  31          2HB       SER  31   3.265 -21.419  -6.873
  866    HG   SER  31           HG       SER  31   3.300 -22.633  -8.611
  867    H    GLY  32           H        GLY  32   2.431 -18.991  -5.729
  868   1HA   GLY  32          1HA       GLY  32   2.798 -16.234  -6.729
  869   2HA   GLY  32          2HA       GLY  32   2.103 -16.652  -5.169
  870    H    LYS  33           H        LYS  33   5.091 -17.064  -7.044
  871    HA   LYS  33           HA       LYS  33   6.667 -17.291  -4.619
  872   1HB   LYS  33          1HB       LYS  33   7.021 -18.384  -7.030
  873   2HB   LYS  33          2HB       LYS  33   7.947 -16.910  -7.281
  874   1HG   LYS  33          1HG       LYS  33   9.362 -18.758  -6.547
  875   2HG   LYS  33          2HG       LYS  33   9.355 -17.438  -5.375
  876   1HD   LYS  33          1HD       LYS  33   7.245 -19.186  -4.679
  877   2HD   LYS  33          2HD       LYS  33   8.666 -20.184  -4.989
  878   1HE   LYS  33          1HE       LYS  33   9.879 -18.387  -3.523
  879   2HE   LYS  33          2HE       LYS  33   8.252 -18.059  -2.931
  880   1HZ   LYS  33          1HZ       LYS  33   8.382 -20.746  -2.788
  881   2HZ   LYS  33          2HZ       LYS  33   8.694 -19.695  -1.496
  882   3HZ   LYS  33          3HZ       LYS  33   9.980 -20.310  -2.414
  883    H    ILE  34           H        ILE  34   5.485 -14.856  -6.628
  884    HA   ILE  34           HA       ILE  34   7.217 -12.896  -5.282
  885    HB   ILE  34           HB       ILE  34   6.283 -11.567  -7.530
  886   1HG1  ILE  34          1HG1      ILE  34   7.587 -14.041  -8.613
  887   2HG1  ILE  34          2HG1      ILE  34   5.846 -14.030  -8.349
  888   1HG2  ILE  34          1HG2      ILE  34   8.945 -12.526  -7.980
  889   2HG2  ILE  34          2HG2      ILE  34   8.718 -12.158  -6.273
  890   3HG2  ILE  34          3HG2      ILE  34   8.405 -10.920  -7.488
  891   1HD1  ILE  34          1HD1      ILE  34   6.697 -13.431 -10.665
  892   2HD1  ILE  34          2HD1      ILE  34   7.210 -11.898  -9.953
  893   3HD1  ILE  34          3HD1      ILE  34   5.504 -12.353  -9.937
  894    H    LYS  35           H        LYS  35   6.166 -11.066  -4.548
  895    HA   LYS  35           HA       LYS  35   3.237 -11.317  -4.431
  896   1HB   LYS  35          1HB       LYS  35   5.333 -10.695  -2.468
  897   2HB   LYS  35          2HB       LYS  35   3.944  -9.617  -2.396
  898   1HG   LYS  35          1HG       LYS  35   3.426 -11.314  -0.894
  899   2HG   LYS  35          2HG       LYS  35   2.526 -11.742  -2.349
  900   1HD   LYS  35          1HD       LYS  35   5.039 -12.946  -2.627
  901   2HD   LYS  35          2HD       LYS  35   4.549 -13.232  -0.955
  902   1HE   LYS  35          1HE       LYS  35   2.355 -13.627  -2.805
  903   2HE   LYS  35          2HE       LYS  35   3.732 -14.657  -3.196
  904   1HZ   LYS  35          1HZ       LYS  35   2.540 -15.915  -1.689
  905   2HZ   LYS  35          2HZ       LYS  35   2.121 -14.585  -0.726
  906   3HZ   LYS  35          3HZ       LYS  35   3.706 -15.188  -0.697
  907    H    ARG  36           H        ARG  36   1.959  -9.406  -4.515
  908    HA   ARG  36           HA       ARG  36   3.270  -7.262  -6.052
  909   1HB   ARG  36          1HB       ARG  36   0.915  -6.653  -6.706
  910   2HB   ARG  36          2HB       ARG  36   1.468  -8.221  -7.278
  911   1HG   ARG  36          1HG       ARG  36  -0.001  -9.368  -5.990
  912   2HG   ARG  36          2HG       ARG  36   0.023  -8.170  -4.696
  913   1HD   ARG  36          1HD       ARG  36  -1.259  -7.669  -7.371
  914   2HD   ARG  36          2HD       ARG  36  -2.132  -8.375  -6.014
  915    HE   ARG  36           HE       ARG  36  -1.727  -6.306  -4.792
  916   1HH1  ARG  36          1HH1      ARG  36  -1.130  -6.221  -8.249
  917   2HH1  ARG  36          2HH1      ARG  36  -1.467  -4.513  -8.394
  918   1HH2  ARG  36          1HH2      ARG  36  -2.146  -4.059  -4.982
  919   2HH2  ARG  36          2HH2      ARG  36  -2.046  -3.298  -6.543
  920    H    VAL  37           H        VAL  37   3.569  -5.344  -5.173
  921    HA   VAL  37           HA       VAL  37   2.066  -4.686  -2.719
  922    HB   VAL  37           HB       VAL  37   4.833  -3.665  -3.320
  923   1HG1  VAL  37          1HG1      VAL  37   4.886  -2.936  -1.143
  924   2HG1  VAL  37          2HG1      VAL  37   3.711  -4.130  -0.598
  925   3HG1  VAL  37          3HG1      VAL  37   3.178  -2.730  -1.525
  926   1HG2  VAL  37          1HG2      VAL  37   4.774  -5.792  -1.351
  927   2HG2  VAL  37          2HG2      VAL  37   5.841  -5.566  -2.736
  928   3HG2  VAL  37          3HG2      VAL  37   4.278  -6.355  -2.945
  929    H    ASN  38           H        ASN  38   0.860  -2.904  -2.844
  930    HA   ASN  38           HA       ASN  38   1.548  -0.890  -4.878
  931   1HB   ASN  38          1HB       ASN  38  -0.656  -1.278  -5.375
  932   2HB   ASN  38          2HB       ASN  38  -1.031  -1.835  -3.749
  933   1HD2  ASN  38          1HD2      ASN  38  -0.752   0.935  -5.839
  934   2HD2  ASN  38          2HD2      ASN  38  -1.533   2.060  -4.779
  935    H    VAL  39           H        VAL  39   2.395   0.964  -4.178
  936    HA   VAL  39           HA       VAL  39   1.830   1.831  -1.434
  937    HB   VAL  39           HB       VAL  39   4.539   2.502  -1.978
  938   1HG1  VAL  39          1HG1      VAL  39   4.447   0.555   0.025
  939   2HG1  VAL  39          2HG1      VAL  39   2.898   1.396   0.103
  940   3HG1  VAL  39          3HG1      VAL  39   4.406   2.307   0.225
  941   1HG2  VAL  39          1HG2      VAL  39   5.055   0.736  -3.338
  942   2HG2  VAL  39          2HG2      VAL  39   3.812  -0.308  -2.643
  943   3HG2  VAL  39          3HG2      VAL  39   5.311  -0.007  -1.759
  944    H    ASN  40           H        ASN  40   2.502   4.063  -1.022
  945    HA   ASN  40           HA       ASN  40   2.221   5.700  -3.445
  946   1HB   ASN  40          1HB       ASN  40   1.169   7.401  -2.032
  947   2HB   ASN  40          2HB       ASN  40   0.311   5.874  -1.911
  948   1HD2  ASN  40          1HD2      ASN  40   0.441   4.669  -0.004
  949   2HD2  ASN  40          2HD2      ASN  40   0.974   5.378   1.492
  950    H    PHE  41           H        PHE  41   3.704   7.177  -3.904
  951    HA   PHE  41           HA       PHE  41   5.752   7.825  -1.886
  952   1HB   PHE  41          1HB       PHE  41   6.339   7.548  -4.836
  953   2HB   PHE  41          2HB       PHE  41   7.489   7.674  -3.510
  954    HD1  PHE  41           HD1      PHE  41   7.815   5.749  -1.980
  955    HD2  PHE  41           HD2      PHE  41   5.442   5.462  -5.500
  956    HE1  PHE  41           HE1      PHE  41   7.975   3.296  -1.883
  957    HE2  PHE  41           HE2      PHE  41   5.594   3.011  -5.404
  958    HZ   PHE  41           HZ       PHE  41   6.867   1.924  -3.602
  959    H    ASP  42           H        ASP  42   5.961   9.957  -1.566
  960    HA   ASP  42           HA       ASP  42   4.244  11.756  -2.921
  961   1HB   ASP  42          1HB       ASP  42   4.618  13.007  -1.105
  962   2HB   ASP  42          2HB       ASP  42   5.693  11.737  -0.540
  963    H    GLU  43           H        GLU  43   4.852  13.711  -4.058
  964    HA   GLU  43           HA       GLU  43   6.372  13.154  -6.304
  965   1HB   GLU  43          1HB       GLU  43   4.529  14.944  -5.862
  966   2HB   GLU  43          2HB       GLU  43   5.890  15.986  -5.466
  967   1HG   GLU  43          1HG       GLU  43   5.149  16.233  -7.786
  968   2HG   GLU  43          2HG       GLU  43   6.816  15.679  -7.669
  969    H    GLU  44           H        GLU  44   7.367  14.709  -3.317
  970    HA   GLU  44           HA       GLU  44   9.881  15.708  -4.255
  971   1HB   GLU  44          1HB       GLU  44   8.632  15.164  -1.608
  972   2HB   GLU  44          2HB       GLU  44  10.382  15.278  -1.670
  973   1HG   GLU  44          1HG       GLU  44  10.350  17.511  -2.255
  974   2HG   GLU  44          2HG       GLU  44   8.705  17.430  -2.885
  975    H    LYS  45           H        LYS  45   8.844  12.804  -2.560
  976    HA   LYS  45           HA       LYS  45  11.321  11.462  -2.530
  977   1HB   LYS  45          1HB       LYS  45   9.648  10.656  -1.080
  978   2HB   LYS  45          2HB       LYS  45   8.443  10.607  -2.357
  979   1HG   LYS  45          1HG       LYS  45   9.257   8.622  -3.225
  980   2HG   LYS  45          2HG       LYS  45  10.834   8.820  -2.455
  981   1HD   LYS  45          1HD       LYS  45   8.362   8.547  -0.795
  982   2HD   LYS  45          2HD       LYS  45   9.136   7.116  -1.480
  983   1HE   LYS  45          1HE       LYS  45  10.467   7.118   0.301
  984   2HE   LYS  45          2HE       LYS  45  11.238   8.551  -0.399
  985   1HZ   LYS  45          1HZ       LYS  45   9.410   9.846   0.796
  986   2HZ   LYS  45          2HZ       LYS  45  10.647   9.199   1.756
  987   3HZ   LYS  45          3HZ       LYS  45   9.139   8.428   1.681
  988    H    HIS  46           H        HIS  46   8.876  11.906  -4.955
  989    HA   HIS  46           HA       HIS  46   9.732   9.815  -6.703
  990   1HB   HIS  46          1HB       HIS  46   7.456  10.789  -6.785
  991   2HB   HIS  46          2HB       HIS  46   8.143  12.308  -7.350
  992    HD1  HIS  46           HD1      HIS  46   6.999  12.306  -9.607
  993    HD2  HIS  46           HD2      HIS  46   9.251   8.877  -8.911
  994    HE1  HIS  46           HE1      HIS  46   7.118  11.105 -11.815
  995    HE2  HIS  46           HE2      HIS  46   8.656   9.148 -11.411
  996    H    THR  47           H        THR  47  10.552  13.251  -6.376
  997    HA   THR  47           HA       THR  47  12.144  13.353  -8.747
  998    HB   THR  47           HB       THR  47  13.196  15.203  -6.883
  999    HG1  THR  47           HG1      THR  47  11.584  15.530  -5.564
 1000   1HG2  THR  47          1HG2      THR  47  13.057  15.977  -9.038
 1001   2HG2  THR  47          2HG2      THR  47  11.640  16.757  -8.336
 1002   3HG2  THR  47          3HG2      THR  47  11.453  15.292  -9.295
 1003    H    ARG  48           H        ARG  48  12.717  12.538  -5.392
 1004    HA   ARG  48           HA       ARG  48  15.549  12.218  -5.593
 1005   1HB   ARG  48          1HB       ARG  48  13.479  11.806  -3.596
 1006   2HB   ARG  48          2HB       ARG  48  14.640  10.485  -3.605
 1007   1HG   ARG  48          1HG       ARG  48  16.464  12.041  -3.283
 1008   2HG   ARG  48          2HG       ARG  48  15.342  13.402  -3.359
 1009   1HD   ARG  48          1HD       ARG  48  14.629  13.091  -1.246
 1010   2HD   ARG  48          2HD       ARG  48  14.644  11.333  -1.394
 1011    HE   ARG  48           HE       ARG  48  17.124  11.525  -1.095
 1012   1HH1  ARG  48          1HH1      ARG  48  14.924  13.908   0.241
 1013   2HH1  ARG  48          2HH1      ARG  48  16.059  14.456   1.443
 1014   1HH2  ARG  48          1HH2      ARG  48  18.614  12.253   0.468
 1015   2HH2  ARG  48          2HH2      ARG  48  18.151  13.528   1.562
 1016    H    PHE  49           H        PHE  49  12.746  10.108  -5.934
 1017    HA   PHE  49           HA       PHE  49  14.100   7.673  -6.306
 1018   1HB   PHE  49          1HB       PHE  49  11.420   8.590  -6.392
 1019   2HB   PHE  49          2HB       PHE  49  11.720   7.758  -7.913
 1020    HD1  PHE  49           HD1      PHE  49  13.936   6.102  -6.100
 1021    HD2  PHE  49           HD2      PHE  49   9.720   6.686  -6.153
 1022    HE1  PHE  49           HE1      PHE  49  13.623   3.932  -4.980
 1023    HE2  PHE  49           HE2      PHE  49   9.403   4.521  -5.029
 1024    HZ   PHE  49           HZ       PHE  49  11.326   3.148  -4.444
 1025    H    LYS  50           H        LYS  50  13.007  10.115  -8.620
 1026    HA   LYS  50           HA       LYS  50  13.742   8.813 -10.974
 1027   1HB   LYS  50          1HB       LYS  50  12.837  11.403 -10.209
 1028   2HB   LYS  50          2HB       LYS  50  14.225  11.612 -11.268
 1029   1HG   LYS  50          1HG       LYS  50  11.967   9.790 -12.011
 1030   2HG   LYS  50          2HG       LYS  50  11.892  11.529 -12.312
 1031   1HD   LYS  50          1HD       LYS  50  13.918  11.413 -13.645
 1032   2HD   LYS  50          2HD       LYS  50  14.075   9.692 -13.287
 1033   1HE   LYS  50          1HE       LYS  50  13.028   9.476 -15.279
 1034   2HE   LYS  50          2HE       LYS  50  11.587   9.718 -14.292
 1035   1HZ   LYS  50          1HZ       LYS  50  11.557  12.023 -14.869
 1036   2HZ   LYS  50          2HZ       LYS  50  11.665  11.127 -16.305
 1037   3HZ   LYS  50          3HZ       LYS  50  13.041  11.904 -15.685
 1038    H    ALA  51           H        ALA  51  15.586  10.987  -8.894
 1039    HA   ALA  51           HA       ALA  51  17.968  10.973 -10.428
 1040   1HB   ALA  51          1HB       ALA  51  18.604  12.492  -8.941
 1041   2HB   ALA  51          2HB       ALA  51  18.467  11.333  -7.618
 1042   3HB   ALA  51          3HB       ALA  51  17.056  12.258  -8.129
 1043    H    ALA  52           H        ALA  52  16.823   9.030  -7.704
 1044    HA   ALA  52           HA       ALA  52  19.156   7.528  -7.285
 1045   1HB   ALA  52          1HB       ALA  52  16.546   7.595  -6.246
 1046   2HB   ALA  52          2HB       ALA  52  17.933   6.699  -5.628
 1047   3HB   ALA  52          3HB       ALA  52  16.831   5.935  -6.772
 1048    H    CYS  53           H        CYS  53  16.374   6.961  -9.415
 1049    HA   CYS  53           HA       CYS  53  17.185   4.433 -10.380
 1050   1HB   CYS  53          1HB       CYS  53  15.558   6.543 -11.815
 1051   2HB   CYS  53          2HB       CYS  53  15.633   4.834 -12.229
 1052    HG   CYS  53           HG       CYS  53  14.337   6.086  -9.321
 1053    H    ALA  54           H        ALA  54  17.936   7.718 -11.385
 1054    HA   ALA  54           HA       ALA  54  19.323   6.996 -13.762
 1055   1HB   ALA  54          1HB       ALA  54  19.371   9.198 -14.096
 1056   2HB   ALA  54          2HB       ALA  54  20.238   9.478 -12.585
 1057   3HB   ALA  54          3HB       ALA  54  18.477   9.365 -12.588
 1058    H    ARG  55           H        ARG  55  20.377   7.816 -10.477
 1059    HA   ARG  55           HA       ARG  55  23.140   7.592 -10.970
 1060   1HB   ARG  55          1HB       ARG  55  21.496   7.430  -8.449
 1061   2HB   ARG  55          2HB       ARG  55  23.248   7.285  -8.430
 1062   1HG   ARG  55          1HG       ARG  55  23.474   9.500  -9.378
 1063   2HG   ARG  55          2HG       ARG  55  21.720   9.650  -9.502
 1064   1HD   ARG  55          1HD       ARG  55  22.081  10.758  -7.532
 1065   2HD   ARG  55          2HD       ARG  55  21.823   9.121  -6.928
 1066    HE   ARG  55           HE       ARG  55  24.516   9.258  -7.322
 1067   1HH1  ARG  55          1HH1      ARG  55  22.218  11.229  -5.550
 1068   2HH1  ARG  55          2HH1      ARG  55  23.372  11.700  -4.337
 1069   1HH2  ARG  55          1HH2      ARG  55  26.027   9.857  -5.694
 1070   2HH2  ARG  55          2HH2      ARG  55  25.522  10.915  -4.407
 1071    H    LYS  56           H        LYS  56  20.883   5.302  -9.445
 1072    HA   LYS  56           HA       LYS  56  22.796   3.234  -9.161
 1073   1HB   LYS  56          1HB       LYS  56  19.774   3.154  -9.172
 1074   2HB   LYS  56          2HB       LYS  56  20.791   1.781  -8.759
 1075   1HG   LYS  56          1HG       LYS  56  21.134   4.357  -7.297
 1076   2HG   LYS  56          2HG       LYS  56  19.795   3.282  -6.887
 1077   1HD   LYS  56          1HD       LYS  56  21.169   1.668  -6.046
 1078   2HD   LYS  56          2HD       LYS  56  22.503   2.089  -7.120
 1079   1HE   LYS  56          1HE       LYS  56  22.836   4.166  -5.789
 1080   2HE   LYS  56          2HE       LYS  56  21.600   3.595  -4.669
 1081   1HZ   LYS  56          1HZ       LYS  56  23.029   1.554  -4.412
 1082   2HZ   LYS  56          2HZ       LYS  56  23.641   2.981  -3.734
 1083   3HZ   LYS  56          3HZ       LYS  56  24.260   2.410  -5.210
 1084    H    GLY  57           H        GLY  57  20.522   4.082 -11.694
 1085   1HA   GLY  57          1HA       GLY  57  20.610   3.475 -13.936
 1086   2HA   GLY  57          2HA       GLY  57  21.933   2.378 -13.560
 1087    H    THR  58           H        THR  58  18.485   2.736 -12.745
 1088    HA   THR  58           HA       THR  58  17.876   0.097 -13.706
 1089    HB   THR  58           HB       THR  58  19.037  -0.128 -11.397
 1090    HG1  THR  58           HG1      THR  58  17.410  -1.798 -10.835
 1091   1HG2  THR  58          1HG2      THR  58  16.271   0.625 -10.468
 1092   2HG2  THR  58          2HG2      THR  58  17.699   1.643 -10.291
 1093   3HG2  THR  58          3HG2      THR  58  17.617   0.087  -9.464
 1094    H    SER  59           H        SER  59  15.545  -0.502 -12.892
 1095    HA   SER  59           HA       SER  59  13.851   1.662 -13.711
 1096   1HB   SER  59          1HB       SER  59  12.347  -0.563 -12.726
 1097   2HB   SER  59          2HB       SER  59  12.593  -0.056 -14.399
 1098    HG   SER  59           HG       SER  59  14.452  -1.314 -14.491
 1099    H    ILE  60           H        ILE  60  11.995   2.434 -12.530
 1100    HA   ILE  60           HA       ILE  60  12.611   3.236  -9.920
 1101    HB   ILE  60           HB       ILE  60  11.033   4.385 -11.541
 1102   1HG1  ILE  60          1HG1      ILE  60  10.000   4.005  -8.722
 1103   2HG1  ILE  60          2HG1      ILE  60  11.377   5.020  -9.146
 1104   1HG2  ILE  60          1HG2      ILE  60   8.737   2.982 -10.345
 1105   2HG2  ILE  60          2HG2      ILE  60   9.650   2.068 -11.548
 1106   3HG2  ILE  60          3HG2      ILE  60   8.951   3.632 -11.970
 1107   1HD1  ILE  60          1HD1      ILE  60   9.811   6.627  -9.155
 1108   2HD1  ILE  60          2HD1      ILE  60   8.495   5.500  -9.481
 1109   3HD1  ILE  60          3HD1      ILE  60   9.536   6.046 -10.797
 1110    H    THR  61           H        THR  61  10.987   0.396 -11.076
 1111    HA   THR  61           HA       THR  61   9.773  -0.288  -8.578
 1112    HB   THR  61           HB       THR  61  10.202  -2.609 -10.162
 1113    HG1  THR  61           HG1      THR  61   8.895  -1.264 -11.989
 1114   1HG2  THR  61          1HG2      THR  61   8.228  -2.293  -8.843
 1115   2HG2  THR  61          2HG2      THR  61   7.737  -2.380 -10.536
 1116   3HG2  THR  61          3HG2      THR  61   7.818  -0.817  -9.719
 1117    H    ASP  62           H        ASP  62  12.766  -1.031 -10.238
 1118    HA   ASP  62           HA       ASP  62  13.632  -3.092  -8.517
 1119   1HB   ASP  62          1HB       ASP  62  14.514  -2.648 -10.827
 1120   2HB   ASP  62          2HB       ASP  62  15.391  -1.271 -10.163
 1121    H    VAL  63           H        VAL  63  14.104   0.416  -8.472
 1122    HA   VAL  63           HA       VAL  63  15.960   0.365  -6.309
 1123    HB   VAL  63           HB       VAL  63  15.049   2.825  -5.995
 1124   1HG1  VAL  63          1HG1      VAL  63  16.557   3.472  -7.978
 1125   2HG1  VAL  63          2HG1      VAL  63  16.821   1.736  -8.151
 1126   3HG1  VAL  63          3HG1      VAL  63  17.263   2.549  -6.650
 1127   1HG2  VAL  63          1HG2      VAL  63  14.006   3.798  -7.827
 1128   2HG2  VAL  63          2HG2      VAL  63  13.156   2.265  -7.640
 1129   3HG2  VAL  63          3HG2      VAL  63  14.389   2.443  -8.890
 1130    H    VAL  64           H        VAL  64  12.532   0.046  -6.483
 1131    HA   VAL  64           HA       VAL  64  12.019   0.692  -3.721
 1132    HB   VAL  64           HB       VAL  64  10.380  -1.102  -5.525
 1133   1HG1  VAL  64          1HG1      VAL  64   9.028   0.451  -3.458
 1134   2HG1  VAL  64          2HG1      VAL  64  10.192  -0.705  -2.809
 1135   3HG1  VAL  64          3HG1      VAL  64   8.890  -1.262  -3.862
 1136   1HG2  VAL  64          1HG2      VAL  64  10.069   1.855  -5.010
 1137   2HG2  VAL  64          2HG2      VAL  64   8.989   0.846  -5.972
 1138   3HG2  VAL  64          3HG2      VAL  64  10.646   1.129  -6.510
 1139    H    ASN  65           H        ASN  65  12.817  -2.169  -5.618
 1140    HA   ASN  65           HA       ASN  65  12.695  -4.030  -3.462
 1141   1HB   ASN  65          1HB       ASN  65  12.702  -4.748  -5.832
 1142   2HB   ASN  65          2HB       ASN  65  14.354  -4.162  -5.997
 1143   1HD2  ASN  65          1HD2      ASN  65  15.609  -5.870  -6.183
 1144   2HD2  ASN  65          2HD2      ASN  65  15.585  -7.257  -5.148
 1145    H    GLN  66           H        GLN  66  14.999  -1.663  -4.507
 1146    HA   GLN  66           HA       GLN  66  17.269  -2.676  -3.136
 1147   1HB   GLN  66          1HB       GLN  66  16.589  -0.307  -4.669
 1148   2HB   GLN  66          2HB       GLN  66  17.582   0.089  -3.275
 1149   1HG   GLN  66          1HG       GLN  66  19.326  -0.447  -4.520
 1150   2HG   GLN  66          2HG       GLN  66  18.821  -2.127  -4.336
 1151   1HE2  GLN  66          1HE2      GLN  66  17.806  -3.157  -6.030
 1152   2HE2  GLN  66          2HE2      GLN  66  17.751  -2.504  -7.636
 1153    H    LEU  67           H        LEU  67  14.789  -0.266  -2.256
 1154    HA   LEU  67           HA       LEU  67  15.960   0.382   0.234
 1155   1HB   LEU  67          1HB       LEU  67  13.186   0.685   0.544
 1156   2HB   LEU  67          2HB       LEU  67  14.379   1.924   0.225
 1157    HG   LEU  67           HG       LEU  67  13.592   0.583  -2.216
 1158   1HD1  LEU  67          1HD1      LEU  67  11.508   1.080  -0.299
 1159   2HD1  LEU  67          2HD1      LEU  67  11.404   0.366  -1.911
 1160   3HD1  LEU  67          3HD1      LEU  67  11.313   2.115  -1.713
 1161   1HD2  LEU  67          1HD2      LEU  67  14.580   2.998  -1.493
 1162   2HD2  LEU  67          2HD2      LEU  67  12.879   3.391  -1.733
 1163   3HD2  LEU  67          3HD2      LEU  67  13.809   2.663  -3.043
 1164    H    VAL  68           H        VAL  68  13.468  -1.980  -0.670
 1165    HA   VAL  68           HA       VAL  68  13.037  -2.900   1.977
 1166    HB   VAL  68           HB       VAL  68  11.507  -3.270  -0.019
 1167   1HG1  VAL  68          1HG1      VAL  68  11.835  -5.455  -1.181
 1168   2HG1  VAL  68          2HG1      VAL  68  13.481  -5.471  -0.540
 1169   3HG1  VAL  68          3HG1      VAL  68  12.970  -4.185  -1.638
 1170   1HG2  VAL  68          1HG2      VAL  68  10.413  -4.700   1.286
 1171   2HG2  VAL  68          2HG2      VAL  68  11.821  -4.637   2.351
 1172   3HG2  VAL  68          3HG2      VAL  68  11.684  -5.916   1.144
 1173    H    ASP  69           H        ASP  69  15.372  -3.636  -0.474
 1174    HA   ASP  69           HA       ASP  69  16.410  -6.039   0.606
 1175   1HB   ASP  69          1HB       ASP  69  16.862  -4.787  -1.689
 1176   2HB   ASP  69          2HB       ASP  69  18.205  -4.088  -0.782
 1177    H    ASN  70           H        ASN  70  17.198  -2.640   1.065
 1178    HA   ASN  70           HA       ASN  70  19.381  -3.058   2.833
 1179   1HB   ASN  70          1HB       ASN  70  17.681  -0.718   2.057
 1180   2HB   ASN  70          2HB       ASN  70  18.707  -0.582   3.480
 1181   1HD2  ASN  70          1HD2      ASN  70  18.875  -1.684   0.112
 1182   2HD2  ASN  70          2HD2      ASN  70  20.443  -1.020  -0.206
 1183    H    TRP  71           H        TRP  71  15.958  -2.361   3.281
 1184    HA   TRP  71           HA       TRP  71  15.961  -2.171   6.082
 1185   1HB   TRP  71          1HB       TRP  71  14.125  -1.452   4.548
 1186   2HB   TRP  71          2HB       TRP  71  13.723  -3.145   4.297
 1187    HD1  TRP  71           HD1      TRP  71  13.499  -0.366   6.914
 1188    HE1  TRP  71           HE1      TRP  71  11.819  -1.077   8.730
 1189    HE3  TRP  71           HE3      TRP  71  12.718  -5.212   5.434
 1190    HZ2  TRP  71           HZ2      TRP  71  10.352  -3.386   9.436
 1191    HZ3  TRP  71           HZ3      TRP  71  11.153  -6.603   6.737
 1192    HH2  TRP  71           HH2      TRP  71   9.995  -5.700   8.699
 1193    H    LEU  72           H        LEU  72  15.191  -4.916   3.963
 1194    HA   LEU  72           HA       LEU  72  14.589  -6.705   6.020
 1195   1HB   LEU  72          1HB       LEU  72  14.497  -6.711   3.265
 1196   2HB   LEU  72          2HB       LEU  72  15.684  -7.952   3.621
 1197    HG   LEU  72           HG       LEU  72  13.643  -8.566   5.361
 1198   1HD1  LEU  72          1HD1      LEU  72  12.369  -6.782   3.935
 1199   2HD1  LEU  72          2HD1      LEU  72  11.582  -8.295   4.382
 1200   3HD1  LEU  72          3HD1      LEU  72  12.258  -8.097   2.762
 1201   1HD2  LEU  72          1HD2      LEU  72  13.436 -10.514   4.101
 1202   2HD2  LEU  72          2HD2      LEU  72  15.072  -9.961   3.733
 1203   3HD2  LEU  72          3HD2      LEU  72  13.766  -9.679   2.582
 1204    H    LYS  73           H        LYS  73  17.567  -6.470   4.082
 1205    HA   LYS  73           HA       LYS  73  18.726  -8.558   5.703
 1206   1HB   LYS  73          1HB       LYS  73  20.058  -7.120   3.424
 1207   2HB   LYS  73          2HB       LYS  73  20.383  -8.740   4.027
 1208   1HG   LYS  73          1HG       LYS  73  18.201  -9.490   3.224
 1209   2HG   LYS  73          2HG       LYS  73  17.853  -7.857   2.648
 1210   1HD   LYS  73          1HD       LYS  73  19.372  -8.006   0.914
 1211   2HD   LYS  73          2HD       LYS  73  20.331  -9.245   1.724
 1212   1HE   LYS  73          1HE       LYS  73  19.014 -10.943   0.991
 1213   2HE   LYS  73          2HE       LYS  73  17.549  -9.962   1.021
 1214   1HZ   LYS  73          1HZ       LYS  73  18.516  -8.783  -0.973
 1215   2HZ   LYS  73          2HZ       LYS  73  18.007 -10.377  -1.229
 1216   3HZ   LYS  73          3HZ       LYS  73  19.657 -10.037  -1.059
 1217    H    GLU  74           H        GLU  74  19.340  -5.117   5.160
 1218    HA   GLU  74           HA       GLU  74  21.737  -5.280   6.805
 1219   1HB   GLU  74          1HB       GLU  74  20.737  -2.722   5.628
 1220   2HB   GLU  74          2HB       GLU  74  22.389  -3.249   5.907
 1221   1HG   GLU  74          1HG       GLU  74  21.459  -5.084   4.091
 1222   2HG   GLU  74          2HG       GLU  74  20.684  -3.585   3.579
 1223    H    ASN  75           H        ASN  75  18.515  -4.816   7.395
 1224    HA   ASN  75           HA       ASN  75  19.122  -3.229   9.795
 1225   1HB   ASN  75          1HB       ASN  75  17.893  -1.639   8.732
 1226   2HB   ASN  75          2HB       ASN  75  17.052  -2.807   7.722
 1227   1HD2  ASN  75          1HD2      ASN  75  15.101  -3.533   8.320
 1228   2HD2  ASN  75          2HD2      ASN  75  14.257  -3.030   9.744
 1229    H    GLU  76           H        GLU  76  16.832  -5.556   8.375
 1230    HA   GLU  76           HA       GLU  76  15.990  -6.384  11.037
 1231   1HB   GLU  76          1HB       GLU  76  15.069  -7.036   8.256
 1232   2HB   GLU  76          2HB       GLU  76  14.567  -8.011   9.628
 1233   1HG   GLU  76          1HG       GLU  76  13.867  -5.210   8.931
 1234   2HG   GLU  76          2HG       GLU  76  12.830  -6.534   9.446
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -22.334  53.184 -36.406
    2   2H    MET   1          2H        MET   1 -23.213  54.583 -36.021
    3   3H    MET   1          3H        MET   1 -22.701  53.540 -34.787
    4    HA   MET   1           HA       MET   1 -21.207  55.286 -34.670
    5   1HB   MET   1          1HB       MET   1 -20.423  52.716 -35.455
    6   2HB   MET   1          2HB       MET   1 -19.445  53.799 -36.436
    7   1HG   MET   1          1HG       MET   1 -18.451  54.782 -34.564
    8   2HG   MET   1          2HG       MET   1 -19.676  54.146 -33.471
    9   1HE   MET   1          1HE       MET   1 -17.574  53.705 -32.023
   10   2HE   MET   1          2HE       MET   1 -16.250  53.822 -33.178
   11   3HE   MET   1          3HE       MET   1 -16.470  52.348 -32.240
   12    H    SER   2           H        SER   2 -20.226  57.067 -35.577
   13    HA   SER   2           HA       SER   2 -21.174  57.921 -38.107
   14   1HB   SER   2          1HB       SER   2 -18.844  59.316 -36.910
   15   2HB   SER   2          2HB       SER   2 -20.369  59.970 -37.509
   16    HG   SER   2           HG       SER   2 -20.834  60.118 -35.464
   17    H    LEU   3           H        LEU   3 -17.760  57.604 -37.071
   18    HA   LEU   3           HA       LEU   3 -17.149  56.674 -39.804
   19   1HB   LEU   3          1HB       LEU   3 -16.256  59.036 -38.458
   20   2HB   LEU   3          2HB       LEU   3 -14.880  57.985 -38.729
   21    HG   LEU   3           HG       LEU   3 -15.010  59.483 -40.576
   22   1HD1  LEU   3          1HD1      LEU   3 -16.070  57.563 -42.288
   23   2HD1  LEU   3          2HD1      LEU   3 -15.435  56.655 -40.916
   24   3HD1  LEU   3          3HD1      LEU   3 -14.381  57.752 -41.811
   25   1HD2  LEU   3          1HD2      LEU   3 -17.285  60.239 -40.364
   26   2HD2  LEU   3          2HD2      LEU   3 -17.897  58.649 -40.821
   27   3HD2  LEU   3          3HD2      LEU   3 -17.029  59.632 -42.000
   28    H    GLU   4           H        GLU   4 -17.309  55.658 -36.778
   29    HA   GLU   4           HA       GLU   4 -16.511  53.837 -35.685
   30   1HB   GLU   4          1HB       GLU   4 -15.897  53.197 -38.269
   31   2HB   GLU   4          2HB       GLU   4 -14.308  53.181 -37.519
   32   1HG   GLU   4          1HG       GLU   4 -15.784  51.779 -35.710
   33   2HG   GLU   4          2HG       GLU   4 -16.547  51.329 -37.233
   34    H    LYS   5           H        LYS   5 -13.688  55.276 -37.319
   35    HA   LYS   5           HA       LYS   5 -11.740  56.139 -36.542
   36   1HB   LYS   5          1HB       LYS   5 -13.749  57.306 -35.028
   37   2HB   LYS   5          2HB       LYS   5 -12.606  56.740 -33.820
   38   1HG   LYS   5          1HG       LYS   5 -11.076  57.965 -35.825
   39   2HG   LYS   5          2HG       LYS   5 -12.453  59.027 -35.526
   40   1HD   LYS   5          1HD       LYS   5 -11.944  59.151 -33.196
   41   2HD   LYS   5          2HD       LYS   5 -10.717  57.890 -33.342
   42   1HE   LYS   5          1HE       LYS   5  -9.229  59.527 -33.604
   43   2HE   LYS   5          2HE       LYS   5  -9.945  59.803 -35.191
   44   1HZ   LYS   5          1HZ       LYS   5  -9.954  61.864 -34.108
   45   2HZ   LYS   5          2HZ       LYS   5 -10.537  61.212 -32.654
   46   3HZ   LYS   5          3HZ       LYS   5 -11.553  61.314 -34.006
   47    H    ALA   6           H        ALA   6 -11.830  53.461 -36.450
   48    HA   ALA   6           HA       ALA   6 -11.097  52.446 -33.851
   49   1HB   ALA   6          1HB       ALA   6 -11.824  50.598 -34.867
   50   2HB   ALA   6          2HB       ALA   6 -10.292  50.580 -35.739
   51   3HB   ALA   6          3HB       ALA   6 -11.708  51.344 -36.460
   52    H    HIS   7           H        HIS   7  -9.268  53.287 -33.067
   53    HA   HIS   7           HA       HIS   7  -6.799  52.820 -34.557
   54   1HB   HIS   7          1HB       HIS   7  -8.001  55.407 -34.258
   55   2HB   HIS   7          2HB       HIS   7  -6.506  55.362 -33.331
   56    HD1  HIS   7           HD1      HIS   7  -5.679  57.140 -35.159
   57    HD2  HIS   7           HD2      HIS   7  -6.319  53.259 -36.524
   58    HE1  HIS   7           HE1      HIS   7  -4.481  56.988 -37.371
   59    HE2  HIS   7           HE2      HIS   7  -4.887  54.630 -38.186
   60    H    THR   8           H        THR   8  -5.033  52.458 -33.273
   61    HA   THR   8           HA       THR   8  -5.508  51.794 -30.532
   62    HB   THR   8           HB       THR   8  -2.737  52.069 -31.608
   63    HG1  THR   8           HG1      THR   8  -4.585  50.038 -32.435
   64   1HG2  THR   8          1HG2      THR   8  -3.538  51.086 -29.318
   65   2HG2  THR   8          2HG2      THR   8  -2.254  50.281 -30.218
   66   3HG2  THR   8          3HG2      THR   8  -3.901  49.654 -30.279
   67    H    SER   9           H        SER   9  -4.715  52.837 -28.691
   68    HA   SER   9           HA       SER   9  -4.652  55.642 -28.747
   69   1HB   SER   9          1HB       SER   9  -3.344  54.597 -26.407
   70   2HB   SER   9          2HB       SER   9  -4.950  55.316 -26.547
   71    HG   SER   9           HG       SER   9  -5.697  53.381 -26.240
   72    H    VAL  10           H        VAL  10  -2.934  57.104 -28.455
   73    HA   VAL  10           HA       VAL  10  -0.561  56.412 -29.846
   74    HB   VAL  10           HB       VAL  10  -0.878  58.867 -28.129
   75   1HG1  VAL  10          1HG1      VAL  10   1.304  58.751 -28.958
   76   2HG1  VAL  10          2HG1      VAL  10   0.471  59.812 -30.091
   77   3HG1  VAL  10          3HG1      VAL  10   0.776  58.131 -30.521
   78   1HG2  VAL  10          1HG2      VAL  10  -2.791  59.153 -29.329
   79   2HG2  VAL  10          2HG2      VAL  10  -2.241  58.136 -30.658
   80   3HG2  VAL  10          3HG2      VAL  10  -1.640  59.784 -30.506
   81    H    LYS  11           H        LYS  11   0.690  54.927 -28.938
   82    HA   LYS  11           HA       LYS  11   1.389  55.152 -26.110
   83   1HB   LYS  11          1HB       LYS  11   1.716  52.984 -28.173
   84   2HB   LYS  11          2HB       LYS  11   2.579  52.928 -26.642
   85   1HG   LYS  11          1HG       LYS  11  -0.247  53.459 -26.278
   86   2HG   LYS  11          2HG       LYS  11   0.048  51.948 -27.140
   87   1HD   LYS  11          1HD       LYS  11   1.224  51.021 -25.369
   88   2HD   LYS  11          2HD       LYS  11   1.606  52.595 -24.669
   89   1HE   LYS  11          1HE       LYS  11  -0.341  52.706 -23.533
   90   2HE   LYS  11          2HE       LYS  11  -1.259  51.947 -24.833
   91   1HZ   LYS  11          1HZ       LYS  11   0.486  50.541 -22.882
   92   2HZ   LYS  11          2HZ       LYS  11  -0.361  49.800 -24.151
   93   3HZ   LYS  11          3HZ       LYS  11  -1.209  50.542 -22.886
   94    H    LYS  12           H        LYS  12   2.567  57.169 -26.716
   95    HA   LYS  12           HA       LYS  12   5.151  56.707 -28.010
   96   1HB   LYS  12          1HB       LYS  12   3.470  59.092 -27.436
   97   2HB   LYS  12          2HB       LYS  12   5.211  59.331 -27.431
   98   1HG   LYS  12          1HG       LYS  12   4.530  57.821 -29.739
   99   2HG   LYS  12          2HG       LYS  12   3.453  59.214 -29.640
  100   1HD   LYS  12          1HD       LYS  12   5.126  60.698 -29.985
  101   2HD   LYS  12          2HD       LYS  12   6.303  59.739 -29.083
  102   1HE   LYS  12          1HE       LYS  12   7.156  59.399 -31.150
  103   2HE   LYS  12          2HE       LYS  12   5.941  58.122 -31.186
  104   1HZ   LYS  12          1HZ       LYS  12   4.442  59.975 -32.141
  105   2HZ   LYS  12          2HZ       LYS  12   5.571  59.230 -33.160
  106   3HZ   LYS  12          3HZ       LYS  12   5.903  60.759 -32.505
  107    H    MET  13           H        MET  13   4.297  55.810 -25.269
  108    HA   MET  13           HA       MET  13   6.444  57.096 -23.724
  109   1HB   MET  13          1HB       MET  13   5.229  56.727 -21.731
  110   2HB   MET  13          2HB       MET  13   4.046  57.341 -22.877
  111   1HG   MET  13          1HG       MET  13   4.447  54.420 -22.277
  112   2HG   MET  13          2HG       MET  13   3.261  55.441 -21.465
  113   1HE   MET  13          1HE       MET  13   1.247  56.474 -22.494
  114   2HE   MET  13          2HE       MET  13   0.803  54.793 -22.195
  115   3HE   MET  13          3HE       MET  13   0.331  55.578 -23.703
  116    H    THR  14           H        THR  14   7.440  55.596 -22.087
  117    HA   THR  14           HA       THR  14   8.323  53.207 -23.397
  118    HB   THR  14           HB       THR  14   9.377  52.881 -21.003
  119    HG1  THR  14           HG1      THR  14   8.449  54.451 -19.815
  120   1HG2  THR  14          1HG2      THR  14  11.270  54.216 -21.682
  121   2HG2  THR  14          2HG2      THR  14  10.263  55.134 -22.803
  122   3HG2  THR  14          3HG2      THR  14  10.584  53.426 -23.100
  123    H    PHE  15           H        PHE  15   7.749  51.116 -23.014
  124    HA   PHE  15           HA       PHE  15   5.518  50.729 -21.133
  125   1HB   PHE  15          1HB       PHE  15   4.925  48.757 -22.595
  126   2HB   PHE  15          2HB       PHE  15   4.719  50.335 -23.339
  127    HD1  PHE  15           HD1      PHE  15   6.535  47.188 -23.413
  128    HD2  PHE  15           HD2      PHE  15   6.243  51.081 -25.106
  129    HE1  PHE  15           HE1      PHE  15   7.908  46.456 -25.318
  130    HE2  PHE  15           HE2      PHE  15   7.619  50.359 -27.011
  131    HZ   PHE  15           HZ       PHE  15   8.453  48.044 -27.123
  132    H    GLY  16           H        GLY  16   8.633  49.587 -22.151
  133   1HA   GLY  16          1HA       GLY  16   8.960  48.143 -19.686
  134   2HA   GLY  16          2HA       GLY  16   8.851  47.084 -21.086
  135    H    GLU  17           H        GLU  17  10.481  50.101 -20.170
  136    HA   GLU  17           HA       GLU  17  12.836  49.218 -21.680
  137   1HB   GLU  17          1HB       GLU  17  11.520  51.721 -21.347
  138   2HB   GLU  17          2HB       GLU  17  13.135  51.865 -20.669
  139   1HG   GLU  17          1HG       GLU  17  12.662  50.728 -23.398
  140   2HG   GLU  17          2HG       GLU  17  12.811  52.462 -23.119
  141    H    ASN  18           H        ASN  18  11.705  49.080 -18.613
  142    HA   ASN  18           HA       ASN  18  14.271  49.675 -17.339
  143   1HB   ASN  18          1HB       ASN  18  12.345  50.661 -16.262
  144   2HB   ASN  18          2HB       ASN  18  11.539  49.098 -16.179
  145   1HD2  ASN  18          1HD2      ASN  18  14.760  50.342 -15.320
  146   2HD2  ASN  18          2HD2      ASN  18  14.762  49.694 -13.713
  147    H    ARG  19           H        ARG  19  11.887  47.043 -17.570
  148    HA   ARG  19           HA       ARG  19  14.080  45.153 -17.043
  149   1HB   ARG  19          1HB       ARG  19  11.672  45.589 -15.456
  150   2HB   ARG  19          2HB       ARG  19  11.829  43.920 -15.987
  151   1HG   ARG  19          1HG       ARG  19  12.905  43.943 -13.936
  152   2HG   ARG  19          2HG       ARG  19  14.234  44.080 -15.090
  153   1HD   ARG  19          1HD       ARG  19  14.093  46.574 -14.786
  154   2HD   ARG  19          2HD       ARG  19  12.967  46.273 -13.463
  155    HE   ARG  19           HE       ARG  19  14.721  45.292 -12.217
  156   1HH1  ARG  19          1HH1      ARG  19  15.782  46.688 -15.259
  157   2HH1  ARG  19          2HH1      ARG  19  17.453  46.757 -14.789
  158   1HH2  ARG  19          1HH2      ARG  19  16.918  45.406 -11.588
  159   2HH2  ARG  19          2HH2      ARG  19  18.104  46.047 -12.697
  160    H    ASP  20           H        ASP  20  13.554  42.937 -17.736
  161    HA   ASP  20           HA       ASP  20  11.551  42.780 -19.876
  162   1HB   ASP  20          1HB       ASP  20  13.071  42.115 -21.533
  163   2HB   ASP  20          2HB       ASP  20  13.906  43.436 -20.726
  164    H    LEU  21           H        LEU  21  12.481  41.587 -17.099
  165    HA   LEU  21           HA       LEU  21  12.834  38.812 -17.586
  166   1HB   LEU  21          1HB       LEU  21  13.461  40.245 -15.516
  167   2HB   LEU  21          2HB       LEU  21  11.814  39.933 -15.005
  168    HG   LEU  21           HG       LEU  21  12.762  37.416 -15.650
  169   1HD1  LEU  21          1HD1      LEU  21  14.896  37.134 -14.752
  170   2HD1  LEU  21          2HD1      LEU  21  14.882  38.720 -13.983
  171   3HD1  LEU  21          3HD1      LEU  21  15.039  38.592 -15.733
  172   1HD2  LEU  21          1HD2      LEU  21  11.481  37.459 -13.777
  173   2HD2  LEU  21          2HD2      LEU  21  12.194  38.963 -13.193
  174   3HD2  LEU  21          3HD2      LEU  21  13.064  37.443 -13.000
  175    H    GLU  22           H        GLU  22  11.388  37.301 -18.008
  176    HA   GLU  22           HA       GLU  22   8.541  37.929 -17.763
  177   1HB   GLU  22          1HB       GLU  22   9.701  35.435 -18.987
  178   2HB   GLU  22          2HB       GLU  22   8.114  36.140 -19.252
  179   1HG   GLU  22          1HG       GLU  22   8.855  37.353 -20.945
  180   2HG   GLU  22          2HG       GLU  22  10.183  37.997 -19.977
  181    H    ARG  23           H        ARG  23   7.296  35.666 -17.312
  182    HA   ARG  23           HA       ARG  23   8.533  34.346 -15.005
  183   1HB   ARG  23          1HB       ARG  23   7.112  36.249 -14.201
  184   2HB   ARG  23          2HB       ARG  23   5.724  35.468 -14.944
  185   1HG   ARG  23          1HG       ARG  23   5.610  34.878 -12.688
  186   2HG   ARG  23          2HG       ARG  23   6.284  33.455 -13.485
  187   1HD   ARG  23          1HD       ARG  23   7.450  34.011 -11.385
  188   2HD   ARG  23          2HD       ARG  23   8.513  34.075 -12.790
  189    HE   ARG  23           HE       ARG  23   7.364  36.623 -12.126
  190   1HH1  ARG  23          1HH1      ARG  23   9.959  34.382 -11.397
  191   2HH1  ARG  23          2HH1      ARG  23  11.040  35.622 -10.817
  192   1HH2  ARG  23          1HH2      ARG  23   8.770  38.257 -11.357
  193   2HH2  ARG  23          2HH2      ARG  23  10.339  37.822 -10.738
  194    H    VAL  24           H        VAL  24   8.729  32.670 -16.655
  195    HA   VAL  24           HA       VAL  24   6.186  31.225 -17.059
  196    HB   VAL  24           HB       VAL  24   8.588  30.708 -18.779
  197   1HG1  VAL  24          1HG1      VAL  24   6.873  29.106 -19.031
  198   2HG1  VAL  24          2HG1      VAL  24   6.722  30.185 -20.419
  199   3HG1  VAL  24          3HG1      VAL  24   5.615  30.343 -19.055
  200   1HG2  VAL  24          1HG2      VAL  24   7.319  32.298 -20.436
  201   2HG2  VAL  24          2HG2      VAL  24   8.474  32.952 -19.272
  202   3HG2  VAL  24          3HG2      VAL  24   6.743  33.045 -18.943
  203    H    VAL  25           H        VAL  25   6.509  30.272 -14.966
  204    HA   VAL  25           HA       VAL  25   8.808  28.480 -14.702
  205    HB   VAL  25           HB       VAL  25   6.908  28.458 -12.485
  206   1HG1  VAL  25          1HG1      VAL  25   9.832  29.179 -12.631
  207   2HG1  VAL  25          2HG1      VAL  25   9.191  27.551 -12.413
  208   3HG1  VAL  25          3HG1      VAL  25   8.921  28.779 -11.176
  209   1HG2  VAL  25          1HG2      VAL  25   7.607  31.032 -13.640
  210   2HG2  VAL  25          2HG2      VAL  25   8.119  30.881 -11.959
  211   3HG2  VAL  25          3HG2      VAL  25   6.427  30.635 -12.391
  212    H    THR  26           H        THR  26   8.131  26.910 -16.225
  213    HA   THR  26           HA       THR  26   5.610  25.570 -15.889
  214    HB   THR  26           HB       THR  26   7.705  24.266 -17.518
  215    HG1  THR  26           HG1      THR  26   6.811  26.236 -19.043
  216   1HG2  THR  26          1HG2      THR  26   5.011  25.221 -18.425
  217   2HG2  THR  26          2HG2      THR  26   5.162  23.800 -17.392
  218   3HG2  THR  26          3HG2      THR  26   5.943  23.830 -18.974
  219    H    ALA  27           H        ALA  27   5.355  24.332 -14.143
  220    HA   ALA  27           HA       ALA  27   7.534  22.473 -13.431
  221   1HB   ALA  27          1HB       ALA  27   5.652  24.053 -11.720
  222   2HB   ALA  27          2HB       ALA  27   7.402  23.888 -11.598
  223   3HB   ALA  27          3HB       ALA  27   6.356  22.550 -11.124
  224    HA   PRO  28           HA       PRO  28   4.387  19.456 -14.377
  225   1HB   PRO  28          1HB       PRO  28   6.262  17.357 -13.964
  226   2HB   PRO  28          2HB       PRO  28   5.804  18.094 -15.499
  227   1HG   PRO  28          1HG       PRO  28   8.311  18.272 -14.298
  228   2HG   PRO  28          2HG       PRO  28   7.707  19.322 -15.589
  229   1HD   PRO  28          1HD       PRO  28   7.862  19.821 -12.652
  230   2HD   PRO  28          2HD       PRO  28   8.068  20.953 -14.008
  231    H    VAL  29           H        VAL  29   5.104  20.388 -11.519
  232    HA   VAL  29           HA       VAL  29   4.440  17.931 -10.055
  233    HB   VAL  29           HB       VAL  29   5.051  20.444  -8.584
  234   1HG1  VAL  29          1HG1      VAL  29   6.459  18.620  -7.332
  235   2HG1  VAL  29          2HG1      VAL  29   5.409  17.511  -8.215
  236   3HG1  VAL  29          3HG1      VAL  29   4.711  18.709  -7.127
  237   1HG2  VAL  29          1HG2      VAL  29   7.098  20.777  -9.380
  238   2HG2  VAL  29          2HG2      VAL  29   6.778  19.579 -10.632
  239   3HG2  VAL  29          3HG2      VAL  29   7.518  19.086  -9.107
  240    H    SER  30           H        SER  30   2.446  19.118 -11.602
  241    HA   SER  30           HA       SER  30   0.716  20.472  -9.657
  242   1HB   SER  30          1HB       SER  30  -0.540  20.445 -12.171
  243   2HB   SER  30          2HB       SER  30   0.301  21.807 -11.425
  244    HG   SER  30           HG       SER  30   1.617  21.621 -13.055
  245    H    SER  31           H        SER  31   1.361  17.543  -9.904
  246    HA   SER  31           HA       SER  31  -1.048  16.287 -10.804
  247   1HB   SER  31          1HB       SER  31   0.740  14.681  -9.133
  248   2HB   SER  31          2HB       SER  31   0.219  14.421 -10.800
  249    HG   SER  31           HG       SER  31   1.865  15.658 -11.536
  250    H    GLY  32           H        GLY  32  -1.008  14.257  -8.628
  251   1HA   GLY  32          1HA       GLY  32  -2.838  15.676  -6.856
  252   2HA   GLY  32          2HA       GLY  32  -2.634  13.935  -6.967
  253    H    LYS  33           H        LYS  33   0.346  15.380  -6.833
  254    HA   LYS  33           HA       LYS  33   1.966  15.635  -5.283
  255   1HB   LYS  33          1HB       LYS  33  -0.316  15.956  -3.332
  256   2HB   LYS  33          2HB       LYS  33   1.367  16.345  -3.005
  257   1HG   LYS  33          1HG       LYS  33   0.401  17.663  -5.396
  258   2HG   LYS  33          2HG       LYS  33  -0.575  18.058  -3.981
  259   1HD   LYS  33          1HD       LYS  33   1.000  19.602  -3.579
  260   2HD   LYS  33          2HD       LYS  33   1.954  18.244  -2.981
  261   1HE   LYS  33          1HE       LYS  33   3.473  19.000  -4.461
  262   2HE   LYS  33          2HE       LYS  33   2.502  18.084  -5.611
  263   1HZ   LYS  33          1HZ       LYS  33   1.889  20.915  -5.041
  264   2HZ   LYS  33          2HZ       LYS  33   1.496  19.991  -6.408
  265   3HZ   LYS  33          3HZ       LYS  33   3.094  20.499  -6.159
  266    H    ILE  34           H        ILE  34   0.343  13.023  -5.710
  267    HA   ILE  34           HA       ILE  34   1.951  11.486  -3.823
  268    HB   ILE  34           HB       ILE  34  -1.042  11.284  -4.086
  269   1HG1  ILE  34          1HG1      ILE  34   0.859  11.238  -1.734
  270   2HG1  ILE  34          2HG1      ILE  34  -0.155  12.590  -2.225
  271   1HG2  ILE  34          1HG2      ILE  34   0.595   9.086  -2.860
  272   2HG2  ILE  34          2HG2      ILE  34   0.131   9.057  -4.562
  273   3HG2  ILE  34          3HG2      ILE  34  -1.112   9.078  -3.310
  274   1HD1  ILE  34          1HD1      ILE  34  -1.192   9.921  -1.303
  275   2HD1  ILE  34          2HD1      ILE  34  -2.140  11.364  -1.657
  276   3HD1  ILE  34          3HD1      ILE  34  -1.033  11.354  -0.286
  277    H    LYS  35           H        LYS  35   2.877   9.799  -4.785
  278    HA   LYS  35           HA       LYS  35   2.098   9.211  -7.562
  279   1HB   LYS  35          1HB       LYS  35   4.789   8.449  -6.561
  280   2HB   LYS  35          2HB       LYS  35   4.313   9.089  -8.128
  281   1HG   LYS  35          1HG       LYS  35   3.992  11.009  -5.961
  282   2HG   LYS  35          2HG       LYS  35   5.656  10.457  -6.168
  283   1HD   LYS  35          1HD       LYS  35   5.304  12.420  -7.515
  284   2HD   LYS  35          2HD       LYS  35   5.491  11.025  -8.578
  285   1HE   LYS  35          1HE       LYS  35   3.232  11.002  -9.146
  286   2HE   LYS  35          2HE       LYS  35   2.767  11.933  -7.722
  287   1HZ   LYS  35          1HZ       LYS  35   3.343  13.898  -8.694
  288   2HZ   LYS  35          2HZ       LYS  35   2.894  13.035 -10.087
  289   3HZ   LYS  35          3HZ       LYS  35   4.530  13.200  -9.688
  290    H    ARG  36           H        ARG  36   1.889   7.098  -8.220
  291    HA   ARG  36           HA       ARG  36   1.570   5.180  -6.019
  292   1HB   ARG  36          1HB       ARG  36  -0.179   5.935  -7.955
  293   2HB   ARG  36          2HB       ARG  36   0.534   4.513  -8.703
  294   1HG   ARG  36          1HG       ARG  36  -0.370   3.087  -7.181
  295   2HG   ARG  36          2HG       ARG  36  -0.372   4.292  -5.890
  296   1HD   ARG  36          1HD       ARG  36  -2.645   3.742  -6.634
  297   2HD   ARG  36          2HD       ARG  36  -2.243   5.434  -6.926
  298    HE   ARG  36           HE       ARG  36  -1.714   3.775  -9.199
  299   1HH1  ARG  36          1HH1      ARG  36  -4.215   5.542  -7.494
  300   2HH1  ARG  36          2HH1      ARG  36  -5.247   5.678  -8.887
  301   1HH2  ARG  36          1HH2      ARG  36  -3.041   3.977 -11.035
  302   2HH2  ARG  36          2HH2      ARG  36  -4.576   4.781 -10.910
  303    H    VAL  37           H        VAL  37   2.829   3.450  -5.834
  304    HA   VAL  37           HA       VAL  37   4.301   2.503  -8.198
  305    HB   VAL  37           HB       VAL  37   5.486   2.975  -5.455
  306   1HG1  VAL  37          1HG1      VAL  37   7.023   1.853  -7.767
  307   2HG1  VAL  37          2HG1      VAL  37   6.133   0.792  -6.677
  308   3HG1  VAL  37          3HG1      VAL  37   7.413   1.826  -6.048
  309   1HG2  VAL  37          1HG2      VAL  37   6.622   4.723  -6.318
  310   2HG2  VAL  37          2HG2      VAL  37   5.275   4.758  -7.454
  311   3HG2  VAL  37          3HG2      VAL  37   6.790   3.975  -7.905
  312    H    ASN  38           H        ASN  38   4.066   0.406  -8.522
  313    HA   ASN  38           HA       ASN  38   3.138  -1.300  -6.301
  314   1HB   ASN  38          1HB       ASN  38   1.470  -1.593  -7.854
  315   2HB   ASN  38          2HB       ASN  38   2.517  -1.205  -9.210
  316   1HD2  ASN  38          1HD2      ASN  38   1.247  -3.691  -7.195
  317   2HD2  ASN  38          2HD2      ASN  38   1.905  -5.033  -8.076
  318    H    VAL  39           H        VAL  39   4.515  -2.812  -5.579
  319    HA   VAL  39           HA       VAL  39   6.900  -3.373  -7.230
  320    HB   VAL  39           HB       VAL  39   7.156  -3.845  -4.340
  321   1HG1  VAL  39          1HG1      VAL  39   8.816  -2.539  -6.479
  322   2HG1  VAL  39          2HG1      VAL  39   9.082  -4.087  -5.678
  323   3HG1  VAL  39          3HG1      VAL  39   9.301  -2.581  -4.784
  324   1HG2  VAL  39          1HG2      VAL  39   7.445  -0.987  -4.995
  325   2HG2  VAL  39          2HG2      VAL  39   6.909  -1.764  -3.506
  326   3HG2  VAL  39          3HG2      VAL  39   5.789  -1.578  -4.856
  327    H    ASN  40           H        ASN  40   7.889  -5.438  -7.044
  328    HA   ASN  40           HA       ASN  40   6.075  -7.560  -6.097
  329   1HB   ASN  40          1HB       ASN  40   6.212  -7.731  -8.490
  330   2HB   ASN  40          2HB       ASN  40   7.961  -7.537  -8.463
  331   1HD2  ASN  40          1HD2      ASN  40   9.232  -9.285  -8.213
  332   2HD2  ASN  40          2HD2      ASN  40   8.638 -10.900  -8.007
  333    H    PHE  41           H        PHE  41   6.841  -8.728  -4.480
  334    HA   PHE  41           HA       PHE  41   9.708  -8.548  -3.846
  335   1HB   PHE  41          1HB       PHE  41   7.404  -9.232  -2.008
  336   2HB   PHE  41          2HB       PHE  41   9.091  -9.067  -1.534
  337    HD1  PHE  41           HD1      PHE  41   9.918  -6.629  -2.882
  338    HD2  PHE  41           HD2      PHE  41   6.249  -7.578  -0.949
  339    HE1  PHE  41           HE1      PHE  41   9.537  -4.241  -2.437
  340    HE2  PHE  41           HE2      PHE  41   5.859  -5.193  -0.506
  341    HZ   PHE  41           HZ       PHE  41   7.502  -3.523  -1.252
  342    H    ASP  42           H        ASP  42  10.684 -10.443  -2.881
  343    HA   ASP  42           HA       ASP  42   9.937 -12.898  -4.208
  344   1HB   ASP  42          1HB       ASP  42  12.323 -12.150  -3.781
  345   2HB   ASP  42          2HB       ASP  42  12.048 -12.473  -2.078
  346    H    GLU  43           H        GLU  43   9.740 -14.926  -2.849
  347    HA   GLU  43           HA       GLU  43   7.661 -14.697  -0.941
  348   1HB   GLU  43          1HB       GLU  43   8.536 -16.741  -2.408
  349   2HB   GLU  43          2HB       GLU  43   9.435 -17.089  -0.935
  350   1HG   GLU  43          1HG       GLU  43   7.577 -18.265  -0.452
  351   2HG   GLU  43          2HG       GLU  43   7.035 -16.698   0.140
  352    H    GLU  44           H        GLU  44  11.144 -14.837  -0.743
  353    HA   GLU  44           HA       GLU  44  11.405 -15.180   2.068
  354   1HB   GLU  44          1HB       GLU  44  13.139 -15.088  -0.032
  355   2HB   GLU  44          2HB       GLU  44  13.409 -13.517   0.716
  356   1HG   GLU  44          1HG       GLU  44  14.899 -14.664   1.941
  357   2HG   GLU  44          2HG       GLU  44  13.474 -15.081   2.894
  358    H    LYS  45           H        LYS  45  11.449 -12.330  -0.029
  359    HA   LYS  45           HA       LYS  45  11.853 -10.419   1.958
  360   1HB   LYS  45          1HB       LYS  45  10.589 -10.280  -0.767
  361   2HB   LYS  45          2HB       LYS  45  10.675  -8.864   0.269
  362   1HG   LYS  45          1HG       LYS  45  13.209  -9.471   0.392
  363   2HG   LYS  45          2HG       LYS  45  12.858 -10.343  -1.103
  364   1HD   LYS  45          1HD       LYS  45  12.616  -8.453  -2.290
  365   2HD   LYS  45          2HD       LYS  45  11.733  -7.643  -0.995
  366   1HE   LYS  45          1HE       LYS  45  13.557  -6.412  -0.677
  367   2HE   LYS  45          2HE       LYS  45  14.315  -7.861  -0.017
  368   1HZ   LYS  45          1HZ       LYS  45  14.973  -8.397  -2.361
  369   2HZ   LYS  45          2HZ       LYS  45  15.749  -7.052  -1.684
  370   3HZ   LYS  45          3HZ       LYS  45  14.480  -6.829  -2.789
  371    H    HIS  46           H        HIS  46   8.957 -12.052   0.907
  372    HA   HIS  46           HA       HIS  46   7.219 -10.162   2.204
  373   1HB   HIS  46          1HB       HIS  46   6.723 -11.811   0.191
  374   2HB   HIS  46          2HB       HIS  46   6.209 -12.871   1.505
  375    HD1  HIS  46           HD1      HIS  46   3.887 -12.535   2.317
  376    HD2  HIS  46           HD2      HIS  46   5.354  -9.186   0.317
  377    HE1  HIS  46           HE1      HIS  46   1.962 -10.912   2.198
  378    HE2  HIS  46           HE2      HIS  46   2.823  -8.963   0.844
  379    H    THR  47           H        THR  47   8.519 -13.355   3.008
  380    HA   THR  47           HA       THR  47   6.993 -13.623   5.404
  381    HB   THR  47           HB       THR  47   9.193 -15.102   5.946
  382    HG1  THR  47           HG1      THR  47   8.978 -15.251   3.112
  383   1HG2  THR  47          1HG2      THR  47   6.987 -16.019   5.910
  384   2HG2  THR  47          2HG2      THR  47   7.975 -16.984   4.813
  385   3HG2  THR  47          3HG2      THR  47   6.859 -15.782   4.166
  386    H    ARG  48           H        ARG  48  10.104 -12.255   4.549
  387    HA   ARG  48           HA       ARG  48  10.952 -11.530   7.160
  388   1HB   ARG  48          1HB       ARG  48  12.264 -11.536   4.903
  389   2HB   ARG  48          2HB       ARG  48  11.599  -9.919   4.710
  390   1HG   ARG  48          1HG       ARG  48  13.699  -9.585   5.666
  391   2HG   ARG  48          2HG       ARG  48  12.568  -9.420   7.012
  392   1HD   ARG  48          1HD       ARG  48  14.319 -10.761   7.828
  393   2HD   ARG  48          2HD       ARG  48  12.994 -11.870   7.480
  394    HE   ARG  48           HE       ARG  48  15.049 -11.501   5.429
  395   1HH1  ARG  48          1HH1      ARG  48  13.658 -13.496   7.954
  396   2HH1  ARG  48          2HH1      ARG  48  14.423 -14.954   7.393
  397   1HH2  ARG  48          1HH2      ARG  48  16.044 -13.398   4.694
  398   2HH2  ARG  48          2HH2      ARG  48  15.769 -14.909   5.521
  399    H    PHE  49           H        PHE  49   9.177  -9.821   4.618
  400    HA   PHE  49           HA       PHE  49   8.808  -7.367   5.849
  401   1HB   PHE  49          1HB       PHE  49   7.779  -8.726   3.582
  402   2HB   PHE  49          2HB       PHE  49   6.395  -8.129   4.487
  403    HD1  PHE  49           HD1      PHE  49   9.656  -6.456   4.415
  404    HD2  PHE  49           HD2      PHE  49   5.695  -6.523   2.870
  405    HE1  PHE  49           HE1      PHE  49  10.001  -4.217   3.459
  406    HE2  PHE  49           HE2      PHE  49   6.030  -4.287   1.901
  407    HZ   PHE  49           HZ       PHE  49   8.152  -3.155   2.132
  408    H    LYS  50           H        LYS  50   6.612 -10.156   5.886
  409    HA   LYS  50           HA       LYS  50   4.709  -9.092   7.611
  410   1HB   LYS  50          1HB       LYS  50   5.501 -11.965   7.127
  411   2HB   LYS  50          2HB       LYS  50   4.075 -11.483   8.037
  412   1HG   LYS  50          1HG       LYS  50   4.458 -10.448   5.266
  413   2HG   LYS  50          2HG       LYS  50   3.888 -12.100   5.514
  414   1HD   LYS  50          1HD       LYS  50   2.600  -9.734   6.851
  415   2HD   LYS  50          2HD       LYS  50   2.115 -10.287   5.246
  416   1HE   LYS  50          1HE       LYS  50   0.976 -12.024   6.079
  417   2HE   LYS  50          2HE       LYS  50   2.276 -12.448   7.191
  418   1HZ   LYS  50          1HZ       LYS  50   0.373 -11.867   8.465
  419   2HZ   LYS  50          2HZ       LYS  50   0.151 -10.420   7.609
  420   3HZ   LYS  50          3HZ       LYS  50   1.488 -10.601   8.632
  421    H    ALA  51           H        ALA  51   7.469 -11.205   8.407
  422    HA   ALA  51           HA       ALA  51   6.905 -11.300  11.172
  423   1HB   ALA  51          1HB       ALA  51   8.800 -12.432   9.393
  424   2HB   ALA  51          2HB       ALA  51   8.411 -12.918  11.045
  425   3HB   ALA  51          3HB       ALA  51   9.679 -11.727  10.751
  426    H    ALA  52           H        ALA  52   9.332  -9.404   9.364
  427    HA   ALA  52           HA       ALA  52  10.402  -8.161  11.647
  428   1HB   ALA  52          1HB       ALA  52  11.899  -7.305  10.235
  429   2HB   ALA  52          2HB       ALA  52  10.657  -6.607   9.194
  430   3HB   ALA  52          3HB       ALA  52  11.108  -8.301   9.016
  431    H    CYS  53           H        CYS  53   7.810  -7.149   9.436
  432    HA   CYS  53           HA       CYS  53   7.550  -4.552  10.548
  433   1HB   CYS  53          1HB       CYS  53   5.583  -4.314   9.269
  434   2HB   CYS  53          2HB       CYS  53   6.647  -5.327   8.304
  435    HG   CYS  53           HG       CYS  53   5.284  -7.621   8.561
  436    H    ALA  54           H        ALA  54   6.124  -7.692  11.276
  437    HA   ALA  54           HA       ALA  54   4.203  -6.823  13.147
  438   1HB   ALA  54          1HB       ALA  54   4.946  -9.243  12.074
  439   2HB   ALA  54          2HB       ALA  54   3.741  -9.001  13.338
  440   3HB   ALA  54          3HB       ALA  54   5.403  -9.403  13.770
  441    H    ARG  55           H        ARG  55   7.612  -7.635  13.414
  442    HA   ARG  55           HA       ARG  55   7.922  -7.632  16.186
  443   1HB   ARG  55          1HB       ARG  55   9.771  -6.908  13.922
  444   2HB   ARG  55          2HB       ARG  55  10.297  -6.813  15.597
  445   1HG   ARG  55          1HG       ARG  55   9.796  -9.199  15.873
  446   2HG   ARG  55          2HG       ARG  55   9.321  -9.278  14.175
  447   1HD   ARG  55          1HD       ARG  55  11.681  -8.259  13.754
  448   2HD   ARG  55          2HD       ARG  55  12.031  -8.873  15.368
  449    HE   ARG  55           HE       ARG  55  11.200 -11.092  14.383
  450   1HH1  ARG  55          1HH1      ARG  55  12.873  -8.618  12.535
  451   2HH1  ARG  55          2HH1      ARG  55  13.590  -9.768  11.436
  452   1HH2  ARG  55          1HH2      ARG  55  12.164 -12.577  12.948
  453   2HH2  ARG  55          2HH2      ARG  55  13.212 -11.996  11.684
  454    H    LYS  56           H        LYS  56   8.203  -4.947  13.872
  455    HA   LYS  56           HA       LYS  56   8.545  -3.075  16.069
  456   1HB   LYS  56          1HB       LYS  56   9.490  -3.191  13.443
  457   2HB   LYS  56          2HB       LYS  56   8.345  -1.857  13.450
  458   1HG   LYS  56          1HG       LYS  56   9.598  -1.052  15.537
  459   2HG   LYS  56          2HG       LYS  56  10.857  -2.184  15.046
  460   1HD   LYS  56          1HD       LYS  56  11.644  -0.498  13.800
  461   2HD   LYS  56          2HD       LYS  56  10.304  -0.860  12.710
  462   1HE   LYS  56          1HE       LYS  56   9.540   1.195  13.054
  463   2HE   LYS  56          2HE       LYS  56   9.227   0.750  14.731
  464   1HZ   LYS  56          1HZ       LYS  56  10.686   2.778  14.278
  465   2HZ   LYS  56          2HZ       LYS  56  11.902   1.672  13.869
  466   3HZ   LYS  56          3HZ       LYS  56  11.232   1.658  15.429
  467    H    GLY  57           H        GLY  57   5.912  -4.482  15.073
  468   1HA   GLY  57          1HA       GLY  57   3.674  -3.955  14.999
  469   2HA   GLY  57          2HA       GLY  57   4.107  -2.581  16.005
  470    H    THR  58           H        THR  58   5.002  -3.335  12.675
  471    HA   THR  58           HA       THR  58   4.031  -0.676  11.895
  472    HB   THR  58           HB       THR  58   5.996  -2.400  10.392
  473    HG1  THR  58           HG1      THR  58   6.314  -1.167  12.778
  474   1HG2  THR  58          1HG2      THR  58   4.836  -0.369   9.335
  475   2HG2  THR  58          2HG2      THR  58   6.595  -0.456   9.237
  476   3HG2  THR  58          3HG2      THR  58   5.828   0.600  10.428
  477    H    SER  59           H        SER  59   2.623  -0.391  10.254
  478    HA   SER  59           HA       SER  59   1.142  -2.654   9.275
  479   1HB   SER  59          1HB       SER  59   0.856   0.064   8.075
  480   2HB   SER  59          2HB       SER  59  -0.392  -1.105   8.520
  481    HG   SER  59           HG       SER  59   0.699  -0.510  10.779
  482    H    ILE  60           H        ILE  60   1.198  -3.552   7.263
  483    HA   ILE  60           HA       ILE  60   3.598  -3.802   6.010
  484    HB   ILE  60           HB       ILE  60   1.958  -5.442   5.588
  485   1HG1  ILE  60          1HG1      ILE  60   1.770  -4.635   2.841
  486   2HG1  ILE  60          2HG1      ILE  60   3.352  -4.182   3.467
  487   1HG2  ILE  60          1HG2      ILE  60   0.204  -3.906   3.818
  488   2HG2  ILE  60          2HG2      ILE  60   0.137  -3.436   5.519
  489   3HG2  ILE  60          3HG2      ILE  60  -0.187  -5.107   5.052
  490   1HD1  ILE  60          1HD1      ILE  60   2.990  -6.754   4.403
  491   2HD1  ILE  60          2HD1      ILE  60   3.970  -6.266   3.023
  492   3HD1  ILE  60          3HD1      ILE  60   2.305  -6.788   2.779
  493    H    THR  61           H        THR  61   1.004  -1.561   5.017
  494    HA   THR  61           HA       THR  61   2.338  -0.597   2.726
  495    HB   THR  61           HB       THR  61   0.526   1.213   4.249
  496    HG1  THR  61           HG1      THR  61  -0.359  -1.133   2.861
  497   1HG2  THR  61          1HG2      THR  61  -0.170   1.921   2.139
  498   2HG2  THR  61          2HG2      THR  61   0.329   0.416   1.362
  499   3HG2  THR  61          3HG2      THR  61   1.544   1.583   1.893
  500    H    ASP  62           H        ASP  62   2.345   0.392   6.085
  501    HA   ASP  62           HA       ASP  62   3.804   2.791   5.789
  502   1HB   ASP  62          1HB       ASP  62   2.446   1.855   7.818
  503   2HB   ASP  62          2HB       ASP  62   3.973   1.098   8.259
  504    H    VAL  63           H        VAL  63   4.733  -0.564   6.280
  505    HA   VAL  63           HA       VAL  63   7.444  -0.256   6.826
  506    HB   VAL  63           HB       VAL  63   6.204  -2.454   5.161
  507   1HG1  VAL  63          1HG1      VAL  63   8.236  -3.533   6.667
  508   2HG1  VAL  63          2HG1      VAL  63   8.887  -1.969   6.174
  509   3HG1  VAL  63          3HG1      VAL  63   8.321  -3.114   4.957
  510   1HG2  VAL  63          1HG2      VAL  63   6.039  -1.840   8.017
  511   2HG2  VAL  63          2HG2      VAL  63   6.535  -3.491   7.649
  512   3HG2  VAL  63          3HG2      VAL  63   5.016  -2.864   7.008
  513    H    VAL  64           H        VAL  64   5.875  -0.755   3.669
  514    HA   VAL  64           HA       VAL  64   8.196  -0.606   2.131
  515    HB   VAL  64           HB       VAL  64   5.731   0.505   0.910
  516   1HG1  VAL  64          1HG1      VAL  64   7.223  -1.847  -0.122
  517   2HG1  VAL  64          2HG1      VAL  64   8.040  -0.286  -0.123
  518   3HG1  VAL  64          3HG1      VAL  64   6.519  -0.483  -0.989
  519   1HG2  VAL  64          1HG2      VAL  64   4.995  -1.286   2.551
  520   2HG2  VAL  64          2HG2      VAL  64   5.884  -2.429   1.543
  521   3HG2  VAL  64          3HG2      VAL  64   4.533  -1.520   0.867
  522    H    ASN  65           H        ASN  65   5.947   1.978   3.103
  523    HA   ASN  65           HA       ASN  65   7.254   4.039   1.669
  524   1HB   ASN  65          1HB       ASN  65   4.982   3.889   3.213
  525   2HB   ASN  65          2HB       ASN  65   6.047   4.887   4.201
  526   1HD2  ASN  65          1HD2      ASN  65   3.694   5.066   2.008
  527   2HD2  ASN  65          2HD2      ASN  65   4.099   6.556   1.222
  528    H    GLN  66           H        GLN  66   7.818   2.595   4.808
  529    HA   GLN  66           HA       GLN  66   9.584   4.527   5.845
  530   1HB   GLN  66          1HB       GLN  66   8.547   2.028   6.651
  531   2HB   GLN  66          2HB       GLN  66  10.299   1.892   6.736
  532   1HG   GLN  66          1HG       GLN  66  10.302   2.996   8.647
  533   2HG   GLN  66          2HG       GLN  66   9.551   4.389   7.860
  534   1HE2  GLN  66          1HE2      GLN  66   7.248   4.459   7.769
  535   2HE2  GLN  66          2HE2      GLN  66   6.293   3.667   8.979
  536    H    LEU  67           H        LEU  67  10.266   1.466   4.110
  537    HA   LEU  67           HA       LEU  67  13.069   1.827   4.199
  538   1HB   LEU  67          1HB       LEU  67  12.888   0.193   2.116
  539   2HB   LEU  67          2HB       LEU  67  12.678  -0.350   3.768
  540    HG   LEU  67           HG       LEU  67  10.124   0.381   2.986
  541   1HD1  LEU  67          1HD1      LEU  67  11.319   0.350   0.639
  542   2HD1  LEU  67          2HD1      LEU  67   9.705  -0.326   0.854
  543   3HD1  LEU  67          3HD1      LEU  67  11.110  -1.394   0.813
  544   1HD2  LEU  67          1HD2      LEU  67  10.774  -1.514   4.382
  545   2HD2  LEU  67          2HD2      LEU  67  11.437  -2.335   2.964
  546   3HD2  LEU  67          3HD2      LEU  67   9.702  -2.019   3.071
  547    H    VAL  68           H        VAL  68  10.624   2.838   1.911
  548    HA   VAL  68           HA       VAL  68  12.341   3.621  -0.195
  549    HB   VAL  68           HB       VAL  68   9.659   4.752   0.635
  550   1HG1  VAL  68          1HG1      VAL  68   9.632   5.517  -1.807
  551   2HG1  VAL  68          2HG1      VAL  68  11.383   5.300  -1.763
  552   3HG1  VAL  68          3HG1      VAL  68  10.608   6.447  -0.671
  553   1HG2  VAL  68          1HG2      VAL  68  10.469   2.358  -0.755
  554   2HG2  VAL  68          2HG2      VAL  68   9.439   3.367  -1.770
  555   3HG2  VAL  68          3HG2      VAL  68   8.874   2.843  -0.184
  556    H    ASP  69           H        ASP  69  11.060   5.308   2.619
  557    HA   ASP  69           HA       ASP  69  12.338   7.795   2.207
  558   1HB   ASP  69          1HB       ASP  69  10.526   7.612   3.791
  559   2HB   ASP  69          2HB       ASP  69  11.403   6.406   4.727
  560    H    ASN  70           H        ASN  70  13.232   4.933   4.074
  561    HA   ASN  70           HA       ASN  70  15.552   5.766   5.276
  562   1HB   ASN  70          1HB       ASN  70  14.447   3.162   4.426
  563   2HB   ASN  70          2HB       ASN  70  16.188   3.186   4.672
  564   1HD2  ASN  70          1HD2      ASN  70  13.075   3.526   6.163
  565   2HD2  ASN  70          2HD2      ASN  70  13.617   3.361   7.801
  566    H    TRP  71           H        TRP  71  15.527   3.816   2.302
  567    HA   TRP  71           HA       TRP  71  18.252   4.153   1.776
  568   1HB   TRP  71          1HB       TRP  71  16.727   2.351   0.879
  569   2HB   TRP  71          2HB       TRP  71  16.137   3.530  -0.287
  570    HD1  TRP  71           HD1      TRP  71  19.386   1.679   0.665
  571    HE1  TRP  71           HE1      TRP  71  20.862   1.524  -1.439
  572    HE3  TRP  71           HE3      TRP  71  16.551   4.481  -2.539
  573    HZ2  TRP  71           HZ2      TRP  71  20.824   2.450  -4.102
  574    HZ3  TRP  71           HZ3      TRP  71  17.338   4.792  -4.846
  575    HH2  TRP  71           HH2      TRP  71  19.431   3.794  -5.616
  576    H    LEU  72           H        LEU  72  15.450   5.944   0.568
  577    HA   LEU  72           HA       LEU  72  16.789   7.441  -1.378
  578   1HB   LEU  72          1HB       LEU  72  14.210   7.427  -0.148
  579   2HB   LEU  72          2HB       LEU  72  14.789   9.079  -0.233
  580    HG   LEU  72           HG       LEU  72  14.821   9.093  -2.559
  581   1HD1  LEU  72          1HD1      LEU  72  14.234   6.504  -3.454
  582   2HD1  LEU  72          2HD1      LEU  72  15.530   6.327  -2.270
  583   3HD1  LEU  72          3HD1      LEU  72  15.742   7.401  -3.656
  584   1HD2  LEU  72          1HD2      LEU  72  12.578   7.174  -2.377
  585   2HD2  LEU  72          2HD2      LEU  72  12.632   8.797  -3.062
  586   3HD2  LEU  72          3HD2      LEU  72  12.521   8.582  -1.315
  587    H    LYS  73           H        LYS  73  16.056   8.299   1.999
  588    HA   LYS  73           HA       LYS  73  17.396  10.788   1.909
  589   1HB   LYS  73          1HB       LYS  73  16.547   9.001   4.174
  590   2HB   LYS  73          2HB       LYS  73  17.368  10.533   4.451
  591   1HG   LYS  73          1HG       LYS  73  15.283  11.120   2.681
  592   2HG   LYS  73          2HG       LYS  73  14.598  10.019   3.880
  593   1HD   LYS  73          1HD       LYS  73  15.879  11.599   5.559
  594   2HD   LYS  73          2HD       LYS  73  15.734  12.751   4.230
  595   1HE   LYS  73          1HE       LYS  73  13.814  13.150   5.472
  596   2HE   LYS  73          2HE       LYS  73  13.245  12.061   4.208
  597   1HZ   LYS  73          1HZ       LYS  73  14.163  10.964   6.784
  598   2HZ   LYS  73          2HZ       LYS  73  13.058  10.313   5.668
  599   3HZ   LYS  73          3HZ       LYS  73  12.600  11.615   6.651
  600    H    GLU  74           H        GLU  74  18.513   7.543   2.406
  601    HA   GLU  74           HA       GLU  74  20.981   8.256   3.654
  602   1HB   GLU  74          1HB       GLU  74  19.937   5.740   2.379
  603   2HB   GLU  74          2HB       GLU  74  21.607   5.859   2.920
  604   1HG   GLU  74          1HG       GLU  74  19.657   6.720   4.916
  605   2HG   GLU  74          2HG       GLU  74  19.494   5.032   4.431
  606    H    ASN  75           H        ASN  75  20.102   7.300   0.336
  607    HA   ASN  75           HA       ASN  75  22.808   7.653  -0.570
  608   1HB   ASN  75          1HB       ASN  75  22.156   6.692  -2.574
  609   2HB   ASN  75          2HB       ASN  75  21.043   5.957  -1.431
  610   1HD2  ASN  75          1HD2      ASN  75  18.894   6.416  -1.548
  611   2HD2  ASN  75          2HD2      ASN  75  18.181   7.290  -2.861
  612    H    GLU  76           H        GLU  76  20.009   9.667  -0.396
  613    HA   GLU  76           HA       GLU  76  20.847  11.458  -2.479
  614   1HB   GLU  76          1HB       GLU  76  18.620  11.326  -0.543
  615   2HB   GLU  76          2HB       GLU  76  19.105  12.941  -1.042
  616   1HG   GLU  76          1HG       GLU  76  18.527  10.768  -3.024
  617   2HG   GLU  76          2HG       GLU  76  17.262  11.810  -2.370
  618   1H    MET   1          1H        MET   1 -24.635 -58.527 -10.432
  619   2H    MET   1          2H        MET   1 -23.892 -58.664 -11.954
  620   3H    MET   1          3H        MET   1 -23.501 -57.369 -10.932
  621    HA   MET   1           HA       MET   1 -21.824 -59.205 -11.043
  622   1HB   MET   1          1HB       MET   1 -22.476 -57.464  -9.101
  623   2HB   MET   1          2HB       MET   1 -22.762 -58.968  -8.233
  624   1HG   MET   1          1HG       MET   1 -20.442 -59.671  -8.872
  625   2HG   MET   1          2HG       MET   1 -20.191 -58.040  -9.492
  626   1HE   MET   1          1HE       MET   1 -18.525 -57.279  -8.499
  627   2HE   MET   1          2HE       MET   1 -17.928 -57.855  -6.942
  628   3HE   MET   1          3HE       MET   1 -18.723 -56.285  -7.055
  629    H    SER   2           H        SER   2 -24.489 -60.482 -11.542
  630    HA   SER   2           HA       SER   2 -25.453 -62.514 -11.441
  631   1HB   SER   2          1HB       SER   2 -22.815 -63.437 -10.281
  632   2HB   SER   2          2HB       SER   2 -24.049 -64.457 -11.024
  633    HG   SER   2           HG       SER   2 -22.373 -62.521 -12.240
  634    H    LEU   3           H        LEU   3 -23.617 -63.614  -8.698
  635    HA   LEU   3           HA       LEU   3 -26.074 -63.540  -7.113
  636   1HB   LEU   3          1HB       LEU   3 -23.441 -64.932  -6.649
  637   2HB   LEU   3          2HB       LEU   3 -24.815 -65.024  -5.565
  638    HG   LEU   3           HG       LEU   3 -25.277 -65.792  -8.394
  639   1HD1  LEU   3          1HD1      LEU   3 -24.538 -68.173  -7.471
  640   2HD1  LEU   3          2HD1      LEU   3 -23.412 -67.174  -6.554
  641   3HD1  LEU   3          3HD1      LEU   3 -23.422 -67.098  -8.313
  642   1HD2  LEU   3          1HD2      LEU   3 -26.180 -66.901  -5.739
  643   2HD2  LEU   3          2HD2      LEU   3 -26.730 -67.446  -7.326
  644   3HD2  LEU   3          3HD2      LEU   3 -27.098 -65.810  -6.779
  645    H    GLU   4           H        GLU   4 -23.605 -61.521  -7.622
  646    HA   GLU   4           HA       GLU   4 -22.663 -59.773  -6.552
  647   1HB   GLU   4          1HB       GLU   4 -24.658 -60.000  -4.326
  648   2HB   GLU   4          2HB       GLU   4 -23.914 -58.560  -5.003
  649   1HG   GLU   4          1HG       GLU   4 -25.577 -58.282  -6.439
  650   2HG   GLU   4          2HG       GLU   4 -25.481 -59.958  -6.983
  651    H    LYS   5           H        LYS   5 -23.730 -60.741  -3.424
  652    HA   LYS   5           HA       LYS   5 -22.625 -61.402  -1.562
  653   1HB   LYS   5          1HB       LYS   5 -22.536 -63.459  -3.290
  654   2HB   LYS   5          2HB       LYS   5 -20.810 -63.187  -3.089
  655   1HG   LYS   5          1HG       LYS   5 -21.081 -64.626  -1.380
  656   2HG   LYS   5          2HG       LYS   5 -21.565 -63.163  -0.517
  657   1HD   LYS   5          1HD       LYS   5 -23.696 -63.833  -0.339
  658   2HD   LYS   5          2HD       LYS   5 -23.740 -64.432  -2.000
  659   1HE   LYS   5          1HE       LYS   5 -22.331 -65.893   0.222
  660   2HE   LYS   5          2HE       LYS   5 -24.032 -66.155  -0.158
  661   1HZ   LYS   5          1HZ       LYS   5 -21.778 -66.522  -2.059
  662   2HZ   LYS   5          2HZ       LYS   5 -23.414 -66.817  -2.386
  663   3HZ   LYS   5          3HZ       LYS   5 -22.591 -67.770  -1.249
  664    H    ALA   6           H        ALA   6 -21.667 -59.052  -2.475
  665    HA   ALA   6           HA       ALA   6 -18.870 -58.999  -2.906
  666   1HB   ALA   6          1HB       ALA   6 -20.782 -57.148  -3.141
  667   2HB   ALA   6          2HB       ALA   6 -19.075 -56.741  -2.970
  668   3HB   ALA   6          3HB       ALA   6 -20.140 -56.686  -1.566
  669    H    HIS   7           H        HIS   7 -17.399 -59.677  -1.518
  670    HA   HIS   7           HA       HIS   7 -17.958 -60.166   1.210
  671   1HB   HIS   7          1HB       HIS   7 -15.723 -60.542  -0.626
  672   2HB   HIS   7          2HB       HIS   7 -15.189 -60.124   0.998
  673    HD1  HIS   7           HD1      HIS   7 -14.363 -62.798   0.266
  674    HD2  HIS   7           HD2      HIS   7 -18.201 -62.090   1.703
  675    HE1  HIS   7           HE1      HIS   7 -15.173 -65.011   1.149
  676    HE2  HIS   7           HE2      HIS   7 -17.571 -64.601   1.824
  677    H    THR   8           H        THR   8 -17.820 -58.909   2.936
  678    HA   THR   8           HA       THR   8 -17.167 -56.148   2.730
  679    HB   THR   8           HB       THR   8 -17.283 -57.586   5.364
  680    HG1  THR   8           HG1      THR   8 -19.047 -58.459   4.330
  681   1HG2  THR   8          1HG2      THR   8 -16.899 -55.227   5.504
  682   2HG2  THR   8          2HG2      THR   8 -18.581 -55.514   5.958
  683   3HG2  THR   8          3HG2      THR   8 -18.194 -54.891   4.351
  684    H    SER   9           H        SER   9 -15.345 -55.052   3.393
  685    HA   SER   9           HA       SER   9 -12.896 -56.333   3.124
  686   1HB   SER   9          1HB       SER   9 -12.531 -53.934   4.621
  687   2HB   SER   9          2HB       SER   9 -12.279 -54.193   2.895
  688    HG   SER   9           HG       SER   9 -13.970 -52.581   3.806
  689    H    VAL  10           H        VAL  10 -12.071 -57.795   4.441
  690    HA   VAL  10           HA       VAL  10 -12.693 -57.816   7.270
  691    HB   VAL  10           HB       VAL  10 -10.661 -59.629   6.002
  692   1HG1  VAL  10          1HG1      VAL  10 -10.979 -60.957   7.808
  693   2HG1  VAL  10          2HG1      VAL  10 -12.696 -60.571   7.927
  694   3HG1  VAL  10          3HG1      VAL  10 -11.494 -59.438   8.540
  695   1HG2  VAL  10          1HG2      VAL  10 -12.150 -60.415   4.544
  696   2HG2  VAL  10          2HG2      VAL  10 -13.434 -59.413   5.223
  697   3HG2  VAL  10          3HG2      VAL  10 -13.089 -60.995   5.920
  698    H    LYS  11           H        LYS  11 -11.688 -56.185   8.316
  699    HA   LYS  11           HA       LYS  11  -8.854 -55.689   7.795
  700   1HB   LYS  11          1HB       LYS  11 -11.060 -54.065   8.629
  701   2HB   LYS  11          2HB       LYS  11  -9.818 -54.009   9.874
  702   1HG   LYS  11          1HG       LYS  11  -9.530 -53.288   6.968
  703   2HG   LYS  11          2HG       LYS  11  -9.434 -52.210   8.361
  704   1HD   LYS  11          1HD       LYS  11  -7.383 -53.195   9.079
  705   2HD   LYS  11          2HD       LYS  11  -7.533 -54.503   7.903
  706   1HE   LYS  11          1HE       LYS  11  -7.402 -51.644   7.021
  707   2HE   LYS  11          2HE       LYS  11  -5.932 -52.543   7.390
  708   1HZ   LYS  11          1HZ       LYS  11  -7.342 -52.548   5.015
  709   2HZ   LYS  11          2HZ       LYS  11  -7.634 -54.068   5.708
  710   3HZ   LYS  11          3HZ       LYS  11  -6.039 -53.551   5.436
  711    H    LYS  12           H        LYS  12  -9.268 -58.126   8.868
  712    HA   LYS  12           HA       LYS  12  -8.885 -58.004  11.746
  713   1HB   LYS  12          1HB       LYS  12  -9.840 -59.942   9.922
  714   2HB   LYS  12          2HB       LYS  12  -8.367 -60.599  10.623
  715   1HG   LYS  12          1HG       LYS  12 -10.048 -61.359  12.035
  716   2HG   LYS  12          2HG       LYS  12  -9.390 -59.960  12.885
  717   1HD   LYS  12          1HD       LYS  12 -11.258 -58.648  11.652
  718   2HD   LYS  12          2HD       LYS  12 -11.986 -60.240  11.423
  719   1HE   LYS  12          1HE       LYS  12 -12.547 -60.437  13.594
  720   2HE   LYS  12          2HE       LYS  12 -11.059 -59.672  14.152
  721   1HZ   LYS  12          1HZ       LYS  12 -11.964 -57.546  13.831
  722   2HZ   LYS  12          2HZ       LYS  12 -13.193 -58.434  14.584
  723   3HZ   LYS  12          3HZ       LYS  12 -13.267 -58.128  12.917
  724    H    MET  13           H        MET  13  -6.952 -56.563  10.707
  725    HA   MET  13           HA       MET  13  -4.545 -57.944  11.389
  726   1HB   MET  13          1HB       MET  13  -3.482 -58.102   9.336
  727   2HB   MET  13          2HB       MET  13  -5.128 -58.544   8.913
  728   1HG   MET  13          1HG       MET  13  -4.359 -55.686   8.689
  729   2HG   MET  13          2HG       MET  13  -3.726 -56.815   7.493
  730   1HE   MET  13          1HE       MET  13  -6.718 -58.058   5.567
  731   2HE   MET  13          2HE       MET  13  -5.269 -58.607   6.413
  732   3HE   MET  13          3HE       MET  13  -5.160 -57.295   5.236
  733    H    THR  14           H        THR  14  -2.612 -56.436  10.962
  734    HA   THR  14           HA       THR  14  -3.322 -53.774  11.853
  735    HB   THR  14           HB       THR  14  -0.637 -53.689  11.444
  736    HG1  THR  14           HG1      THR  14  -0.915 -56.279  12.487
  737   1HG2  THR  14          1HG2      THR  14  -2.272 -54.608  13.786
  738   2HG2  THR  14          2HG2      THR  14  -1.456 -53.063  13.537
  739   3HG2  THR  14          3HG2      THR  14  -0.515 -54.510  13.891
  740    H    PHE  15           H        PHE  15  -3.014 -51.887  10.685
  741    HA   PHE  15           HA       PHE  15  -2.591 -52.281   7.794
  742   1HB   PHE  15          1HB       PHE  15  -4.238 -50.776   7.357
  743   2HB   PHE  15          2HB       PHE  15  -4.771 -51.188   8.979
  744    HD1  PHE  15           HD1      PHE  15  -3.982 -49.700  10.896
  745    HD2  PHE  15           HD2      PHE  15  -3.696 -48.579   6.800
  746    HE1  PHE  15           HE1      PHE  15  -3.786 -47.341  11.560
  747    HE2  PHE  15           HE2      PHE  15  -3.499 -46.218   7.457
  748    HZ   PHE  15           HZ       PHE  15  -3.556 -45.590   9.827
  749    H    GLY  16           H        GLY  16  -1.288 -50.984  10.600
  750   1HA   GLY  16          1HA       GLY  16   1.124 -50.286  10.213
  751   2HA   GLY  16          2HA       GLY  16   0.440 -49.136   9.071
  752    H    GLU  17           H        GLU  17  -0.775 -50.089  12.253
  753    HA   GLU  17           HA       GLU  17  -1.260 -47.395  13.009
  754   1HB   GLU  17          1HB       GLU  17  -1.260 -49.915  14.687
  755   2HB   GLU  17          2HB       GLU  17  -1.961 -48.370  15.157
  756   1HG   GLU  17          1HG       GLU  17  -3.848 -49.327  14.403
  757   2HG   GLU  17          2HG       GLU  17  -3.254 -48.744  12.848
  758    H    ASN  18           H        ASN  18   1.190 -49.783  13.852
  759    HA   ASN  18           HA       ASN  18   2.518 -48.209  15.808
  760   1HB   ASN  18          1HB       ASN  18   4.350 -49.817  15.614
  761   2HB   ASN  18          2HB       ASN  18   2.806 -50.658  15.676
  762   1HD2  ASN  18          1HD2      ASN  18   2.055 -51.729  13.857
  763   2HD2  ASN  18          2HD2      ASN  18   3.086 -52.078  12.499
  764    H    ARG  19           H        ARG  19   2.487 -48.186  12.392
  765    HA   ARG  19           HA       ARG  19   4.972 -46.744  12.063
  766   1HB   ARG  19          1HB       ARG  19   3.968 -48.269  10.313
  767   2HB   ARG  19          2HB       ARG  19   2.711 -47.063  10.078
  768   1HG   ARG  19          1HG       ARG  19   4.004 -45.981   8.651
  769   2HG   ARG  19          2HG       ARG  19   5.226 -45.757   9.906
  770   1HD   ARG  19          1HD       ARG  19   4.950 -48.176   8.123
  771   2HD   ARG  19          2HD       ARG  19   6.136 -46.887   7.926
  772    HE   ARG  19           HE       ARG  19   6.134 -48.990   9.950
  773   1HH1  ARG  19          1HH1      ARG  19   7.584 -46.063   8.685
  774   2HH1  ARG  19          2HH1      ARG  19   9.052 -46.239   9.599
  775   1HH2  ARG  19          1HH2      ARG  19   8.076 -49.241  11.139
  776   2HH2  ARG  19          2HH2      ARG  19   9.335 -48.048  10.994
  777    H    ASP  20           H        ASP  20   4.974 -44.798  13.030
  778    HA   ASP  20           HA       ASP  20   2.603 -43.123  12.998
  779   1HB   ASP  20          1HB       ASP  20   3.936 -43.168  15.039
  780   2HB   ASP  20          2HB       ASP  20   5.363 -42.646  14.148
  781    H    LEU  21           H        LEU  21   2.178 -41.994  11.225
  782    HA   LEU  21           HA       LEU  21   4.270 -40.369  10.030
  783   1HB   LEU  21          1HB       LEU  21   4.078 -42.751   8.939
  784   2HB   LEU  21          2HB       LEU  21   2.674 -42.057   8.154
  785    HG   LEU  21           HG       LEU  21   4.280 -40.164   7.420
  786   1HD1  LEU  21          1HD1      LEU  21   6.373 -42.277   7.688
  787   2HD1  LEU  21          2HD1      LEU  21   6.070 -41.155   9.015
  788   3HD1  LEU  21          3HD1      LEU  21   6.554 -40.541   7.432
  789   1HD2  LEU  21          1HD2      LEU  21   4.879 -42.813   6.167
  790   2HD2  LEU  21          2HD2      LEU  21   4.625 -41.245   5.399
  791   3HD2  LEU  21          3HD2      LEU  21   3.258 -42.128   6.084
  792    H    GLU  22           H        GLU  22   2.505 -39.127  11.342
  793    HA   GLU  22           HA       GLU  22   0.292 -38.407   9.549
  794   1HB   GLU  22          1HB       GLU  22   0.692 -37.732  12.471
  795   2HB   GLU  22          2HB       GLU  22  -0.707 -37.293  11.500
  796   1HG   GLU  22          1HG       GLU  22   0.123 -40.140  11.937
  797   2HG   GLU  22          2HG       GLU  22  -0.958 -39.283  13.035
  798    H    ARG  23           H        ARG  23   1.107 -36.941   8.147
  799    HA   ARG  23           HA       ARG  23   2.691 -34.725   9.263
  800   1HB   ARG  23          1HB       ARG  23   2.599 -35.389   6.339
  801   2HB   ARG  23          2HB       ARG  23   3.854 -34.558   7.244
  802   1HG   ARG  23          1HG       ARG  23   4.938 -36.454   7.671
  803   2HG   ARG  23          2HG       ARG  23   3.460 -37.278   8.169
  804   1HD   ARG  23          1HD       ARG  23   4.872 -37.321   5.600
  805   2HD   ARG  23          2HD       ARG  23   3.793 -38.514   6.321
  806    HE   ARG  23           HE       ARG  23   1.924 -37.257   5.451
  807   1HH1  ARG  23          1HH1      ARG  23   5.080 -36.323   4.239
  808   2HH1  ARG  23          2HH1      ARG  23   4.450 -35.621   2.778
  809   1HH2  ARG  23          1HH2      ARG  23   1.088 -36.293   3.533
  810   2HH2  ARG  23          2HH2      ARG  23   2.196 -35.610   2.376
  811    H    VAL  24           H        VAL  24   1.275 -33.156   9.730
  812    HA   VAL  24           HA       VAL  24  -0.741 -32.457   7.701
  813    HB   VAL  24           HB       VAL  24  -1.536 -30.944   9.737
  814   1HG1  VAL  24          1HG1      VAL  24  -3.086 -32.738  10.363
  815   2HG1  VAL  24          2HG1      VAL  24  -2.078 -33.901   9.506
  816   3HG1  VAL  24          3HG1      VAL  24  -2.892 -32.615   8.616
  817   1HG2  VAL  24          1HG2      VAL  24  -1.138 -31.825  11.874
  818   2HG2  VAL  24          2HG2      VAL  24   0.447 -31.790  11.102
  819   3HG2  VAL  24          3HG2      VAL  24  -0.439 -33.310  11.229
  820    H    VAL  25           H        VAL  25   1.015 -31.461   6.467
  821    HA   VAL  25           HA       VAL  25   1.464 -28.701   7.358
  822    HB   VAL  25           HB       VAL  25   3.607 -29.622   7.663
  823   1HG1  VAL  25          1HG1      VAL  25   3.322 -31.774   6.663
  824   2HG1  VAL  25          2HG1      VAL  25   4.750 -31.017   5.957
  825   3HG1  VAL  25          3HG1      VAL  25   3.239 -31.067   5.050
  826   1HG2  VAL  25          1HG2      VAL  25   4.251 -27.743   6.623
  827   2HG2  VAL  25          2HG2      VAL  25   3.213 -28.034   5.225
  828   3HG2  VAL  25          3HG2      VAL  25   4.773 -28.848   5.351
  829    H    THR  26           H        THR  26   0.454 -27.383   6.017
  830    HA   THR  26           HA       THR  26   0.416 -28.016   3.148
  831    HB   THR  26           HB       THR  26  -1.989 -26.659   3.746
  832    HG1  THR  26           HG1      THR  26  -2.260 -27.317   5.768
  833   1HG2  THR  26          1HG2      THR  26  -1.539 -28.313   1.926
  834   2HG2  THR  26          2HG2      THR  26  -3.040 -28.611   2.802
  835   3HG2  THR  26          3HG2      THR  26  -1.616 -29.595   3.134
  836    H    ALA  27           H        ALA  27   1.599 -26.451   2.272
  837    HA   ALA  27           HA       ALA  27   1.369 -23.715   3.309
  838   1HB   ALA  27          1HB       ALA  27   3.329 -23.780   1.309
  839   2HB   ALA  27          2HB       ALA  27   3.525 -25.277   2.220
  840   3HB   ALA  27          3HB       ALA  27   3.577 -23.725   3.055
  841    HA   PRO  28           HA       PRO  28  -1.291 -23.081  -0.252
  842   1HB   PRO  28          1HB       PRO  28  -1.800 -20.447   0.883
  843   2HB   PRO  28          2HB       PRO  28  -2.901 -21.818   0.725
  844   1HG   PRO  28          1HG       PRO  28  -1.973 -20.941   3.120
  845   2HG   PRO  28          2HG       PRO  28  -2.391 -22.634   2.809
  846   1HD   PRO  28          1HD       PRO  28   0.304 -21.324   2.850
  847   2HD   PRO  28          2HD       PRO  28  -0.197 -22.896   3.513
  848    H    VAL  29           H        VAL  29   0.759 -22.947  -1.507
  849    HA   VAL  29           HA       VAL  29   1.835 -20.285  -1.910
  850    HB   VAL  29           HB       VAL  29   2.565 -22.794  -3.424
  851   1HG1  VAL  29          1HG1      VAL  29   3.532 -21.077  -4.602
  852   2HG1  VAL  29          2HG1      VAL  29   4.803 -21.430  -3.433
  853   3HG1  VAL  29          3HG1      VAL  29   3.725 -20.060  -3.175
  854   1HG2  VAL  29          1HG2      VAL  29   2.760 -22.911  -0.868
  855   2HG2  VAL  29          2HG2      VAL  29   4.070 -21.745  -1.051
  856   3HG2  VAL  29          3HG2      VAL  29   4.182 -23.326  -1.826
  857    H    SER  30           H        SER  30   0.000 -19.249  -2.759
  858    HA   SER  30           HA       SER  30  -1.162 -20.161  -5.243
  859   1HB   SER  30          1HB       SER  30  -1.637 -17.400  -4.233
  860   2HB   SER  30          2HB       SER  30  -2.789 -18.585  -4.850
  861    HG   SER  30           HG       SER  30  -2.156 -18.031  -2.303
  862    H    SER  31           H        SER  31   1.164 -17.813  -4.129
  863    HA   SER  31           HA       SER  31   1.769 -17.129  -6.928
  864   1HB   SER  31          1HB       SER  31   2.990 -15.303  -5.089
  865   2HB   SER  31          2HB       SER  31   1.774 -14.969  -6.323
  866    HG   SER  31           HG       SER  31   0.169 -15.353  -4.855
  867    H    GLY  32           H        GLY  32   3.480 -18.228  -7.594
  868   1HA   GLY  32          1HA       GLY  32   5.202 -19.569  -5.780
  869   2HA   GLY  32          2HA       GLY  32   5.376 -19.519  -7.526
  870    H    LYS  33           H        LYS  33   6.346 -18.182  -4.499
  871    HA   LYS  33           HA       LYS  33   8.165 -17.021  -3.840
  872   1HB   LYS  33          1HB       LYS  33   9.053 -18.697  -5.726
  873   2HB   LYS  33          2HB       LYS  33   9.478 -17.174  -6.497
  874   1HG   LYS  33          1HG       LYS  33  10.762 -16.538  -4.507
  875   2HG   LYS  33          2HG       LYS  33  10.351 -18.081  -3.759
  876   1HD   LYS  33          1HD       LYS  33  11.425 -19.200  -5.748
  877   2HD   LYS  33          2HD       LYS  33  12.018 -17.606  -6.223
  878   1HE   LYS  33          1HE       LYS  33  13.703 -18.880  -4.975
  879   2HE   LYS  33          2HE       LYS  33  13.230 -17.404  -4.133
  880   1HZ   LYS  33          1HZ       LYS  33  13.277 -19.918  -3.076
  881   2HZ   LYS  33          2HZ       LYS  33  11.630 -19.646  -3.369
  882   3HZ   LYS  33          3HZ       LYS  33  12.510 -18.567  -2.404
  883    H    ILE  34           H        ILE  34   5.965 -15.685  -5.552
  884    HA   ILE  34           HA       ILE  34   7.416 -13.152  -5.761
  885    HB   ILE  34           HB       ILE  34   5.866 -12.580  -7.732
  886   1HG1  ILE  34          1HG1      ILE  34   5.917 -15.235  -8.814
  887   2HG1  ILE  34          2HG1      ILE  34   5.069 -15.266  -7.271
  888   1HG2  ILE  34          1HG2      ILE  34   7.651 -12.852  -9.072
  889   2HG2  ILE  34          2HG2      ILE  34   7.814 -14.565  -8.690
  890   3HG2  ILE  34          3HG2      ILE  34   8.447 -13.351  -7.578
  891   1HD1  ILE  34          1HD1      ILE  34   3.436 -13.771  -8.013
  892   2HD1  ILE  34          2HD1      ILE  34   3.696 -14.862  -9.375
  893   3HD1  ILE  34          3HD1      ILE  34   4.413 -13.250  -9.387
  894    H    LYS  35           H        LYS  35   6.449 -11.516  -4.818
  895    HA   LYS  35           HA       LYS  35   3.589 -11.713  -4.136
  896   1HB   LYS  35          1HB       LYS  35   5.756 -10.690  -2.285
  897   2HB   LYS  35          2HB       LYS  35   4.051 -10.904  -1.901
  898   1HG   LYS  35          1HG       LYS  35   5.443 -13.325  -2.824
  899   2HG   LYS  35          2HG       LYS  35   5.994 -12.674  -1.279
  900   1HD   LYS  35          1HD       LYS  35   4.302 -14.119  -0.639
  901   2HD   LYS  35          2HD       LYS  35   3.468 -12.565  -0.708
  902   1HE   LYS  35          1HE       LYS  35   2.012 -13.469  -2.116
  903   2HE   LYS  35          2HE       LYS  35   3.316 -13.641  -3.291
  904   1HZ   LYS  35          1HZ       LYS  35   2.386 -15.643  -1.315
  905   2HZ   LYS  35          2HZ       LYS  35   3.838 -15.810  -2.181
  906   3HZ   LYS  35          3HZ       LYS  35   2.353 -15.756  -3.005
  907    H    ARG  36           H        ARG  36   2.711  -9.476  -3.518
  908    HA   ARG  36           HA       ARG  36   4.255  -7.332  -4.780
  909   1HB   ARG  36          1HB       ARG  36   2.222  -6.640  -6.088
  910   2HB   ARG  36          2HB       ARG  36   3.004  -8.113  -6.637
  911   1HG   ARG  36          1HG       ARG  36   1.307  -9.458  -5.564
  912   2HG   ARG  36          2HG       ARG  36   0.547  -8.010  -4.901
  913   1HD   ARG  36          1HD       ARG  36   0.929  -7.862  -7.779
  914   2HD   ARG  36          2HD       ARG  36  -0.071  -9.232  -7.298
  915    HE   ARG  36           HE       ARG  36  -1.333  -7.422  -5.964
  916   1HH1  ARG  36          1HH1      ARG  36   0.213  -6.911  -9.066
  917   2HH1  ARG  36          2HH1      ARG  36  -0.927  -5.696  -9.580
  918   1HH2  ARG  36          1HH2      ARG  36  -2.830  -5.824  -6.626
  919   2HH2  ARG  36          2HH2      ARG  36  -2.695  -5.122  -8.217
  920    H    VAL  37           H        VAL  37   3.511  -5.215  -4.346
  921    HA   VAL  37           HA       VAL  37   1.455  -4.903  -2.304
  922    HB   VAL  37           HB       VAL  37   3.865  -5.177  -1.297
  923   1HG1  VAL  37          1HG1      VAL  37   3.897  -2.271  -2.100
  924   2HG1  VAL  37          2HG1      VAL  37   4.953  -3.532  -2.728
  925   3HG1  VAL  37          3HG1      VAL  37   5.057  -3.061  -1.032
  926   1HG2  VAL  37          1HG2      VAL  37   1.947  -4.665   0.052
  927   2HG2  VAL  37          2HG2      VAL  37   1.960  -2.986  -0.494
  928   3HG2  VAL  37          3HG2      VAL  37   3.270  -3.594   0.518
  929    H    ASN  38           H        ASN  38   0.685  -2.737  -2.129
  930    HA   ASN  38           HA       ASN  38   1.400  -1.025  -4.423
  931   1HB   ASN  38          1HB       ASN  38  -0.899  -2.030  -4.502
  932   2HB   ASN  38          2HB       ASN  38  -1.275  -1.164  -3.015
  933   1HD2  ASN  38          1HD2      ASN  38  -0.486  -0.832  -6.397
  934   2HD2  ASN  38          2HD2      ASN  38  -1.110   0.771  -6.580
  935    H    VAL  39           H        VAL  39   2.313   0.852  -3.871
  936    HA   VAL  39           HA       VAL  39   1.653   1.987  -1.234
  937    HB   VAL  39           HB       VAL  39   4.287   2.796  -1.928
  938   1HG1  VAL  39          1HG1      VAL  39   2.820   1.957   0.309
  939   2HG1  VAL  39          2HG1      VAL  39   4.442   2.650   0.276
  940   3HG1  VAL  39          3HG1      VAL  39   4.228   0.899   0.221
  941   1HG2  VAL  39          1HG2      VAL  39   3.933  -0.201  -1.972
  942   2HG2  VAL  39          2HG2      VAL  39   5.478   0.641  -1.836
  943   3HG2  VAL  39          3HG2      VAL  39   4.506   0.812  -3.297
  944    H    ASN  40           H        ASN  40   1.865   4.243  -1.033
  945    HA   ASN  40           HA       ASN  40   1.974   5.732  -3.572
  946   1HB   ASN  40          1HB       ASN  40   0.006   5.959  -1.305
  947   2HB   ASN  40          2HB       ASN  40   0.362   7.351  -2.314
  948   1HD2  ASN  40          1HD2      ASN  40  -1.298   4.372  -2.069
  949   2HD2  ASN  40          2HD2      ASN  40  -2.061   4.417  -3.627
  950    H    PHE  41           H        PHE  41   3.497   7.227  -3.593
  951    HA   PHE  41           HA       PHE  41   4.648   8.105  -1.019
  952   1HB   PHE  41          1HB       PHE  41   6.093   7.963  -3.675
  953   2HB   PHE  41          2HB       PHE  41   6.801   8.254  -2.088
  954    HD1  PHE  41           HD1      PHE  41   6.079   6.289  -0.339
  955    HD2  PHE  41           HD2      PHE  41   6.513   5.901  -4.554
  956    HE1  PHE  41           HE1      PHE  41   6.478   3.878  -0.076
  957    HE2  PHE  41           HE2      PHE  41   6.908   3.487  -4.297
  958    HZ   PHE  41           HZ       PHE  41   6.887   2.475  -2.053
  959    H    ASP  42           H        ASP  42   5.791  10.256  -1.182
  960    HA   ASP  42           HA       ASP  42   3.970  12.136  -2.430
  961   1HB   ASP  42          1HB       ASP  42   4.611  13.611  -0.842
  962   2HB   ASP  42          2HB       ASP  42   5.250  12.181  -0.042
  963    H    GLU  43           H        GLU  43   5.052  14.169  -3.401
  964    HA   GLU  43           HA       GLU  43   6.246  13.390  -5.808
  965   1HB   GLU  43          1HB       GLU  43   6.141  16.141  -4.569
  966   2HB   GLU  43          2HB       GLU  43   6.465  15.787  -6.262
  967   1HG   GLU  43          1HG       GLU  43   3.959  14.751  -5.053
  968   2HG   GLU  43          2HG       GLU  43   4.067  16.472  -5.424
  969    H    GLU  44           H        GLU  44   7.668  14.777  -2.874
  970    HA   GLU  44           HA       GLU  44  10.260  15.230  -3.891
  971   1HB   GLU  44          1HB       GLU  44   9.016  15.015  -1.222
  972   2HB   GLU  44          2HB       GLU  44  10.736  14.653  -1.290
  973   1HG   GLU  44          1HG       GLU  44   9.714  17.126  -2.597
  974   2HG   GLU  44          2HG       GLU  44   9.894  17.086  -0.844
  975    H    LYS  45           H        LYS  45   8.760  12.451  -2.345
  976    HA   LYS  45           HA       LYS  45  10.990  10.758  -2.205
  977   1HB   LYS  45          1HB       LYS  45   8.129  10.556  -1.886
  978   2HB   LYS  45          2HB       LYS  45   8.732   9.161  -2.771
  979   1HG   LYS  45          1HG       LYS  45   9.359   8.252  -0.860
  980   2HG   LYS  45          2HG       LYS  45  10.501   9.577  -0.618
  981   1HD   LYS  45          1HD       LYS  45   7.808  10.400   0.019
  982   2HD   LYS  45          2HD       LYS  45   8.263   8.963   0.939
  983   1HE   LYS  45          1HE       LYS  45   8.944  10.772   2.271
  984   2HE   LYS  45          2HE       LYS  45  10.419  10.200   1.492
  985   1HZ   LYS  45          1HZ       LYS  45  10.626  12.078   0.294
  986   2HZ   LYS  45          2HZ       LYS  45   9.692  12.750   1.536
  987   3HZ   LYS  45          3HZ       LYS  45   8.952  12.284   0.084
  988    H    HIS  46           H        HIS  46   8.903  11.649  -4.839
  989    HA   HIS  46           HA       HIS  46   9.860   9.526  -6.552
  990   1HB   HIS  46          1HB       HIS  46   7.521  10.694  -6.580
  991   2HB   HIS  46          2HB       HIS  46   8.341  11.882  -7.589
  992    HD1  HIS  46           HD1      HIS  46   8.460  11.355 -10.017
  993    HD2  HIS  46           HD2      HIS  46   7.762   7.968  -7.700
  994    HE1  HIS  46           HE1      HIS  46   8.089   9.469 -11.648
  995    HE2  HIS  46           HE2      HIS  46   7.519   7.470 -10.226
  996    H    THR  47           H        THR  47  10.484  12.953  -6.073
  997    HA   THR  47           HA       THR  47  12.116  13.276  -8.392
  998    HB   THR  47           HB       THR  47  12.438  14.898  -5.877
  999    HG1  THR  47           HG1      THR  47  10.144  14.523  -7.219
 1000   1HG2  THR  47          1HG2      THR  47  12.739  15.444  -8.826
 1001   2HG2  THR  47          2HG2      THR  47  13.980  15.517  -7.575
 1002   3HG2  THR  47          3HG2      THR  47  12.696  16.725  -7.616
 1003    H    ARG  48           H        ARG  48  12.703  12.427  -5.025
 1004    HA   ARG  48           HA       ARG  48  15.540  12.210  -5.204
 1005   1HB   ARG  48          1HB       ARG  48  13.428  11.246  -3.314
 1006   2HB   ARG  48          2HB       ARG  48  15.039  10.552  -3.208
 1007   1HG   ARG  48          1HG       ARG  48  14.163  12.789  -1.899
 1008   2HG   ARG  48          2HG       ARG  48  15.847  12.342  -2.156
 1009   1HD   ARG  48          1HD       ARG  48  16.189  13.983  -3.653
 1010   2HD   ARG  48          2HD       ARG  48  14.596  13.793  -4.383
 1011    HE   ARG  48           HE       ARG  48  13.693  15.253  -2.749
 1012   1HH1  ARG  48          1HH1      ARG  48  17.187  14.921  -2.540
 1013   2HH1  ARG  48          2HH1      ARG  48  17.376  16.339  -1.546
 1014   1HH2  ARG  48          1HH2      ARG  48  13.948  17.091  -1.436
 1015   2HH2  ARG  48          2HH2      ARG  48  15.544  17.552  -0.896
 1016    H    PHE  49           H        PHE  49  12.829  10.058  -5.753
 1017    HA   PHE  49           HA       PHE  49  14.254   7.654  -6.110
 1018   1HB   PHE  49          1HB       PHE  49  11.605   8.358  -6.046
 1019   2HB   PHE  49          2HB       PHE  49  11.836   7.982  -7.751
 1020    HD1  PHE  49           HD1      PHE  49  13.923   6.275  -5.348
 1021    HD2  PHE  49           HD2      PHE  49  10.249   6.130  -7.481
 1022    HE1  PHE  49           HE1      PHE  49  13.725   3.880  -4.831
 1023    HE2  PHE  49           HE2      PHE  49  10.042   3.736  -6.967
 1024    HZ   PHE  49           HZ       PHE  49  11.810   2.595  -5.694
 1025    H    LYS  50           H        LYS  50  13.146  10.106  -8.432
 1026    HA   LYS  50           HA       LYS  50  14.026   8.823 -10.761
 1027   1HB   LYS  50          1HB       LYS  50  12.810  11.257 -10.108
 1028   2HB   LYS  50          2HB       LYS  50  14.299  11.707 -10.925
 1029   1HG   LYS  50          1HG       LYS  50  12.754   9.578 -12.234
 1030   2HG   LYS  50          2HG       LYS  50  11.972  11.159 -12.178
 1031   1HD   LYS  50          1HD       LYS  50  14.811  10.816 -13.097
 1032   2HD   LYS  50          2HD       LYS  50  13.446  10.651 -14.202
 1033   1HE   LYS  50          1HE       LYS  50  12.877  12.881 -14.041
 1034   2HE   LYS  50          2HE       LYS  50  13.650  13.072 -12.468
 1035   1HZ   LYS  50          1HZ       LYS  50  15.814  12.719 -13.709
 1036   2HZ   LYS  50          2HZ       LYS  50  15.018  14.191 -13.978
 1037   3HZ   LYS  50          3HZ       LYS  50  14.928  12.957 -15.135
 1038    H    ALA  51           H        ALA  51  15.702  10.922  -8.493
 1039    HA   ALA  51           HA       ALA  51  18.099  11.182  -9.996
 1040   1HB   ALA  51          1HB       ALA  51  17.131  11.954  -7.374
 1041   2HB   ALA  51          2HB       ALA  51  18.319  12.738  -8.413
 1042   3HB   ALA  51          3HB       ALA  51  18.816  11.436  -7.332
 1043    H    ALA  52           H        ALA  52  17.071   9.011  -7.393
 1044    HA   ALA  52           HA       ALA  52  19.474   7.553  -7.190
 1045   1HB   ALA  52          1HB       ALA  52  17.871   5.770  -6.216
 1046   2HB   ALA  52          2HB       ALA  52  16.644   7.028  -6.381
 1047   3HB   ALA  52          3HB       ALA  52  18.066   7.309  -5.374
 1048    H    CYS  53           H        CYS  53  16.545   7.006  -9.110
 1049    HA   CYS  53           HA       CYS  53  17.184   4.502 -10.188
 1050   1HB   CYS  53          1HB       CYS  53  15.045   6.070 -10.375
 1051   2HB   CYS  53          2HB       CYS  53  15.807   6.546 -11.885
 1052    HG   CYS  53           HG       CYS  53  16.022   3.538 -12.383
 1053    H    ALA  54           H        ALA  54  17.854   7.765 -11.442
 1054    HA   ALA  54           HA       ALA  54  19.283   6.871 -13.727
 1055   1HB   ALA  54          1HB       ALA  54  18.672   9.441 -12.443
 1056   2HB   ALA  54          2HB       ALA  54  18.654   8.989 -14.147
 1057   3HB   ALA  54          3HB       ALA  54  20.177   9.404 -13.361
 1058    H    ARG  55           H        ARG  55  20.169   7.500 -10.422
 1059    HA   ARG  55           HA       ARG  55  22.976   7.700 -10.851
 1060   1HB   ARG  55          1HB       ARG  55  21.374   8.223  -8.742
 1061   2HB   ARG  55          2HB       ARG  55  22.006   6.656  -8.258
 1062   1HG   ARG  55          1HG       ARG  55  23.893   7.583  -7.594
 1063   2HG   ARG  55          2HG       ARG  55  24.162   8.261  -9.202
 1064   1HD   ARG  55          1HD       ARG  55  24.139  10.066  -7.631
 1065   2HD   ARG  55          2HD       ARG  55  22.657  10.148  -8.581
 1066    HE   ARG  55           HE       ARG  55  22.563   8.800  -5.986
 1067   1HH1  ARG  55          1HH1      ARG  55  21.776  11.602  -7.945
 1068   2HH1  ARG  55          2HH1      ARG  55  20.597  12.204  -6.821
 1069   1HH2  ARG  55          1HH2      ARG  55  20.966   9.580  -4.534
 1070   2HH2  ARG  55          2HH2      ARG  55  20.127  11.067  -4.902
 1071    H    LYS  56           H        LYS  56  20.831   5.071  -9.854
 1072    HA   LYS  56           HA       LYS  56  22.951   3.154  -9.687
 1073   1HB   LYS  56          1HB       LYS  56  19.948   2.805  -9.748
 1074   2HB   LYS  56          2HB       LYS  56  21.098   1.515  -9.421
 1075   1HG   LYS  56          1HG       LYS  56  21.482   3.844  -7.719
 1076   2HG   LYS  56          2HG       LYS  56  19.886   3.108  -7.546
 1077   1HD   LYS  56          1HD       LYS  56  20.721   1.344  -6.465
 1078   2HD   LYS  56          2HD       LYS  56  22.003   1.128  -7.660
 1079   1HE   LYS  56          1HE       LYS  56  22.766   3.409  -6.305
 1080   2HE   LYS  56          2HE       LYS  56  22.088   2.387  -5.036
 1081   1HZ   LYS  56          1HZ       LYS  56  23.553   0.586  -5.865
 1082   2HZ   LYS  56          2HZ       LYS  56  24.396   1.915  -5.234
 1083   3HZ   LYS  56          3HZ       LYS  56  24.279   1.703  -6.913
 1084    H    GLY  57           H        GLY  57  20.587   4.076 -12.122
 1085   1HA   GLY  57          1HA       GLY  57  20.601   3.625 -14.402
 1086   2HA   GLY  57          2HA       GLY  57  22.070   2.681 -14.180
 1087    H    THR  58           H        THR  58  18.776   2.471 -12.872
 1088    HA   THR  58           HA       THR  58  18.513  -0.217 -13.976
 1089    HB   THR  58           HB       THR  58  19.598  -0.297 -11.678
 1090    HG1  THR  58           HG1      THR  58  18.537  -2.121 -12.525
 1091   1HG2  THR  58          1HG2      THR  58  16.890   0.129 -10.513
 1092   2HG2  THR  58          2HG2      THR  58  17.897   1.538 -10.859
 1093   3HG2  THR  58          3HG2      THR  58  18.476   0.282  -9.762
 1094    H    SER  59           H        SER  59  16.285  -1.103 -13.521
 1095    HA   SER  59           HA       SER  59  14.328   0.740 -14.384
 1096   1HB   SER  59          1HB       SER  59  13.396  -1.769 -13.149
 1097   2HB   SER  59          2HB       SER  59  13.089  -1.120 -14.761
 1098    HG   SER  59           HG       SER  59  14.504  -3.108 -14.459
 1099    H    ILE  60           H        ILE  60  12.616   1.688 -13.328
 1100    HA   ILE  60           HA       ILE  60  13.076   2.696 -10.820
 1101    HB   ILE  60           HB       ILE  60  11.535   3.811 -12.259
 1102   1HG1  ILE  60          1HG1      ILE  60   9.459   3.158 -10.340
 1103   2HG1  ILE  60          2HG1      ILE  60  11.026   3.327  -9.558
 1104   1HG2  ILE  60          1HG2      ILE  60   9.812   2.894 -13.354
 1105   2HG2  ILE  60          2HG2      ILE  60   9.264   1.994 -11.939
 1106   3HG2  ILE  60          3HG2      ILE  60  10.578   1.361 -12.930
 1107   1HD1  ILE  60          1HD1      ILE  60   9.502   5.390  -9.816
 1108   2HD1  ILE  60          2HD1      ILE  60  10.080   5.399 -11.482
 1109   3HD1  ILE  60          3HD1      ILE  60  11.226   5.547 -10.150
 1110    H    THR  61           H        THR  61  11.106  -0.131 -11.652
 1111    HA   THR  61           HA       THR  61  10.104  -0.617  -9.088
 1112    HB   THR  61           HB       THR  61  10.569  -3.025 -10.666
 1113    HG1  THR  61           HG1      THR  61   9.286  -2.324 -12.430
 1114   1HG2  THR  61          1HG2      THR  61   8.854  -2.521  -8.808
 1115   2HG2  THR  61          2HG2      THR  61   8.310  -3.419 -10.224
 1116   3HG2  THR  61          3HG2      THR  61   7.943  -1.699 -10.076
 1117    H    ASP  62           H        ASP  62  13.175  -1.394 -10.535
 1118    HA   ASP  62           HA       ASP  62  13.920  -3.298  -8.506
 1119   1HB   ASP  62          1HB       ASP  62  14.856  -2.757 -11.038
 1120   2HB   ASP  62          2HB       ASP  62  16.114  -2.073 -10.010
 1121    H    VAL  63           H        VAL  63  14.001   0.122  -8.888
 1122    HA   VAL  63           HA       VAL  63  16.008   0.594  -6.871
 1123    HB   VAL  63           HB       VAL  63  13.934   2.649  -7.534
 1124   1HG1  VAL  63          1HG1      VAL  63  15.812   4.172  -7.242
 1125   2HG1  VAL  63          2HG1      VAL  63  16.905   2.803  -7.029
 1126   3HG1  VAL  63          3HG1      VAL  63  15.639   3.115  -5.840
 1127   1HG2  VAL  63          1HG2      VAL  63  14.726   1.558  -9.679
 1128   2HG2  VAL  63          2HG2      VAL  63  16.327   2.189  -9.291
 1129   3HG2  VAL  63          3HG2      VAL  63  14.979   3.299  -9.544
 1130    H    VAL  64           H        VAL  64  12.500   0.329  -7.040
 1131    HA   VAL  64           HA       VAL  64  11.973   1.081  -4.354
 1132    HB   VAL  64           HB       VAL  64  10.231  -1.006  -5.547
 1133   1HG1  VAL  64          1HG1      VAL  64   9.051   1.517  -4.715
 1134   2HG1  VAL  64          2HG1      VAL  64  10.076   0.803  -3.470
 1135   3HG1  VAL  64          3HG1      VAL  64   8.738  -0.123  -4.145
 1136   1HG2  VAL  64          1HG2      VAL  64  10.696   0.202  -7.555
 1137   2HG2  VAL  64          2HG2      VAL  64  10.504   1.750  -6.732
 1138   3HG2  VAL  64          3HG2      VAL  64   9.103   0.706  -6.981
 1139    H    ASN  65           H        ASN  65  12.662  -1.992  -5.930
 1140    HA   ASN  65           HA       ASN  65  12.457  -3.592  -3.601
 1141   1HB   ASN  65          1HB       ASN  65  12.657  -4.173  -6.214
 1142   2HB   ASN  65          2HB       ASN  65  14.341  -4.401  -5.748
 1143   1HD2  ASN  65          1HD2      ASN  65  12.317  -6.328  -6.617
 1144   2HD2  ASN  65          2HD2      ASN  65  12.206  -7.505  -5.345
 1145    H    GLN  66           H        GLN  66  14.946  -1.550  -4.897
 1146    HA   GLN  66           HA       GLN  66  17.119  -2.604  -3.389
 1147   1HB   GLN  66          1HB       GLN  66  16.964  -0.859  -5.430
 1148   2HB   GLN  66          2HB       GLN  66  17.122   0.273  -4.096
 1149   1HG   GLN  66          1HG       GLN  66  19.302  -0.040  -4.131
 1150   2HG   GLN  66          2HG       GLN  66  19.049  -1.722  -3.670
 1151   1HE2  GLN  66          1HE2      GLN  66  17.520  -1.805  -6.408
 1152   2HE2  GLN  66          2HE2      GLN  66  18.804  -2.109  -7.533
 1153    H    LEU  67           H        LEU  67  14.654  -0.166  -2.799
 1154    HA   LEU  67           HA       LEU  67  15.728   0.802  -0.345
 1155   1HB   LEU  67          1HB       LEU  67  12.790   0.688  -0.960
 1156   2HB   LEU  67          2HB       LEU  67  13.653   1.859   0.015
 1157    HG   LEU  67           HG       LEU  67  14.416   1.781  -2.837
 1158   1HD1  LEU  67          1HD1      LEU  67  12.184   3.437  -2.796
 1159   2HD1  LEU  67          2HD1      LEU  67  11.656   1.938  -2.038
 1160   3HD1  LEU  67          3HD1      LEU  67  12.359   1.909  -3.651
 1161   1HD2  LEU  67          1HD2      LEU  67  13.677   4.016  -0.957
 1162   2HD2  LEU  67          2HD2      LEU  67  14.420   4.183  -2.549
 1163   3HD2  LEU  67          3HD2      LEU  67  15.311   3.414  -1.239
 1164    H    VAL  68           H        VAL  68  13.381  -1.708  -1.191
 1165    HA   VAL  68           HA       VAL  68  12.829  -2.554   1.451
 1166    HB   VAL  68           HB       VAL  68  12.793  -4.501  -0.825
 1167   1HG1  VAL  68          1HG1      VAL  68  11.660  -5.688   0.661
 1168   2HG1  VAL  68          2HG1      VAL  68  10.411  -4.444   0.696
 1169   3HG1  VAL  68          3HG1      VAL  68  11.767  -4.364   1.824
 1170   1HG2  VAL  68          1HG2      VAL  68  11.875  -2.214  -1.544
 1171   2HG2  VAL  68          2HG2      VAL  68  10.549  -2.552  -0.429
 1172   3HG2  VAL  68          3HG2      VAL  68  10.856  -3.633  -1.790
 1173    H    ASP  69           H        ASP  69  15.284  -3.424  -0.901
 1174    HA   ASP  69           HA       ASP  69  16.389  -5.675   0.305
 1175   1HB   ASP  69          1HB       ASP  69  17.126  -3.795  -1.743
 1176   2HB   ASP  69          2HB       ASP  69  18.530  -4.130  -0.738
 1177    H    ASN  70           H        ASN  70  17.223  -2.270   0.719
 1178    HA   ASN  70           HA       ASN  70  19.229  -2.508   2.633
 1179   1HB   ASN  70          1HB       ASN  70  18.341  -0.420   1.351
 1180   2HB   ASN  70          2HB       ASN  70  17.217  -0.270   2.698
 1181   1HD2  ASN  70          1HD2      ASN  70  18.040   0.152   4.785
 1182   2HD2  ASN  70          2HD2      ASN  70  19.605   0.874   4.994
 1183    H    TRP  71           H        TRP  71  15.816  -1.707   3.197
 1184    HA   TRP  71           HA       TRP  71  15.775  -1.878   5.957
 1185   1HB   TRP  71          1HB       TRP  71  13.946  -1.010   4.508
 1186   2HB   TRP  71          2HB       TRP  71  13.548  -2.666   4.068
 1187    HD1  TRP  71           HD1      TRP  71  13.310  -0.191   6.945
 1188    HE1  TRP  71           HE1      TRP  71  11.622  -1.066   8.680
 1189    HE3  TRP  71           HE3      TRP  71  12.491  -4.848   4.981
 1190    HZ2  TRP  71           HZ2      TRP  71  10.128  -3.409   9.138
 1191    HZ3  TRP  71           HZ3      TRP  71  10.893  -6.331   6.120
 1192    HH2  TRP  71           HH2      TRP  71   9.742  -5.625   8.162
 1193    H    LEU  72           H        LEU  72  14.636  -4.370   3.721
 1194    HA   LEU  72           HA       LEU  72  13.865  -6.273   5.448
 1195   1HB   LEU  72          1HB       LEU  72  14.057  -6.148   2.793
 1196   2HB   LEU  72          2HB       LEU  72  15.377  -7.260   3.101
 1197    HG   LEU  72           HG       LEU  72  13.285  -8.272   4.613
 1198   1HD1  LEU  72          1HD1      LEU  72  11.322  -7.927   3.625
 1199   2HD1  LEU  72          2HD1      LEU  72  12.002  -8.127   2.012
 1200   3HD1  LEU  72          3HD1      LEU  72  12.097  -6.563   2.820
 1201   1HD2  LEU  72          1HD2      LEU  72  13.635 -10.154   3.364
 1202   2HD2  LEU  72          2HD2      LEU  72  15.096  -9.254   2.955
 1203   3HD2  LEU  72          3HD2      LEU  72  13.726  -9.262   1.846
 1204    H    LYS  73           H        LYS  73  17.166  -6.048   4.146
 1205    HA   LYS  73           HA       LYS  73  17.887  -8.287   5.834
 1206   1HB   LYS  73          1HB       LYS  73  19.438  -6.857   3.679
 1207   2HB   LYS  73          2HB       LYS  73  19.946  -8.337   4.490
 1208   1HG   LYS  73          1HG       LYS  73  18.640  -9.611   3.201
 1209   2HG   LYS  73          2HG       LYS  73  17.253  -8.537   3.421
 1210   1HD   LYS  73          1HD       LYS  73  17.577  -7.554   1.442
 1211   2HD   LYS  73          2HD       LYS  73  19.311  -7.383   1.716
 1212   1HE   LYS  73          1HE       LYS  73  19.564  -9.791   1.138
 1213   2HE   LYS  73          2HE       LYS  73  17.857  -9.814   0.698
 1214   1HZ   LYS  73          1HZ       LYS  73  19.141  -9.488  -1.263
 1215   2HZ   LYS  73          2HZ       LYS  73  20.006  -8.207  -0.566
 1216   3HZ   LYS  73          3HZ       LYS  73  18.357  -8.022  -0.918
 1217    H    GLU  74           H        GLU  74  18.139  -4.901   6.039
 1218    HA   GLU  74           HA       GLU  74  20.481  -5.057   7.789
 1219   1HB   GLU  74          1HB       GLU  74  19.429  -3.050   6.077
 1220   2HB   GLU  74          2HB       GLU  74  19.346  -2.428   7.720
 1221   1HG   GLU  74          1HG       GLU  74  21.449  -1.929   6.399
 1222   2HG   GLU  74          2HG       GLU  74  21.660  -2.587   8.021
 1223    H    ASN  75           H        ASN  75  17.022  -4.558   7.907
 1224    HA   ASN  75           HA       ASN  75  17.015  -3.629  10.620
 1225   1HB   ASN  75          1HB       ASN  75  14.834  -3.134  10.284
 1226   2HB   ASN  75          2HB       ASN  75  15.236  -3.399   8.590
 1227   1HD2  ASN  75          1HD2      ASN  75  14.740  -5.463   7.671
 1228   2HD2  ASN  75          2HD2      ASN  75  13.441  -6.408   8.314
 1229    H    GLU  76           H        GLU  76  17.330  -6.680   9.266
 1230    HA   GLU  76           HA       GLU  76  15.900  -8.224  11.187
 1231   1HB   GLU  76          1HB       GLU  76  17.785  -8.750   8.989
 1232   2HB   GLU  76          2HB       GLU  76  17.865  -9.903  10.314
 1233   1HG   GLU  76          1HG       GLU  76  15.254  -9.160   9.059
 1234   2HG   GLU  76          2HG       GLU  76  16.293 -10.397   8.356
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1 -49.414  62.462  46.028
    2   2H    MET   1          2H        MET   1 -49.778  61.410  44.748
    3   3H    MET   1          3H        MET   1 -50.521  61.200  46.256
    4    HA   MET   1           HA       MET   1 -51.315  63.653  45.808
    5   1HB   MET   1          1HB       MET   1 -50.530  62.452  43.186
    6   2HB   MET   1          2HB       MET   1 -51.993  63.425  43.236
    7   1HG   MET   1          1HG       MET   1 -50.762  65.333  43.999
    8   2HG   MET   1          2HG       MET   1 -49.292  64.372  44.167
    9   1HE   MET   1          1HE       MET   1 -49.891  67.037  42.883
   10   2HE   MET   1          2HE       MET   1 -50.905  66.920  41.445
   11   3HE   MET   1          3HE       MET   1 -49.158  67.096  41.279
   12    H    SER   2           H        SER   2 -53.641  63.759  45.239
   13    HA   SER   2           HA       SER   2 -55.026  61.420  46.107
   14   1HB   SER   2          1HB       SER   2 -56.586  63.488  44.691
   15   2HB   SER   2          2HB       SER   2 -56.826  62.789  46.291
   16    HG   SER   2           HG       SER   2 -54.875  64.091  46.872
   17    H    LEU   3           H        LEU   3 -54.598  63.040  43.006
   18    HA   LEU   3           HA       LEU   3 -55.688  60.668  41.653
   19   1HB   LEU   3          1HB       LEU   3 -54.919  62.900  39.935
   20   2HB   LEU   3          2HB       LEU   3 -56.416  61.987  39.987
   21    HG   LEU   3           HG       LEU   3 -55.988  63.939  42.177
   22   1HD1  LEU   3          1HD1      LEU   3 -57.101  65.588  40.389
   23   2HD1  LEU   3          2HD1      LEU   3 -56.047  64.667  39.314
   24   3HD1  LEU   3          3HD1      LEU   3 -55.365  65.527  40.694
   25   1HD2  LEU   3          1HD2      LEU   3 -58.107  62.439  41.040
   26   2HD2  LEU   3          2HD2      LEU   3 -58.473  64.150  40.814
   27   3HD2  LEU   3          3HD2      LEU   3 -58.153  63.523  42.432
   28    H    GLU   4           H        GLU   4 -53.767  59.506  42.237
   29    HA   GLU   4           HA       GLU   4 -51.171  60.368  41.528
   30   1HB   GLU   4          1HB       GLU   4 -52.417  57.895  42.553
   31   2HB   GLU   4          2HB       GLU   4 -50.915  57.666  41.666
   32   1HG   GLU   4          1HG       GLU   4 -51.303  59.460  44.050
   33   2HG   GLU   4          2HG       GLU   4 -50.522  57.879  44.058
   34    H    LYS   5           H        LYS   5 -50.115  60.296  39.656
   35    HA   LYS   5           HA       LYS   5 -51.099  58.534  37.519
   36   1HB   LYS   5          1HB       LYS   5 -51.771  61.131  37.493
   37   2HB   LYS   5          2HB       LYS   5 -50.187  61.253  36.741
   38   1HG   LYS   5          1HG       LYS   5 -51.609  61.032  34.933
   39   2HG   LYS   5          2HG       LYS   5 -51.029  59.384  35.178
   40   1HD   LYS   5          1HD       LYS   5 -53.093  58.643  35.564
   41   2HD   LYS   5          2HD       LYS   5 -53.378  59.896  36.775
   42   1HE   LYS   5          1HE       LYS   5 -54.023  61.468  35.064
   43   2HE   LYS   5          2HE       LYS   5 -53.602  60.318  33.796
   44   1HZ   LYS   5          1HZ       LYS   5 -55.869  60.227  35.692
   45   2HZ   LYS   5          2HZ       LYS   5 -55.343  58.828  34.884
   46   3HZ   LYS   5          3HZ       LYS   5 -55.903  60.157  33.997
   47    H    ALA   6           H        ALA   6 -48.985  57.863  39.024
   48    HA   ALA   6           HA       ALA   6 -46.548  58.764  37.683
   49   1HB   ALA   6          1HB       ALA   6 -46.387  56.642  39.724
   50   2HB   ALA   6          2HB       ALA   6 -46.981  58.207  40.282
   51   3HB   ALA   6          3HB       ALA   6 -45.400  58.088  39.508
   52    H    HIS   7           H        HIS   7 -45.370  57.524  36.314
   53    HA   HIS   7           HA       HIS   7 -46.211  54.748  35.925
   54   1HB   HIS   7          1HB       HIS   7 -45.941  54.998  33.457
   55   2HB   HIS   7          2HB       HIS   7 -47.290  55.914  34.112
   56    HD1  HIS   7           HD1      HIS   7 -44.222  56.252  32.127
   57    HD2  HIS   7           HD2      HIS   7 -46.812  58.772  34.193
   58    HE1  HIS   7           HE1      HIS   7 -43.722  58.573  31.298
   59    HE2  HIS   7           HE2      HIS   7 -45.231  60.094  32.621
   60    H    THR   8           H        THR   8 -44.583  53.441  36.180
   61    HA   THR   8           HA       THR   8 -41.854  54.414  35.628
   62    HB   THR   8           HB       THR   8 -42.315  52.324  37.704
   63    HG1  THR   8           HG1      THR   8 -42.729  55.117  38.189
   64   1HG2  THR   8          1HG2      THR   8 -40.441  54.684  37.486
   65   2HG2  THR   8          2HG2      THR   8 -40.048  53.000  37.139
   66   3HG2  THR   8          3HG2      THR   8 -40.436  53.493  38.786
   67    H    SER   9           H        SER   9 -41.894  53.437  33.546
   68    HA   SER   9           HA       SER   9 -41.749  50.494  33.630
   69   1HB   SER   9          1HB       SER   9 -42.415  51.273  30.996
   70   2HB   SER   9          2HB       SER   9 -43.424  50.397  32.145
   71    HG   SER   9           HG       SER   9 -44.366  52.269  32.782
   72    H    VAL  10           H        VAL  10 -39.756  49.822  33.208
   73    HA   VAL  10           HA       VAL  10 -37.932  51.593  31.756
   74    HB   VAL  10           HB       VAL  10 -37.121  48.964  32.963
   75   1HG1  VAL  10          1HG1      VAL  10 -35.731  51.580  32.432
   76   2HG1  VAL  10          2HG1      VAL  10 -35.434  50.024  31.656
   77   3HG1  VAL  10          3HG1      VAL  10 -35.011  50.259  33.352
   78   1HG2  VAL  10          1HG2      VAL  10 -36.495  50.756  34.913
   79   2HG2  VAL  10          2HG2      VAL  10 -37.889  49.675  34.946
   80   3HG2  VAL  10          3HG2      VAL  10 -38.075  51.339  34.389
   81    H    LYS  11           H        LYS  11 -37.705  51.331  29.640
   82    HA   LYS  11           HA       LYS  11 -38.346  48.731  28.444
   83   1HB   LYS  11          1HB       LYS  11 -38.424  51.547  27.507
   84   2HB   LYS  11          2HB       LYS  11 -38.011  50.328  26.309
   85   1HG   LYS  11          1HG       LYS  11 -40.286  49.482  27.846
   86   2HG   LYS  11          2HG       LYS  11 -40.559  51.086  27.161
   87   1HD   LYS  11          1HD       LYS  11 -39.542  48.757  25.544
   88   2HD   LYS  11          2HD       LYS  11 -41.257  49.139  25.712
   89   1HE   LYS  11          1HE       LYS  11 -41.128  50.909  24.328
   90   2HE   LYS  11          2HE       LYS  11 -39.557  51.408  24.950
   91   1HZ   LYS  11          1HZ       LYS  11 -40.181  49.486  22.811
   92   2HZ   LYS  11          2HZ       LYS  11 -38.725  49.342  23.669
   93   3HZ   LYS  11          3HZ       LYS  11 -39.066  50.765  22.814
   94    H    LYS  12           H        LYS  12 -36.705  47.420  28.070
   95    HA   LYS  12           HA       LYS  12 -34.112  48.604  27.298
   96   1HB   LYS  12          1HB       LYS  12 -34.166  45.956  28.657
   97   2HB   LYS  12          2HB       LYS  12 -32.936  47.211  28.695
   98   1HG   LYS  12          1HG       LYS  12 -33.678  47.865  30.670
   99   2HG   LYS  12          2HG       LYS  12 -35.242  48.255  29.953
  100   1HD   LYS  12          1HD       LYS  12 -35.741  46.731  31.673
  101   2HD   LYS  12          2HD       LYS  12 -35.778  45.767  30.196
  102   1HE   LYS  12          1HE       LYS  12 -33.192  45.485  30.855
  103   2HE   LYS  12          2HE       LYS  12 -33.886  45.695  32.462
  104   1HZ   LYS  12          1HZ       LYS  12 -35.184  43.806  30.639
  105   2HZ   LYS  12          2HZ       LYS  12 -35.033  43.753  32.327
  106   3HZ   LYS  12          3HZ       LYS  12 -33.711  43.345  31.342
  107    H    MET  13           H        MET  13 -32.915  47.507  25.733
  108    HA   MET  13           HA       MET  13 -34.467  45.511  24.224
  109   1HB   MET  13          1HB       MET  13 -33.466  47.890  23.316
  110   2HB   MET  13          2HB       MET  13 -32.183  46.775  22.867
  111   1HG   MET  13          1HG       MET  13 -33.494  46.721  20.999
  112   2HG   MET  13          2HG       MET  13 -34.140  45.352  21.903
  113   1HE   MET  13          1HE       MET  13 -36.319  45.622  20.159
  114   2HE   MET  13          2HE       MET  13 -37.681  46.093  21.174
  115   3HE   MET  13          3HE       MET  13 -36.490  44.942  21.777
  116    H    THR  14           H        THR  14 -32.574  45.172  26.525
  117    HA   THR  14           HA       THR  14 -30.281  43.807  25.455
  118    HB   THR  14           HB       THR  14 -30.569  43.005  28.080
  119    HG1  THR  14           HG1      THR  14 -30.979  45.688  28.432
  120   1HG2  THR  14          1HG2      THR  14 -28.486  43.743  27.191
  121   2HG2  THR  14          2HG2      THR  14 -28.883  44.821  28.528
  122   3HG2  THR  14          3HG2      THR  14 -29.127  45.353  26.865
  123    H    PHE  15           H        PHE  15 -31.129  42.177  24.122
  124    HA   PHE  15           HA       PHE  15 -32.869  40.208  25.426
  125   1HB   PHE  15          1HB       PHE  15 -32.397  40.967  22.557
  126   2HB   PHE  15          2HB       PHE  15 -33.125  39.416  22.966
  127    HD1  PHE  15           HD1      PHE  15 -33.666  42.936  22.563
  128    HD2  PHE  15           HD2      PHE  15 -35.250  39.395  24.312
  129    HE1  PHE  15           HE1      PHE  15 -35.866  44.016  22.752
  130    HE2  PHE  15           HE2      PHE  15 -37.452  40.472  24.505
  131    HZ   PHE  15           HZ       PHE  15 -37.752  42.801  23.770
  132    H    GLY  16           H        GLY  16 -29.717  40.599  25.160
  133   1HA   GLY  16          1HA       GLY  16 -28.064  39.023  25.616
  134   2HA   GLY  16          2HA       GLY  16 -29.229  37.745  25.296
  135    H    GLU  17           H        GLU  17 -28.808  40.311  23.004
  136    HA   GLU  17           HA       GLU  17 -27.491  38.393  21.200
  137   1HB   GLU  17          1HB       GLU  17 -28.986  40.876  20.366
  138   2HB   GLU  17          2HB       GLU  17 -28.508  39.514  19.362
  139   1HG   GLU  17          1HG       GLU  17 -30.248  38.821  21.614
  140   2HG   GLU  17          2HG       GLU  17 -30.979  39.882  20.414
  141    H    ASN  18           H        ASN  18 -26.068  39.889  23.143
  142    HA   ASN  18           HA       ASN  18 -24.728  42.059  21.740
  143   1HB   ASN  18          1HB       ASN  18 -25.214  41.862  24.311
  144   2HB   ASN  18          2HB       ASN  18 -23.763  40.865  24.322
  145   1HD2  ASN  18          1HD2      ASN  18 -24.840  43.950  22.920
  146   2HD2  ASN  18          2HD2      ASN  18 -23.399  44.824  23.330
  147    H    ARG  19           H        ARG  19 -24.479  38.698  22.195
  148    HA   ARG  19           HA       ARG  19 -21.672  38.501  21.492
  149   1HB   ARG  19          1HB       ARG  19 -22.821  36.890  23.036
  150   2HB   ARG  19          2HB       ARG  19 -23.762  36.318  21.667
  151   1HG   ARG  19          1HG       ARG  19 -21.303  36.008  20.663
  152   2HG   ARG  19          2HG       ARG  19 -20.944  35.813  22.382
  153   1HD   ARG  19          1HD       ARG  19 -23.022  34.279  20.819
  154   2HD   ARG  19          2HD       ARG  19 -21.447  33.665  21.320
  155    HE   ARG  19           HE       ARG  19 -22.227  33.902  23.643
  156   1HH1  ARG  19          1HH1      ARG  19 -24.658  33.863  21.097
  157   2HH1  ARG  19          2HH1      ARG  19 -25.909  33.251  22.145
  158   1HH2  ARG  19          1HH2      ARG  19 -23.878  33.148  25.004
  159   2HH2  ARG  19          2HH2      ARG  19 -25.470  32.862  24.368
  160    H    ASP  20           H        ASP  20 -22.307  39.900  19.537
  161    HA   ASP  20           HA       ASP  20 -23.170  38.160  17.316
  162   1HB   ASP  20          1HB       ASP  20 -24.761  39.976  17.776
  163   2HB   ASP  20          2HB       ASP  20 -23.475  41.163  17.572
  164    H    LEU  21           H        LEU  21 -21.026  37.460  16.962
  165    HA   LEU  21           HA       LEU  21 -19.605  39.029  15.070
  166   1HB   LEU  21          1HB       LEU  21 -18.935  39.746  17.598
  167   2HB   LEU  21          2HB       LEU  21 -17.792  38.445  17.329
  168    HG   LEU  21           HG       LEU  21 -17.962  40.424  15.151
  169   1HD1  LEU  21          1HD1      LEU  21 -18.057  42.119  16.687
  170   2HD1  LEU  21          2HD1      LEU  21 -16.314  41.862  16.589
  171   3HD1  LEU  21          3HD1      LEU  21 -17.232  41.183  17.936
  172   1HD2  LEU  21          1HD2      LEU  21 -15.369  40.212  15.762
  173   2HD2  LEU  21          2HD2      LEU  21 -16.217  39.026  14.772
  174   3HD2  LEU  21          3HD2      LEU  21 -15.947  38.711  16.485
  175    H    GLU  22           H        GLU  22 -19.282  37.449  13.671
  176    HA   GLU  22           HA       GLU  22 -18.422  34.826  14.676
  177   1HB   GLU  22          1HB       GLU  22 -19.869  35.681  12.178
  178   2HB   GLU  22          2HB       GLU  22 -19.119  34.096  12.317
  179   1HG   GLU  22          1HG       GLU  22 -20.895  34.865  14.533
  180   2HG   GLU  22          2HG       GLU  22 -21.674  34.617  12.970
  181    H    ARG  23           H        ARG  23 -16.667  33.776  13.772
  182    HA   ARG  23           HA       ARG  23 -15.047  35.227  11.813
  183   1HB   ARG  23          1HB       ARG  23 -14.277  34.622  14.627
  184   2HB   ARG  23          2HB       ARG  23 -13.050  34.406  13.387
  185   1HG   ARG  23          1HG       ARG  23 -13.012  36.659  12.847
  186   2HG   ARG  23          2HG       ARG  23 -14.598  36.957  13.560
  187   1HD   ARG  23          1HD       ARG  23 -11.932  36.801  14.840
  188   2HD   ARG  23          2HD       ARG  23 -13.305  37.844  15.208
  189    HE   ARG  23           HE       ARG  23 -13.338  34.988  15.922
  190   1HH1  ARG  23          1HH1      ARG  23 -13.475  38.357  16.860
  191   2HH1  ARG  23          2HH1      ARG  23 -14.002  38.014  18.483
  192   1HH2  ARG  23          1HH2      ARG  23 -14.040  34.532  18.032
  193   2HH2  ARG  23          2HH2      ARG  23 -14.340  35.836  19.149
  194    H    VAL  24           H        VAL  24 -15.598  33.616  10.349
  195    HA   VAL  24           HA       VAL  24 -14.480  30.951  10.939
  196    HB   VAL  24           HB       VAL  24 -16.751  31.303   9.011
  197   1HG1  VAL  24          1HG1      VAL  24 -15.387  29.187   9.237
  198   2HG1  VAL  24          2HG1      VAL  24 -17.133  29.005   9.403
  199   3HG1  VAL  24          3HG1      VAL  24 -16.106  29.003  10.836
  200   1HG2  VAL  24          1HG2      VAL  24 -18.068  30.457  11.198
  201   2HG2  VAL  24          2HG2      VAL  24 -17.979  32.148  10.707
  202   3HG2  VAL  24          3HG2      VAL  24 -16.887  31.532  11.948
  203    H    VAL  25           H        VAL  25 -12.505  31.667   9.959
  204    HA   VAL  25           HA       VAL  25 -12.666  32.041   7.045
  205    HB   VAL  25           HB       VAL  25 -11.405  33.814   7.964
  206   1HG1  VAL  25          1HG1      VAL  25  -9.782  31.793   9.502
  207   2HG1  VAL  25          2HG1      VAL  25 -10.992  32.884  10.177
  208   3HG1  VAL  25          3HG1      VAL  25  -9.511  33.536   9.476
  209   1HG2  VAL  25          1HG2      VAL  25 -10.304  33.200   6.024
  210   2HG2  VAL  25          2HG2      VAL  25  -9.714  31.688   6.715
  211   3HG2  VAL  25          3HG2      VAL  25  -9.000  33.222   7.212
  212    H    THR  26           H        THR  26 -12.589  30.173   6.007
  213    HA   THR  26           HA       THR  26 -10.893  28.028   7.077
  214    HB   THR  26           HB       THR  26 -12.889  27.549   4.910
  215    HG1  THR  26           HG1      THR  26 -13.563  27.827   7.678
  216   1HG2  THR  26          1HG2      THR  26 -12.133  25.936   7.349
  217   2HG2  THR  26          2HG2      THR  26 -11.403  25.751   5.753
  218   3HG2  THR  26          3HG2      THR  26 -13.115  25.400   5.986
  219    H    ALA  27           H        ALA  27  -9.106  27.479   6.047
  220    HA   ALA  27           HA       ALA  27  -8.922  27.816   3.151
  221   1HB   ALA  27          1HB       ALA  27  -6.743  28.919   3.290
  222   2HB   ALA  27          2HB       ALA  27  -6.874  28.964   5.048
  223   3HB   ALA  27          3HB       ALA  27  -7.998  29.893   4.058
  224    HA   PRO  28           HA       PRO  28  -7.243  23.821   4.635
  225   1HB   PRO  28          1HB       PRO  28  -8.436  22.699   2.229
  226   2HB   PRO  28          2HB       PRO  28  -8.810  22.351   3.917
  227   1HG   PRO  28          1HG       PRO  28 -10.523  23.662   2.269
  228   2HG   PRO  28          2HG       PRO  28 -10.461  23.943   4.020
  229   1HD   PRO  28          1HD       PRO  28  -9.272  25.559   1.791
  230   2HD   PRO  28          2HD       PRO  28 -10.107  26.108   3.261
  231    H    VAL  29           H        VAL  29  -5.384  25.398   3.649
  232    HA   VAL  29           HA       VAL  29  -4.408  24.400   1.095
  233    HB   VAL  29           HB       VAL  29  -2.628  26.126   2.703
  234   1HG1  VAL  29          1HG1      VAL  29  -2.181  25.455   0.370
  235   2HG1  VAL  29          2HG1      VAL  29  -2.271  27.205   0.570
  236   3HG1  VAL  29          3HG1      VAL  29  -3.630  26.325  -0.134
  237   1HG2  VAL  29          1HG2      VAL  29  -4.844  27.046   3.281
  238   2HG2  VAL  29          2HG2      VAL  29  -5.186  27.250   1.563
  239   3HG2  VAL  29          3HG2      VAL  29  -3.876  28.160   2.316
  240    H    SER  30           H        SER  30  -4.565  22.318   2.712
  241    HA   SER  30           HA       SER  30  -2.047  21.889   4.087
  242   1HB   SER  30          1HB       SER  30  -4.029  19.691   3.794
  243   2HB   SER  30          2HB       SER  30  -3.141  20.228   5.222
  244    HG   SER  30           HG       SER  30  -4.542  22.063   5.285
  245    H    SER  31           H        SER  31  -0.387  20.741   3.297
  246    HA   SER  31           HA       SER  31  -0.348  20.043   0.543
  247   1HB   SER  31          1HB       SER  31   1.847  18.883   2.007
  248   2HB   SER  31          2HB       SER  31   1.866  20.229   0.866
  249    HG   SER  31           HG       SER  31   1.613  21.654   2.493
  250    H    GLY  32           H        GLY  32   0.223  17.928  -0.321
  251   1HA   GLY  32          1HA       GLY  32   0.174  15.516   1.048
  252   2HA   GLY  32          2HA       GLY  32  -1.504  15.898   0.677
  253    H    LYS  33           H        LYS  33   1.584  16.206  -1.059
  254    HA   LYS  33           HA       LYS  33   0.287  15.189  -3.468
  255   1HB   LYS  33          1HB       LYS  33   2.802  16.676  -2.877
  256   2HB   LYS  33          2HB       LYS  33   2.751  15.680  -4.326
  257   1HG   LYS  33          1HG       LYS  33   0.417  17.028  -4.554
  258   2HG   LYS  33          2HG       LYS  33   1.418  18.225  -3.733
  259   1HD   LYS  33          1HD       LYS  33   2.915  16.965  -5.831
  260   2HD   LYS  33          2HD       LYS  33   1.390  17.586  -6.468
  261   1HE   LYS  33          1HE       LYS  33   2.264  19.626  -6.489
  262   2HE   LYS  33          2HE       LYS  33   2.413  19.557  -4.733
  263   1HZ   LYS  33          1HZ       LYS  33   4.473  18.275  -6.392
  264   2HZ   LYS  33          2HZ       LYS  33   4.604  18.963  -4.847
  265   3HZ   LYS  33          3HZ       LYS  33   4.494  19.962  -6.211
  266    H    ILE  34           H        ILE  34   0.198  13.076  -3.669
  267    HA   ILE  34           HA       ILE  34   2.478  11.447  -2.735
  268    HB   ILE  34           HB       ILE  34  -0.281  10.328  -2.993
  269   1HG1  ILE  34          1HG1      ILE  34   0.236  11.240  -0.292
  270   2HG1  ILE  34          2HG1      ILE  34   0.199  12.594  -1.421
  271   1HG2  ILE  34          1HG2      ILE  34   1.435   9.706  -0.688
  272   2HG2  ILE  34          2HG2      ILE  34   2.082   9.243  -2.263
  273   3HG2  ILE  34          3HG2      ILE  34   0.511   8.636  -1.740
  274   1HD1  ILE  34          1HD1      ILE  34  -2.007  12.394  -1.784
  275   2HD1  ILE  34          2HD1      ILE  34  -1.973  11.578  -0.221
  276   3HD1  ILE  34          3HD1      ILE  34  -1.972  10.633  -1.712
  277    H    LYS  35           H        LYS  35   2.878   9.496  -3.884
  278    HA   LYS  35           HA       LYS  35   1.876   9.407  -6.655
  279   1HB   LYS  35          1HB       LYS  35   4.716   8.856  -5.749
  280   2HB   LYS  35          2HB       LYS  35   4.119   8.774  -7.405
  281   1HG   LYS  35          1HG       LYS  35   3.621  11.358  -6.191
  282   2HG   LYS  35          2HG       LYS  35   5.333  10.929  -6.182
  283   1HD   LYS  35          1HD       LYS  35   5.083  12.002  -8.228
  284   2HD   LYS  35          2HD       LYS  35   4.940  10.296  -8.661
  285   1HE   LYS  35          1HE       LYS  35   2.638  10.438  -8.954
  286   2HE   LYS  35          2HE       LYS  35   2.510  11.917  -8.001
  287   1HZ   LYS  35          1HZ       LYS  35   4.073  11.988 -10.487
  288   2HZ   LYS  35          2HZ       LYS  35   3.155  13.209  -9.750
  289   3HZ   LYS  35          3HZ       LYS  35   2.381  11.967 -10.601
  290    H    ARG  36           H        ARG  36   1.768   7.252  -7.550
  291    HA   ARG  36           HA       ARG  36   1.738   5.182  -5.447
  292   1HB   ARG  36          1HB       ARG  36   0.303   4.297  -7.740
  293   2HB   ARG  36          2HB       ARG  36  -0.307   4.614  -6.122
  294   1HG   ARG  36          1HG       ARG  36   0.093   6.998  -7.789
  295   2HG   ARG  36          2HG       ARG  36  -1.147   5.876  -8.352
  296   1HD   ARG  36          1HD       ARG  36  -2.392   6.083  -6.385
  297   2HD   ARG  36          2HD       ARG  36  -1.039   6.775  -5.492
  298    HE   ARG  36           HE       ARG  36  -2.160   8.290  -7.735
  299   1HH1  ARG  36          1HH1      ARG  36  -1.721   7.905  -4.269
  300   2HH1  ARG  36          2HH1      ARG  36  -2.252   9.520  -3.902
  301   1HH2  ARG  36          1HH2      ARG  36  -2.803  10.431  -7.248
  302   2HH2  ARG  36          2HH2      ARG  36  -2.865  10.958  -5.589
  303    H    VAL  37           H        VAL  37   2.446   3.091  -5.935
  304    HA   VAL  37           HA       VAL  37   4.001   2.721  -8.400
  305    HB   VAL  37           HB       VAL  37   5.660   1.523  -6.618
  306   1HG1  VAL  37          1HG1      VAL  37   5.701   4.244  -7.860
  307   2HG1  VAL  37          2HG1      VAL  37   6.618   2.801  -8.295
  308   3HG1  VAL  37          3HG1      VAL  37   7.034   3.703  -6.838
  309   1HG2  VAL  37          1HG2      VAL  37   5.836   3.840  -5.084
  310   2HG2  VAL  37          2HG2      VAL  37   5.302   2.247  -4.548
  311   3HG2  VAL  37          3HG2      VAL  37   4.121   3.432  -5.102
  312    H    ASN  38           H        ASN  38   4.173   0.614  -9.062
  313    HA   ASN  38           HA       ASN  38   2.707  -1.396  -7.478
  314   1HB   ASN  38          1HB       ASN  38   1.621  -1.344  -9.563
  315   2HB   ASN  38          2HB       ASN  38   3.121  -1.076 -10.445
  316   1HD2  ASN  38          1HD2      ASN  38   1.390  -3.490  -8.505
  317   2HD2  ASN  38          2HD2      ASN  38   2.037  -4.859  -9.344
  318    H    VAL  39           H        VAL  39   4.079  -2.549  -6.315
  319    HA   VAL  39           HA       VAL  39   6.797  -2.959  -7.360
  320    HB   VAL  39           HB       VAL  39   5.874  -2.982  -4.480
  321   1HG1  VAL  39          1HG1      VAL  39   8.003  -4.259  -5.214
  322   2HG1  VAL  39          2HG1      VAL  39   8.098  -3.160  -3.837
  323   3HG1  VAL  39          3HG1      VAL  39   8.701  -2.650  -5.415
  324   1HG2  VAL  39          1HG2      VAL  39   6.694  -0.809  -6.291
  325   2HG2  VAL  39          2HG2      VAL  39   7.441  -0.801  -4.695
  326   3HG2  VAL  39          3HG2      VAL  39   5.686  -0.763  -4.845
  327    H    ASN  40           H        ASN  40   7.833  -4.940  -7.092
  328    HA   ASN  40           HA       ASN  40   6.025  -7.237  -6.765
  329   1HB   ASN  40          1HB       ASN  40   7.280  -6.848  -8.965
  330   2HB   ASN  40          2HB       ASN  40   8.744  -7.261  -8.081
  331   1HD2  ASN  40          1HD2      ASN  40   8.924  -8.958  -9.649
  332   2HD2  ASN  40          2HD2      ASN  40   8.053 -10.436  -9.408
  333    H    PHE  41           H        PHE  41   6.353  -8.589  -5.106
  334    HA   PHE  41           HA       PHE  41   8.814  -8.238  -3.521
  335   1HB   PHE  41          1HB       PHE  41   5.949  -8.358  -2.748
  336   2HB   PHE  41          2HB       PHE  41   7.103  -9.132  -1.667
  337    HD1  PHE  41           HD1      PHE  41   9.406  -7.202  -2.216
  338    HD2  PHE  41           HD2      PHE  41   5.290  -6.599  -1.323
  339    HE1  PHE  41           HE1      PHE  41   9.948  -5.022  -1.209
  340    HE2  PHE  41           HE2      PHE  41   5.823  -4.425  -0.316
  341    HZ   PHE  41           HZ       PHE  41   8.185  -3.598  -0.348
  342    H    ASP  42           H        ASP  42  10.053  -9.940  -3.387
  343    HA   ASP  42           HA       ASP  42   9.291 -12.521  -4.314
  344   1HB   ASP  42          1HB       ASP  42  11.517 -12.644  -4.498
  345   2HB   ASP  42          2HB       ASP  42  11.697 -11.162  -3.571
  346    H    GLU  43           H        GLU  43   9.267 -14.471  -3.079
  347    HA   GLU  43           HA       GLU  43   7.444 -14.553  -1.070
  348   1HB   GLU  43          1HB       GLU  43   8.195 -16.503  -2.377
  349   2HB   GLU  43          2HB       GLU  43   9.698 -16.526  -1.465
  350   1HG   GLU  43          1HG       GLU  43   8.467 -18.150  -0.406
  351   2HG   GLU  43          2HG       GLU  43   8.150 -16.738   0.597
  352    H    GLU  44           H        GLU  44  10.977 -14.607  -0.599
  353    HA   GLU  44           HA       GLU  44  10.953 -14.797   2.210
  354   1HB   GLU  44          1HB       GLU  44  12.910 -14.842   0.371
  355   2HB   GLU  44          2HB       GLU  44  13.084 -13.183   0.936
  356   1HG   GLU  44          1HG       GLU  44  12.832 -15.073   3.124
  357   2HG   GLU  44          2HG       GLU  44  14.196 -15.439   2.073
  358    H    LYS  45           H        LYS  45  11.416 -11.961   0.132
  359    HA   LYS  45           HA       LYS  45  11.527 -10.028   2.100
  360   1HB   LYS  45          1HB       LYS  45  10.944 -10.077  -0.790
  361   2HB   LYS  45          2HB       LYS  45  10.323  -8.671   0.070
  362   1HG   LYS  45          1HG       LYS  45  12.519  -8.105   0.856
  363   2HG   LYS  45          2HG       LYS  45  13.185  -9.596   0.193
  364   1HD   LYS  45          1HD       LYS  45  11.766  -7.906  -1.748
  365   2HD   LYS  45          2HD       LYS  45  13.229  -7.192  -1.065
  366   1HE   LYS  45          1HE       LYS  45  14.040  -9.743  -1.604
  367   2HE   LYS  45          2HE       LYS  45  12.915  -9.431  -2.927
  368   1HZ   LYS  45          1HZ       LYS  45  14.169  -7.341  -3.346
  369   2HZ   LYS  45          2HZ       LYS  45  15.072  -8.750  -3.615
  370   3HZ   LYS  45          3HZ       LYS  45  15.323  -7.841  -2.203
  371    H    HIS  46           H        HIS  46   8.701 -11.481   0.590
  372    HA   HIS  46           HA       HIS  46   6.870  -9.635   1.815
  373   1HB   HIS  46          1HB       HIS  46   6.451 -10.919  -0.333
  374   2HB   HIS  46          2HB       HIS  46   6.156 -12.333   0.675
  375    HD1  HIS  46           HD1      HIS  46   3.728 -12.697   0.901
  376    HD2  HIS  46           HD2      HIS  46   4.688  -8.649   0.885
  377    HE1  HIS  46           HE1      HIS  46   1.553 -11.483   1.266
  378    HE2  HIS  46           HE2      HIS  46   2.128  -9.037   1.029
  379    H    THR  47           H        THR  47   7.942 -12.930   2.534
  380    HA   THR  47           HA       THR  47   6.134 -13.403   4.643
  381    HB   THR  47           HB       THR  47   8.894 -14.600   4.331
  382    HG1  THR  47           HG1      THR  47   7.645 -14.909   2.431
  383   1HG2  THR  47          1HG2      THR  47   6.418 -15.713   5.658
  384   2HG2  THR  47          2HG2      THR  47   7.773 -14.980   6.515
  385   3HG2  THR  47          3HG2      THR  47   8.012 -16.465   5.595
  386    H    ARG  48           H        ARG  48   9.500 -12.222   4.648
  387    HA   ARG  48           HA       ARG  48   9.560 -11.846   7.473
  388   1HB   ARG  48          1HB       ARG  48  11.600 -12.092   6.023
  389   2HB   ARG  48          2HB       ARG  48  11.309 -10.456   5.443
  390   1HG   ARG  48          1HG       ARG  48  11.382  -9.724   7.855
  391   2HG   ARG  48          2HG       ARG  48  11.987 -11.333   8.234
  392   1HD   ARG  48          1HD       ARG  48  13.255  -9.245   6.480
  393   2HD   ARG  48          2HD       ARG  48  13.851  -9.865   8.016
  394    HE   ARG  48           HE       ARG  48  13.605 -11.714   5.749
  395   1HH1  ARG  48          1HH1      ARG  48  15.622  -9.910   7.971
  396   2HH1  ARG  48          2HH1      ARG  48  17.084 -10.733   7.525
  397   1HH2  ARG  48          1HH2      ARG  48  15.519 -12.766   5.118
  398   2HH2  ARG  48          2HH2      ARG  48  17.026 -12.358   5.897
  399    H    PHE  49           H        PHE  49   8.492  -9.914   4.770
  400    HA   PHE  49           HA       PHE  49   8.475  -7.388   5.976
  401   1HB   PHE  49          1HB       PHE  49   7.677  -8.385   3.543
  402   2HB   PHE  49          2HB       PHE  49   6.145  -7.927   4.282
  403    HD1  PHE  49           HD1      PHE  49   9.496  -6.359   4.574
  404    HD2  PHE  49           HD2      PHE  49   5.490  -5.992   3.199
  405    HE1  PHE  49           HE1      PHE  49   9.922  -4.018   3.964
  406    HE2  PHE  49           HE2      PHE  49   5.910  -3.650   2.580
  407    HZ   PHE  49           HZ       PHE  49   8.103  -2.643   3.017
  408    H    LYS  50           H        LYS  50   6.012  -9.926   5.936
  409    HA   LYS  50           HA       LYS  50   4.100  -8.567   7.496
  410   1HB   LYS  50          1HB       LYS  50   4.621 -11.483   6.966
  411   2HB   LYS  50          2HB       LYS  50   3.298 -10.951   7.996
  412   1HG   LYS  50          1HG       LYS  50   2.106 -10.076   6.244
  413   2HG   LYS  50          2HG       LYS  50   3.548  -9.788   5.267
  414   1HD   LYS  50          1HD       LYS  50   2.856 -11.615   4.141
  415   2HD   LYS  50          2HD       LYS  50   3.604 -12.490   5.482
  416   1HE   LYS  50          1HE       LYS  50   0.981 -11.739   6.266
  417   2HE   LYS  50          2HE       LYS  50   0.884 -12.474   4.667
  418   1HZ   LYS  50          1HZ       LYS  50   2.149 -13.685   7.071
  419   2HZ   LYS  50          2HZ       LYS  50   2.100 -14.390   5.527
  420   3HZ   LYS  50          3HZ       LYS  50   0.662 -14.136   6.386
  421    H    ALA  51           H        ALA  51   6.647 -10.878   8.367
  422    HA   ALA  51           HA       ALA  51   6.148 -10.947  11.135
  423   1HB   ALA  51          1HB       ALA  51   7.628 -12.485   9.763
  424   2HB   ALA  51          2HB       ALA  51   8.228 -12.016  11.354
  425   3HB   ALA  51          3HB       ALA  51   8.875 -11.243   9.904
  426    H    ALA  52           H        ALA  52   8.462  -8.971   9.281
  427    HA   ALA  52           HA       ALA  52   9.480  -7.507  11.436
  428   1HB   ALA  52          1HB       ALA  52  10.659  -6.359   9.887
  429   2HB   ALA  52          2HB       ALA  52   9.271  -6.151   8.820
  430   3HB   ALA  52          3HB       ALA  52  10.131  -7.693   8.859
  431    H    CYS  53           H        CYS  53   6.650  -6.916   9.382
  432    HA   CYS  53           HA       CYS  53   6.118  -4.297  10.241
  433   1HB   CYS  53          1HB       CYS  53   4.217  -4.432   8.990
  434   2HB   CYS  53          2HB       CYS  53   5.030  -5.853   8.355
  435    HG   CYS  53           HG       CYS  53   3.583  -7.685   9.834
  436    H    ALA  54           H        ALA  54   5.207  -7.417  11.596
  437    HA   ALA  54           HA       ALA  54   3.576  -6.323  13.688
  438   1HB   ALA  54          1HB       ALA  54   4.770  -8.913  14.266
  439   2HB   ALA  54          2HB       ALA  54   4.003  -8.850  12.679
  440   3HB   ALA  54          3HB       ALA  54   3.073  -8.454  14.124
  441    H    ARG  55           H        ARG  55   6.948  -7.205  13.311
  442    HA   ARG  55           HA       ARG  55   7.726  -6.964  16.024
  443   1HB   ARG  55          1HB       ARG  55   8.968  -7.498  13.504
  444   2HB   ARG  55          2HB       ARG  55   9.897  -6.253  14.328
  445   1HG   ARG  55          1HG       ARG  55   9.780  -7.842  16.359
  446   2HG   ARG  55          2HG       ARG  55   9.342  -9.069  15.168
  447   1HD   ARG  55          1HD       ARG  55  11.514  -9.343  14.772
  448   2HD   ARG  55          2HD       ARG  55  11.526  -7.729  14.062
  449    HE   ARG  55           HE       ARG  55  12.279  -6.856  16.157
  450   1HH1  ARG  55          1HH1      ARG  55  12.365 -10.350  15.854
  451   2HH1  ARG  55          2HH1      ARG  55  13.398 -10.566  17.238
  452   1HH2  ARG  55          1HH2      ARG  55  13.647  -7.136  17.957
  453   2HH2  ARG  55          2HH2      ARG  55  14.136  -8.737  18.429
  454    H    LYS  56           H        LYS  56   7.472  -4.669  13.374
  455    HA   LYS  56           HA       LYS  56   8.673  -2.537  14.925
  456   1HB   LYS  56          1HB       LYS  56   7.431  -2.620  12.173
  457   2HB   LYS  56          2HB       LYS  56   8.085  -1.155  12.892
  458   1HG   LYS  56          1HG       LYS  56   9.623  -3.675  12.294
  459   2HG   LYS  56          2HG       LYS  56   9.679  -2.173  11.369
  460   1HD   LYS  56          1HD       LYS  56  10.462  -1.032  13.465
  461   2HD   LYS  56          2HD       LYS  56  10.611  -2.630  14.196
  462   1HE   LYS  56          1HE       LYS  56  12.479  -3.122  13.048
  463   2HE   LYS  56          2HE       LYS  56  11.896  -2.348  11.575
  464   1HZ   LYS  56          1HZ       LYS  56  12.326  -0.183  12.898
  465   2HZ   LYS  56          2HZ       LYS  56  13.631  -0.998  12.189
  466   3HZ   LYS  56          3HZ       LYS  56  13.335  -1.158  13.850
  467    H    GLY  57           H        GLY  57   5.524  -3.758  14.253
  468   1HA   GLY  57          1HA       GLY  57   3.505  -3.193  15.218
  469   2HA   GLY  57          2HA       GLY  57   4.333  -1.932  16.121
  470    H    THR  58           H        THR  58   4.030  -2.479  12.627
  471    HA   THR  58           HA       THR  58   2.386  -0.088  12.386
  472    HB   THR  58           HB       THR  58   4.887   0.524  12.254
  473    HG1  THR  58           HG1      THR  58   4.374   1.902  10.323
  474   1HG2  THR  58          1HG2      THR  58   4.866  -0.114   9.387
  475   2HG2  THR  58          2HG2      THR  58   5.046  -1.507  10.454
  476   3HG2  THR  58          3HG2      THR  58   6.186  -0.168  10.552
  477    H    SER  59           H        SER  59   1.616   0.187  10.089
  478    HA   SER  59           HA       SER  59   0.534  -2.245   9.148
  479   1HB   SER  59          1HB       SER  59   0.206  -0.446   7.081
  480   2HB   SER  59          2HB       SER  59  -0.889  -0.633   8.452
  481    HG   SER  59           HG       SER  59   0.527   1.504   7.791
  482    H    ILE  60           H        ILE  60   0.940  -3.392   7.223
  483    HA   ILE  60           HA       ILE  60   3.633  -3.762   6.574
  484    HB   ILE  60           HB       ILE  60   1.759  -5.406   6.200
  485   1HG1  ILE  60          1HG1      ILE  60   3.587  -4.943   3.836
  486   2HG1  ILE  60          2HG1      ILE  60   4.079  -5.694   5.353
  487   1HG2  ILE  60          1HG2      ILE  60   0.886  -3.385   4.379
  488   2HG2  ILE  60          2HG2      ILE  60   0.073  -4.873   4.871
  489   3HG2  ILE  60          3HG2      ILE  60   1.182  -4.886   3.499
  490   1HD1  ILE  60          1HD1      ILE  60   3.225  -7.669   4.776
  491   2HD1  ILE  60          2HD1      ILE  60   3.191  -7.018   3.138
  492   3HD1  ILE  60          3HD1      ILE  60   1.743  -6.952   4.145
  493    H    THR  61           H        THR  61   1.232  -1.647   5.186
  494    HA   THR  61           HA       THR  61   2.663  -0.931   2.847
  495    HB   THR  61           HB       THR  61   0.925   1.156   3.797
  496    HG1  THR  61           HG1      THR  61  -0.984  -0.180   3.955
  497   1HG2  THR  61          1HG2      THR  61   0.284  -0.867   1.673
  498   2HG2  THR  61          2HG2      THR  61   1.509   0.375   1.418
  499   3HG2  THR  61          3HG2      THR  61  -0.161   0.839   1.744
  500    H    ASP  62           H        ASP  62   2.621   0.199   6.155
  501    HA   ASP  62           HA       ASP  62   4.035   2.636   5.666
  502   1HB   ASP  62          1HB       ASP  62   2.533   1.981   7.696
  503   2HB   ASP  62          2HB       ASP  62   4.012   1.261   8.328
  504    H    VAL  63           H        VAL  63   4.910  -0.669   6.449
  505    HA   VAL  63           HA       VAL  63   7.615  -0.238   7.114
  506    HB   VAL  63           HB       VAL  63   6.790  -2.644   5.520
  507   1HG1  VAL  63          1HG1      VAL  63   9.084  -1.870   6.941
  508   2HG1  VAL  63          2HG1      VAL  63   8.749  -3.432   6.197
  509   3HG1  VAL  63          3HG1      VAL  63   8.326  -3.150   7.883
  510   1HG2  VAL  63          1HG2      VAL  63   5.011  -2.221   7.190
  511   2HG2  VAL  63          2HG2      VAL  63   6.236  -2.288   8.458
  512   3HG2  VAL  63          3HG2      VAL  63   5.902  -3.715   7.477
  513    H    VAL  64           H        VAL  64   5.984  -0.708   4.009
  514    HA   VAL  64           HA       VAL  64   8.257  -0.697   2.363
  515    HB   VAL  64           HB       VAL  64   5.751   0.631   1.426
  516   1HG1  VAL  64          1HG1      VAL  64   7.640  -1.341   0.145
  517   2HG1  VAL  64          2HG1      VAL  64   7.667   0.410  -0.076
  518   3HG1  VAL  64          3HG1      VAL  64   6.288  -0.533  -0.647
  519   1HG2  VAL  64          1HG2      VAL  64   6.019  -2.233   2.230
  520   2HG2  VAL  64          2HG2      VAL  64   5.000  -1.794   0.859
  521   3HG2  VAL  64          3HG2      VAL  64   4.667  -1.125   2.457
  522    H    ASN  65           H        ASN  65   6.145   1.943   3.453
  523    HA   ASN  65           HA       ASN  65   7.439   4.053   2.166
  524   1HB   ASN  65          1HB       ASN  65   5.329   3.783   3.952
  525   2HB   ASN  65          2HB       ASN  65   6.495   4.773   4.825
  526   1HD2  ASN  65          1HD2      ASN  65   3.959   4.841   2.710
  527   2HD2  ASN  65          2HD2      ASN  65   4.205   6.416   2.040
  528    H    GLN  66           H        GLN  66   8.156   2.503   5.261
  529    HA   GLN  66           HA       GLN  66  10.058   4.324   6.202
  530   1HB   GLN  66          1HB       GLN  66   9.149   1.658   6.885
  531   2HB   GLN  66          2HB       GLN  66  10.882   1.833   7.138
  532   1HG   GLN  66          1HG       GLN  66  10.360   2.701   9.110
  533   2HG   GLN  66          2HG       GLN  66   9.860   4.139   8.225
  534   1HE2  GLN  66          1HE2      GLN  66   7.776   4.723   8.253
  535   2HE2  GLN  66          2HE2      GLN  66   6.490   3.792   8.959
  536    H    LEU  67           H        LEU  67  10.525   1.367   4.262
  537    HA   LEU  67           HA       LEU  67  13.348   1.582   4.236
  538   1HB   LEU  67          1HB       LEU  67  12.456   0.266   1.857
  539   2HB   LEU  67          2HB       LEU  67  13.272  -0.402   3.255
  540    HG   LEU  67           HG       LEU  67  10.475   0.016   3.824
  541   1HD1  LEU  67          1HD1      LEU  67  11.185  -1.173   1.224
  542   2HD1  LEU  67          2HD1      LEU  67   9.693  -0.401   1.753
  543   3HD1  LEU  67          3HD1      LEU  67  10.027  -2.072   2.203
  544   1HD2  LEU  67          1HD2      LEU  67  10.704  -1.957   4.891
  545   2HD2  LEU  67          2HD2      LEU  67  12.424  -1.608   4.697
  546   3HD2  LEU  67          3HD2      LEU  67  11.612  -2.691   3.569
  547    H    VAL  68           H        VAL  68  10.844   2.771   2.054
  548    HA   VAL  68           HA       VAL  68  12.576   3.743   0.025
  549    HB   VAL  68           HB       VAL  68   9.951   5.029   0.773
  550   1HG1  VAL  68          1HG1      VAL  68   9.856   5.414  -1.697
  551   2HG1  VAL  68          2HG1      VAL  68  11.506   4.792  -1.799
  552   3HG1  VAL  68          3HG1      VAL  68  11.173   6.257  -0.878
  553   1HG2  VAL  68          1HG2      VAL  68   9.089   2.962   0.518
  554   2HG2  VAL  68          2HG2      VAL  68  10.489   2.372  -0.375
  555   3HG2  VAL  68          3HG2      VAL  68   9.262   3.335  -1.197
  556    H    ASP  69           H        ASP  69  11.287   5.133   2.984
  557    HA   ASP  69           HA       ASP  69  12.260   7.748   2.706
  558   1HB   ASP  69          1HB       ASP  69  10.673   6.760   4.494
  559   2HB   ASP  69          2HB       ASP  69  12.146   6.314   5.352
  560    H    ASN  70           H        ASN  70  13.725   4.855   4.113
  561    HA   ASN  70           HA       ASN  70  16.111   6.148   4.952
  562   1HB   ASN  70          1HB       ASN  70  15.214   3.308   4.686
  563   2HB   ASN  70          2HB       ASN  70  16.930   3.638   4.902
  564   1HD2  ASN  70          1HD2      ASN  70  13.743   4.208   6.284
  565   2HD2  ASN  70          2HD2      ASN  70  14.279   4.390   7.920
  566    H    TRP  71           H        TRP  71  15.230   4.350   2.033
  567    HA   TRP  71           HA       TRP  71  17.814   4.254   0.899
  568   1HB   TRP  71          1HB       TRP  71  15.766   2.926   0.189
  569   2HB   TRP  71          2HB       TRP  71  15.219   4.373  -0.646
  570    HD1  TRP  71           HD1      TRP  71  18.015   1.717  -0.801
  571    HE1  TRP  71           HE1      TRP  71  19.037   1.751  -3.167
  572    HE3  TRP  71           HE3      TRP  71  15.448   5.703  -2.743
  573    HZ2  TRP  71           HZ2      TRP  71  18.765   3.240  -5.547
  574    HZ3  TRP  71           HZ3      TRP  71  15.865   6.334  -5.088
  575    HH2  TRP  71           HH2      TRP  71  17.500   5.138  -6.466
  576    H    LEU  72           H        LEU  72  15.197   6.618   0.649
  577    HA   LEU  72           HA       LEU  72  16.611   8.228  -1.254
  578   1HB   LEU  72          1HB       LEU  72  13.987   8.250   0.043
  579   2HB   LEU  72          2HB       LEU  72  14.645   9.851  -0.226
  580    HG   LEU  72           HG       LEU  72  13.711   9.711  -2.256
  581   1HD1  LEU  72          1HD1      LEU  72  14.980   8.318  -3.950
  582   2HD1  LEU  72          2HD1      LEU  72  16.005   7.804  -2.607
  583   3HD1  LEU  72          3HD1      LEU  72  15.913   9.509  -3.045
  584   1HD2  LEU  72          1HD2      LEU  72  12.709   7.758  -3.165
  585   2HD2  LEU  72          2HD2      LEU  72  12.418   7.742  -1.426
  586   3HD2  LEU  72          3HD2      LEU  72  13.668   6.708  -2.120
  587    H    LYS  73           H        LYS  73  16.218   8.261   2.239
  588    HA   LYS  73           HA       LYS  73  17.284  10.875   2.621
  589   1HB   LYS  73          1HB       LYS  73  16.742   8.528   4.391
  590   2HB   LYS  73          2HB       LYS  73  17.768   9.823   4.994
  591   1HG   LYS  73          1HG       LYS  73  16.018  11.428   4.734
  592   2HG   LYS  73          2HG       LYS  73  14.997  10.260   3.886
  593   1HD   LYS  73          1HD       LYS  73  14.481   9.115   5.815
  594   2HD   LYS  73          2HD       LYS  73  15.956   9.622   6.643
  595   1HE   LYS  73          1HE       LYS  73  15.023  11.520   7.413
  596   2HE   LYS  73          2HE       LYS  73  14.140  11.812   5.916
  597   1HZ   LYS  73          1HZ       LYS  73  12.405  11.339   7.255
  598   2HZ   LYS  73          2HZ       LYS  73  13.310  10.375   8.309
  599   3HZ   LYS  73          3HZ       LYS  73  12.780   9.740   6.826
  600    H    GLU  74           H        GLU  74  18.651   7.722   2.186
  601    HA   GLU  74           HA       GLU  74  21.334   8.555   2.911
  602   1HB   GLU  74          1HB       GLU  74  20.073   6.027   1.929
  603   2HB   GLU  74          2HB       GLU  74  21.807   6.240   1.734
  604   1HG   GLU  74          1HG       GLU  74  20.249   6.253   4.305
  605   2HG   GLU  74          2HG       GLU  74  21.408   5.042   3.756
  606    H    ASN  75           H        ASN  75  19.336   9.116   0.380
  607    HA   ASN  75           HA       ASN  75  21.397   9.003  -1.696
  608   1HB   ASN  75          1HB       ASN  75  18.580   8.628  -1.664
  609   2HB   ASN  75          2HB       ASN  75  18.902  10.069  -2.626
  610   1HD2  ASN  75          1HD2      ASN  75  18.453   6.878  -2.809
  611   2HD2  ASN  75          2HD2      ASN  75  19.328   6.538  -4.258
  612    H    GLU  76           H        GLU  76  18.896  11.277  -0.577
  613    HA   GLU  76           HA       GLU  76  20.707  13.497  -1.272
  614   1HB   GLU  76          1HB       GLU  76  17.697  13.658  -1.291
  615   2HB   GLU  76          2HB       GLU  76  18.847  14.795  -1.981
  616   1HG   GLU  76          1HG       GLU  76  19.157  12.162  -3.118
  617   2HG   GLU  76          2HG       GLU  76  17.507  12.755  -3.295
  618   1H    MET   1          1H        MET   1  29.970 -61.404 -75.903
  619   2H    MET   1          2H        MET   1  30.997 -61.518 -74.560
  620   3H    MET   1          3H        MET   1  29.388 -61.008 -74.362
  621    HA   MET   1           HA       MET   1  30.289 -63.703 -75.210
  622   1HB   MET   1          1HB       MET   1  29.959 -62.481 -72.665
  623   2HB   MET   1          2HB       MET   1  28.639 -63.626 -72.867
  624   1HG   MET   1          1HG       MET   1  30.117 -65.437 -73.130
  625   2HG   MET   1          2HG       MET   1  31.504 -64.372 -73.350
  626   1HE   MET   1          1HE       MET   1  28.673 -65.397 -70.995
  627   2HE   MET   1          2HE       MET   1  29.475 -65.574 -69.433
  628   3HE   MET   1          3HE       MET   1  29.847 -66.689 -70.748
  629    H    SER   2           H        SER   2  28.640 -65.168 -75.723
  630    HA   SER   2           HA       SER   2  26.394 -64.043 -77.019
  631   1HB   SER   2          1HB       SER   2  26.237 -66.910 -76.381
  632   2HB   SER   2          2HB       SER   2  26.183 -66.098 -77.946
  633    HG   SER   2           HG       SER   2  28.250 -66.425 -78.187
  634    H    LEU   3           H        LEU   3  26.793 -65.742 -73.942
  635    HA   LEU   3           HA       LEU   3  24.059 -64.890 -73.237
  636   1HB   LEU   3          1HB       LEU   3  24.273 -67.357 -73.525
  637   2HB   LEU   3          2HB       LEU   3  25.473 -67.367 -72.246
  638    HG   LEU   3           HG       LEU   3  23.275 -66.073 -71.121
  639   1HD1  LEU   3          1HD1      LEU   3  21.397 -67.506 -71.506
  640   2HD1  LEU   3          2HD1      LEU   3  22.343 -68.536 -72.583
  641   3HD1  LEU   3          3HD1      LEU   3  21.954 -66.882 -73.060
  642   1HD2  LEU   3          1HD2      LEU   3  23.063 -68.264 -69.873
  643   2HD2  LEU   3          2HD2      LEU   3  24.651 -67.498 -69.845
  644   3HD2  LEU   3          3HD2      LEU   3  24.353 -68.871 -70.912
  645    H    GLU   4           H        GLU   4  24.499 -63.079 -72.105
  646    HA   GLU   4           HA       GLU   4  26.334 -63.334 -69.809
  647   1HB   GLU   4          1HB       GLU   4  25.403 -60.676 -70.831
  648   2HB   GLU   4          2HB       GLU   4  26.880 -61.082 -69.971
  649   1HG   GLU   4          1HG       GLU   4  27.669 -62.252 -72.021
  650   2HG   GLU   4          2HG       GLU   4  26.245 -61.638 -72.857
  651    H    LYS   5           H        LYS   5  24.348 -64.452 -68.931
  652    HA   LYS   5           HA       LYS   5  22.148 -62.703 -68.228
  653   1HB   LYS   5          1HB       LYS   5  22.448 -65.473 -68.597
  654   2HB   LYS   5          2HB       LYS   5  22.097 -65.262 -66.887
  655   1HG   LYS   5          1HG       LYS   5  20.034 -65.585 -68.047
  656   2HG   LYS   5          2HG       LYS   5  20.115 -63.901 -67.519
  657   1HD   LYS   5          1HD       LYS   5  21.003 -63.358 -69.828
  658   2HD   LYS   5          2HD       LYS   5  20.550 -65.001 -70.292
  659   1HE   LYS   5          1HE       LYS   5  18.399 -63.644 -68.915
  660   2HE   LYS   5          2HE       LYS   5  18.935 -62.740 -70.331
  661   1HZ   LYS   5          1HZ       LYS   5  17.130 -64.538 -70.593
  662   2HZ   LYS   5          2HZ       LYS   5  18.423 -65.637 -70.536
  663   3HZ   LYS   5          3HZ       LYS   5  18.373 -64.449 -71.746
  664    H    ALA   6           H        ALA   6  24.051 -61.437 -67.134
  665    HA   ALA   6           HA       ALA   6  24.453 -62.354 -64.385
  666   1HB   ALA   6          1HB       ALA   6  26.384 -61.468 -65.694
  667   2HB   ALA   6          2HB       ALA   6  26.090 -60.616 -64.178
  668   3HB   ALA   6          3HB       ALA   6  25.588 -59.894 -65.709
  669    H    HIS   7           H        HIS   7  23.753 -61.133 -62.610
  670    HA   HIS   7           HA       HIS   7  22.090 -58.805 -63.120
  671   1HB   HIS   7          1HB       HIS   7  20.177 -59.673 -61.842
  672   2HB   HIS   7          2HB       HIS   7  20.474 -60.616 -63.291
  673    HD1  HIS   7           HD1      HIS   7  19.463 -61.120 -60.006
  674    HD2  HIS   7           HD2      HIS   7  22.278 -62.999 -62.427
  675    HE1  HIS   7           HE1      HIS   7  19.813 -63.400 -59.001
  676    HE2  HIS   7           HE2      HIS   7  21.356 -64.590 -60.608
  677    H    THR   8           H        THR   8  24.380 -58.483 -62.095
  678    HA   THR   8           HA       THR   8  24.372 -58.697 -59.198
  679    HB   THR   8           HB       THR   8  26.462 -57.108 -60.562
  680    HG1  THR   8           HG1      THR   8  27.446 -59.151 -61.292
  681   1HG2  THR   8          1HG2      THR   8  26.663 -59.459 -58.676
  682   2HG2  THR   8          2HG2      THR   8  26.496 -57.786 -58.146
  683   3HG2  THR   8          3HG2      THR   8  27.920 -58.283 -59.059
  684    H    SER   9           H        SER   9  22.354 -57.331 -59.255
  685    HA   SER   9           HA       SER   9  22.507 -54.592 -59.968
  686   1HB   SER   9          1HB       SER   9  20.455 -55.109 -58.016
  687   2HB   SER   9          2HB       SER   9  20.282 -54.772 -59.743
  688    HG   SER   9           HG       SER   9  20.120 -57.149 -58.393
  689    H    VAL  10           H        VAL  10  22.745 -52.784 -58.709
  690    HA   VAL  10           HA       VAL  10  23.799 -53.242 -55.997
  691    HB   VAL  10           HB       VAL  10  24.280 -50.702 -57.527
  692   1HG1  VAL  10          1HG1      VAL  10  26.068 -50.387 -56.031
  693   2HG1  VAL  10          2HG1      VAL  10  26.048 -52.074 -55.523
  694   3HG1  VAL  10          3HG1      VAL  10  24.741 -50.994 -55.043
  695   1HG2  VAL  10          1HG2      VAL  10  26.224 -51.524 -58.562
  696   2HG2  VAL  10          2HG2      VAL  10  25.000 -52.758 -58.869
  697   3HG2  VAL  10          3HG2      VAL  10  26.207 -53.011 -57.608
  698    H    LYS  11           H        LYS  11  21.954 -53.117 -54.829
  699    HA   LYS  11           HA       LYS  11  20.148 -50.869 -55.281
  700   1HB   LYS  11          1HB       LYS  11  19.942 -53.477 -53.817
  701   2HB   LYS  11          2HB       LYS  11  18.845 -52.163 -53.410
  702   1HG   LYS  11          1HG       LYS  11  17.543 -52.837 -55.065
  703   2HG   LYS  11          2HG       LYS  11  18.797 -52.323 -56.194
  704   1HD   LYS  11          1HD       LYS  11  19.761 -54.498 -56.240
  705   2HD   LYS  11          2HD       LYS  11  18.760 -55.037 -54.889
  706   1HE   LYS  11          1HE       LYS  11  16.912 -54.168 -56.738
  707   2HE   LYS  11          2HE       LYS  11  18.156 -54.915 -57.738
  708   1HZ   LYS  11          1HZ       LYS  11  17.639 -56.571 -55.526
  709   2HZ   LYS  11          2HZ       LYS  11  17.394 -56.898 -57.173
  710   3HZ   LYS  11          3HZ       LYS  11  16.162 -56.175 -56.258
  711    H    LYS  12           H        LYS  12  20.514 -49.062 -54.224
  712    HA   LYS  12           HA       LYS  12  22.040 -49.021 -51.762
  713   1HB   LYS  12          1HB       LYS  12  21.955 -47.264 -53.744
  714   2HB   LYS  12          2HB       LYS  12  20.621 -46.609 -52.805
  715   1HG   LYS  12          1HG       LYS  12  21.981 -46.023 -51.031
  716   2HG   LYS  12          2HG       LYS  12  23.244 -47.168 -51.489
  717   1HD   LYS  12          1HD       LYS  12  24.231 -45.699 -52.868
  718   2HD   LYS  12          2HD       LYS  12  22.691 -45.136 -53.520
  719   1HE   LYS  12          1HE       LYS  12  23.673 -43.283 -52.427
  720   2HE   LYS  12          2HE       LYS  12  22.378 -43.857 -51.376
  721   1HZ   LYS  12          1HZ       LYS  12  23.816 -44.311 -49.760
  722   2HZ   LYS  12          2HZ       LYS  12  24.963 -43.416 -50.636
  723   3HZ   LYS  12          3HZ       LYS  12  24.893 -45.103 -50.805
  724    H    MET  13           H        MET  13  20.248 -50.501 -50.913
  725    HA   MET  13           HA       MET  13  17.805 -49.132 -50.153
  726   1HB   MET  13          1HB       MET  13  18.732 -51.909 -50.333
  727   2HB   MET  13          2HB       MET  13  17.716 -51.590 -48.934
  728   1HG   MET  13          1HG       MET  13  15.870 -51.153 -50.194
  729   2HG   MET  13          2HG       MET  13  16.809 -50.609 -51.584
  730   1HE   MET  13          1HE       MET  13  14.333 -53.747 -51.885
  731   2HE   MET  13          2HE       MET  13  14.424 -52.540 -50.601
  732   3HE   MET  13          3HE       MET  13  14.952 -54.195 -50.296
  733    H    THR  14           H        THR  14  20.859 -49.451 -48.861
  734    HA   THR  14           HA       THR  14  19.892 -49.299 -46.095
  735    HB   THR  14           HB       THR  14  22.731 -49.270 -46.235
  736    HG1  THR  14           HG1      THR  14  21.453 -51.345 -47.744
  737   1HG2  THR  14          1HG2      THR  14  21.121 -50.126 -44.444
  738   2HG2  THR  14          2HG2      THR  14  22.570 -51.084 -44.753
  739   3HG2  THR  14          3HG2      THR  14  21.017 -51.595 -45.416
  740    H    PHE  15           H        PHE  15  19.553 -47.336 -45.365
  741    HA   PHE  15           HA       PHE  15  21.526 -45.241 -45.785
  742   1HB   PHE  15          1HB       PHE  15  19.923 -43.619 -46.645
  743   2HB   PHE  15          2HB       PHE  15  19.995 -45.015 -47.713
  744    HD1  PHE  15           HD1      PHE  15  17.898 -42.931 -45.687
  745    HD2  PHE  15           HD2      PHE  15  18.166 -46.740 -47.563
  746    HE1  PHE  15           HE1      PHE  15  15.456 -43.169 -45.543
  747    HE2  PHE  15           HE2      PHE  15  15.724 -46.983 -47.428
  748    HZ   PHE  15           HZ       PHE  15  14.372 -45.201 -46.353
  749    H    GLY  16           H        GLY  16  18.777 -46.557 -44.139
  750   1HA   GLY  16          1HA       GLY  16  18.348 -46.389 -41.862
  751   2HA   GLY  16          2HA       GLY  16  19.489 -45.056 -41.759
  752    H    GLU  17           H        GLU  17  16.332 -45.877 -41.493
  753    HA   GLU  17           HA       GLU  17  15.376 -43.200 -42.270
  754   1HB   GLU  17          1HB       GLU  17  14.239 -45.854 -42.481
  755   2HB   GLU  17          2HB       GLU  17  13.166 -44.775 -41.601
  756   1HG   GLU  17          1HG       GLU  17  14.167 -43.407 -43.881
  757   2HG   GLU  17          2HG       GLU  17  13.558 -44.983 -44.382
  758    H    ASN  18           H        ASN  18  16.098 -45.219 -39.632
  759    HA   ASN  18           HA       ASN  18  14.252 -44.173 -37.738
  760   1HB   ASN  18          1HB       ASN  18  16.227 -46.200 -37.805
  761   2HB   ASN  18          2HB       ASN  18  16.636 -45.129 -36.469
  762   1HD2  ASN  18          1HD2      ASN  18  14.805 -47.728 -37.424
  763   2HD2  ASN  18          2HD2      ASN  18  13.667 -47.756 -36.122
  764    H    ARG  19           H        ARG  19  14.446 -42.556 -36.274
  765    HA   ARG  19           HA       ARG  19  16.948 -41.092 -36.039
  766   1HB   ARG  19          1HB       ARG  19  15.221 -40.252 -37.960
  767   2HB   ARG  19          2HB       ARG  19  14.640 -39.333 -36.577
  768   1HG   ARG  19          1HG       ARG  19  16.197 -37.845 -37.142
  769   2HG   ARG  19          2HG       ARG  19  17.344 -38.972 -36.414
  770   1HD   ARG  19          1HD       ARG  19  18.327 -38.726 -38.454
  771   2HD   ARG  19          2HD       ARG  19  17.235 -40.059 -38.827
  772    HE   ARG  19           HE       ARG  19  16.350 -37.305 -39.333
  773   1HH1  ARG  19          1HH1      ARG  19  17.404 -40.410 -40.580
  774   2HH1  ARG  19          2HH1      ARG  19  16.755 -40.133 -42.170
  775   1HH2  ARG  19          1HH2      ARG  19  15.533 -36.923 -41.440
  776   2HH2  ARG  19          2HH2      ARG  19  15.674 -38.163 -42.654
  777    H    ASP  20           H        ASP  20  17.064 -41.435 -33.879
  778    HA   ASP  20           HA       ASP  20  14.770 -40.657 -32.214
  779   1HB   ASP  20          1HB       ASP  20  15.924 -42.867 -31.804
  780   2HB   ASP  20          2HB       ASP  20  17.351 -41.956 -31.311
  781    H    LEU  21           H        LEU  21  15.191 -38.414 -32.873
  782    HA   LEU  21           HA       LEU  21  17.505 -37.232 -31.489
  783   1HB   LEU  21          1HB       LEU  21  16.271 -36.821 -34.102
  784   2HB   LEU  21          2HB       LEU  21  16.514 -35.321 -33.229
  785    HG   LEU  21           HG       LEU  21  18.926 -35.938 -32.966
  786   1HD1  LEU  21          1HD1      LEU  21  19.209 -37.739 -35.106
  787   2HD1  LEU  21          2HD1      LEU  21  17.977 -38.417 -34.040
  788   3HD1  LEU  21          3HD1      LEU  21  19.573 -38.014 -33.402
  789   1HD2  LEU  21          1HD2      LEU  21  17.842 -35.721 -35.774
  790   2HD2  LEU  21          2HD2      LEU  21  19.518 -35.431 -35.306
  791   3HD2  LEU  21          3HD2      LEU  21  18.236 -34.386 -34.689
  792    H    GLU  22           H        GLU  22  14.291 -37.673 -31.076
  793    HA   GLU  22           HA       GLU  22  13.270 -35.140 -30.512
  794   1HB   GLU  22          1HB       GLU  22  12.066 -37.437 -30.658
  795   2HB   GLU  22          2HB       GLU  22  12.428 -37.556 -28.940
  796   1HG   GLU  22          1HG       GLU  22  10.208 -36.698 -29.228
  797   2HG   GLU  22          2HG       GLU  22  11.239 -35.429 -28.570
  798    H    ARG  23           H        ARG  23  13.804 -33.708 -29.051
  799    HA   ARG  23           HA       ARG  23  14.810 -34.609 -26.443
  800   1HB   ARG  23          1HB       ARG  23  16.412 -33.512 -28.419
  801   2HB   ARG  23          2HB       ARG  23  16.036 -32.133 -27.396
  802   1HG   ARG  23          1HG       ARG  23  18.087 -33.123 -26.669
  803   2HG   ARG  23          2HG       ARG  23  16.851 -33.402 -25.443
  804   1HD   ARG  23          1HD       ARG  23  18.088 -35.418 -25.702
  805   2HD   ARG  23          2HD       ARG  23  16.506 -35.673 -26.427
  806    HE   ARG  23           HE       ARG  23  18.413 -34.820 -28.364
  807   1HH1  ARG  23          1HH1      ARG  23  17.335 -37.589 -26.509
  808   2HH1  ARG  23          2HH1      ARG  23  17.940 -38.759 -27.649
  809   1HH2  ARG  23          1HH2      ARG  23  19.171 -36.344 -29.899
  810   2HH2  ARG  23          2HH2      ARG  23  18.991 -38.047 -29.580
  811    H    VAL  24           H        VAL  24  12.637 -34.162 -25.773
  812    HA   VAL  24           HA       VAL  24  12.162 -31.278 -25.373
  813    HB   VAL  24           HB       VAL  24   9.651 -32.302 -25.164
  814   1HG1  VAL  24          1HG1      VAL  24  10.726 -31.406 -27.817
  815   2HG1  VAL  24          2HG1      VAL  24  10.599 -30.305 -26.445
  816   3HG1  VAL  24          3HG1      VAL  24   9.152 -31.080 -27.091
  817   1HG2  VAL  24          1HG2      VAL  24  10.742 -34.479 -26.116
  818   2HG2  VAL  24          2HG2      VAL  24  10.622 -33.628 -27.656
  819   3HG2  VAL  24          3HG2      VAL  24   9.168 -33.943 -26.708
  820    H    VAL  25           H        VAL  25  11.023 -30.726 -23.442
  821    HA   VAL  25           HA       VAL  25  10.675 -32.763 -21.411
  822    HB   VAL  25           HB       VAL  25  13.082 -32.085 -21.222
  823   1HG1  VAL  25          1HG1      VAL  25  13.506 -29.926 -21.587
  824   2HG1  VAL  25          2HG1      VAL  25  13.057 -29.701 -19.895
  825   3HG1  VAL  25          3HG1      VAL  25  11.866 -29.431 -21.169
  826   1HG2  VAL  25          1HG2      VAL  25  12.228 -33.002 -19.267
  827   2HG2  VAL  25          2HG2      VAL  25  11.142 -31.642 -18.985
  828   3HG2  VAL  25          3HG2      VAL  25  12.875 -31.454 -18.723
  829    H    THR  26           H        THR  26   9.296 -32.096 -19.738
  830    HA   THR  26           HA       THR  26   7.902 -29.562 -20.308
  831    HB   THR  26           HB       THR  26   6.240 -31.425 -18.895
  832    HG1  THR  26           HG1      THR  26   7.589 -33.022 -19.874
  833   1HG2  THR  26          1HG2      THR  26   5.602 -29.504 -20.406
  834   2HG2  THR  26          2HG2      THR  26   4.723 -31.009 -20.674
  835   3HG2  THR  26          3HG2      THR  26   6.028 -30.542 -21.767
  836    H    ALA  27           H        ALA  27   9.336 -28.527 -18.748
  837    HA   ALA  27           HA       ALA  27   8.265 -28.846 -16.033
  838   1HB   ALA  27          1HB       ALA  27  10.405 -28.694 -15.004
  839   2HB   ALA  27          2HB       ALA  27  11.196 -28.376 -16.548
  840   3HB   ALA  27          3HB       ALA  27  10.508 -29.968 -16.220
  841    HA   PRO  28           HA       PRO  28   8.252 -24.481 -17.481
  842   1HB   PRO  28          1HB       PRO  28   5.661 -23.935 -17.070
  843   2HB   PRO  28          2HB       PRO  28   6.202 -24.829 -18.497
  844   1HG   PRO  28          1HG       PRO  28   4.980 -25.853 -15.967
  845   2HG   PRO  28          2HG       PRO  28   4.672 -26.353 -17.638
  846   1HD   PRO  28          1HD       PRO  28   6.318 -27.702 -15.892
  847   2HD   PRO  28          2HD       PRO  28   6.451 -27.787 -17.659
  848    H    VAL  29           H        VAL  29   8.045 -22.538 -16.331
  849    HA   VAL  29           HA       VAL  29   8.216 -21.161 -14.539
  850    HB   VAL  29           HB       VAL  29   6.368 -23.062 -13.097
  851   1HG1  VAL  29          1HG1      VAL  29   6.795 -20.089 -12.817
  852   2HG1  VAL  29          2HG1      VAL  29   7.383 -21.324 -11.703
  853   3HG1  VAL  29          3HG1      VAL  29   5.649 -21.066 -11.897
  854   1HG2  VAL  29          1HG2      VAL  29   4.746 -21.107 -14.049
  855   2HG2  VAL  29          2HG2      VAL  29   4.971 -22.677 -14.823
  856   3HG2  VAL  29          3HG2      VAL  29   5.887 -21.279 -15.382
  857    H    SER  30           H        SER  30  10.364 -21.463 -14.066
  858    HA   SER  30           HA       SER  30  11.179 -23.592 -12.273
  859   1HB   SER  30          1HB       SER  30  12.841 -21.252 -13.222
  860   2HB   SER  30          2HB       SER  30  13.412 -22.811 -12.620
  861    HG   SER  30           HG       SER  30  12.094 -23.653 -14.510
  862    H    SER  31           H        SER  31  10.407 -20.201 -12.161
  863    HA   SER  31           HA       SER  31  10.416 -20.335  -9.252
  864   1HB   SER  31          1HB       SER  31  11.440 -17.776 -10.341
  865   2HB   SER  31          2HB       SER  31  11.888 -18.635  -8.866
  866    HG   SER  31           HG       SER  31  12.864 -18.926 -11.484
  867    H    GLY  32           H        GLY  32   8.540 -19.602  -8.514
  868   1HA   GLY  32          1HA       GLY  32   7.185 -17.390  -9.844
  869   2HA   GLY  32          2HA       GLY  32   6.345 -18.936  -9.843
  870    H    LYS  33           H        LYS  33   8.156 -16.948  -7.503
  871    HA   LYS  33           HA       LYS  33   5.893 -17.284  -5.641
  872   1HB   LYS  33          1HB       LYS  33   8.843 -17.545  -5.027
  873   2HB   LYS  33          2HB       LYS  33   7.599 -17.405  -3.793
  874   1HG   LYS  33          1HG       LYS  33   6.561 -19.461  -5.017
  875   2HG   LYS  33          2HG       LYS  33   8.201 -19.670  -5.632
  876   1HD   LYS  33          1HD       LYS  33   8.964 -20.387  -3.652
  877   2HD   LYS  33          2HD       LYS  33   8.090 -19.141  -2.761
  878   1HE   LYS  33          1HE       LYS  33   6.097 -20.822  -3.669
  879   2HE   LYS  33          2HE       LYS  33   7.405 -21.922  -3.240
  880   1HZ   LYS  33          1HZ       LYS  33   5.759 -21.302  -1.430
  881   2HZ   LYS  33          2HZ       LYS  33   6.517 -19.785  -1.398
  882   3HZ   LYS  33          3HZ       LYS  33   7.406 -21.188  -1.040
  883    H    ILE  34           H        ILE  34   6.175 -15.082  -7.278
  884    HA   ILE  34           HA       ILE  34   7.183 -12.997  -5.451
  885    HB   ILE  34           HB       ILE  34   6.803 -11.675  -7.791
  886   1HG1  ILE  34          1HG1      ILE  34   7.936 -14.362  -8.600
  887   2HG1  ILE  34          2HG1      ILE  34   6.268 -13.885  -8.900
  888   1HG2  ILE  34          1HG2      ILE  34   8.758 -11.447  -6.453
  889   2HG2  ILE  34          2HG2      ILE  34   9.280 -11.902  -8.076
  890   3HG2  ILE  34          3HG2      ILE  34   9.253 -13.106  -6.785
  891   1HD1  ILE  34          1HD1      ILE  34   8.777 -12.843 -10.127
  892   2HD1  ILE  34          2HD1      ILE  34   7.326 -11.840 -10.078
  893   3HD1  ILE  34          3HD1      ILE  34   7.293 -13.400 -10.899
  894    H    LYS  35           H        LYS  35   5.847 -11.463  -4.741
  895    HA   LYS  35           HA       LYS  35   3.013 -11.642  -5.543
  896   1HB   LYS  35          1HB       LYS  35   3.622 -10.269  -3.017
  897   2HB   LYS  35          2HB       LYS  35   2.410 -11.494  -3.365
  898   1HG   LYS  35          1HG       LYS  35   5.127 -12.544  -3.362
  899   2HG   LYS  35          2HG       LYS  35   4.649 -11.834  -1.820
  900   1HD   LYS  35          1HD       LYS  35   3.334 -13.569  -1.353
  901   2HD   LYS  35          2HD       LYS  35   2.525 -13.444  -2.918
  902   1HE   LYS  35          1HE       LYS  35   4.448 -14.657  -3.932
  903   2HE   LYS  35          2HE       LYS  35   5.100 -14.893  -2.310
  904   1HZ   LYS  35          1HZ       LYS  35   3.209 -16.196  -1.717
  905   2HZ   LYS  35          2HZ       LYS  35   3.808 -16.803  -3.182
  906   3HZ   LYS  35          3HZ       LYS  35   2.415 -15.838  -3.171
  907    H    ARG  36           H        ARG  36   1.793  -9.640  -5.620
  908    HA   ARG  36           HA       ARG  36   3.519  -7.369  -6.353
  909   1HB   ARG  36          1HB       ARG  36   0.597  -7.686  -7.029
  910   2HB   ARG  36          2HB       ARG  36   1.754  -6.574  -7.746
  911   1HG   ARG  36          1HG       ARG  36   1.874  -9.570  -8.012
  912   2HG   ARG  36          2HG       ARG  36   1.167  -8.480  -9.206
  913   1HD   ARG  36          1HD       ARG  36   3.232  -7.551  -9.758
  914   2HD   ARG  36          2HD       ARG  36   3.984  -8.099  -8.261
  915    HE   ARG  36           HE       ARG  36   3.386 -10.422  -9.469
  916   1HH1  ARG  36          1HH1      ARG  36   4.988  -7.532 -10.626
  917   2HH1  ARG  36          2HH1      ARG  36   5.990  -8.392 -11.761
  918   1HH2  ARG  36          1HH2      ARG  36   4.703 -11.553 -10.933
  919   2HH2  ARG  36          2HH2      ARG  36   5.832 -10.685 -11.938
  920    H    VAL  37           H        VAL  37   3.287  -5.395  -5.414
  921    HA   VAL  37           HA       VAL  37   1.188  -5.091  -3.388
  922    HB   VAL  37           HB       VAL  37   3.851  -5.555  -2.738
  923   1HG1  VAL  37          1HG1      VAL  37   4.185  -3.111  -3.477
  924   2HG1  VAL  37          2HG1      VAL  37   4.839  -3.613  -1.919
  925   3HG1  VAL  37          3HG1      VAL  37   3.330  -2.701  -1.991
  926   1HG2  VAL  37          1HG2      VAL  37   2.870  -4.451  -0.477
  927   2HG2  VAL  37          2HG2      VAL  37   2.488  -6.079  -1.034
  928   3HG2  VAL  37          3HG2      VAL  37   1.381  -4.749  -1.371
  929    H    ASN  38           H        ASN  38   0.426  -3.026  -3.083
  930    HA   ASN  38           HA       ASN  38   1.349  -1.031  -5.046
  931   1HB   ASN  38          1HB       ASN  38  -0.915  -1.877  -5.514
  932   2HB   ASN  38          2HB       ASN  38  -1.424  -1.420  -3.892
  933   1HD2  ASN  38          1HD2      ASN  38  -0.240  -0.166  -6.950
  934   2HD2  ASN  38          2HD2      ASN  38  -0.977   1.392  -6.805
  935    H    VAL  39           H        VAL  39   2.391   0.607  -4.112
  936    HA   VAL  39           HA       VAL  39   1.501   1.448  -1.433
  937    HB   VAL  39           HB       VAL  39   4.161   2.250  -1.636
  938   1HG1  VAL  39          1HG1      VAL  39   4.439   1.019   0.320
  939   2HG1  VAL  39          2HG1      VAL  39   3.277  -0.213  -0.174
  940   3HG1  VAL  39          3HG1      VAL  39   2.714   1.391   0.298
  941   1HG2  VAL  39          1HG2      VAL  39   4.890  -0.406  -1.809
  942   2HG2  VAL  39          2HG2      VAL  39   5.176   0.834  -3.029
  943   3HG2  VAL  39          3HG2      VAL  39   3.754  -0.202  -3.141
  944    H    ASN  40           H        ASN  40   2.183   3.675  -0.874
  945    HA   ASN  40           HA       ASN  40   2.184   5.427  -3.238
  946   1HB   ASN  40          1HB       ASN  40   0.444   5.462  -0.801
  947   2HB   ASN  40          2HB       ASN  40   0.870   6.991  -1.561
  948   1HD2  ASN  40          1HD2      ASN  40  -0.475   3.801  -2.265
  949   2HD2  ASN  40          2HD2      ASN  40  -1.546   4.334  -3.523
  950    H    PHE  41           H        PHE  41   4.002   6.529  -3.291
  951    HA   PHE  41           HA       PHE  41   5.338   7.230  -0.760
  952   1HB   PHE  41          1HB       PHE  41   6.548   7.288  -3.534
  953   2HB   PHE  41          2HB       PHE  41   7.396   7.466  -2.006
  954    HD1  PHE  41           HD1      PHE  41   5.687   5.140  -0.735
  955    HD2  PHE  41           HD2      PHE  41   8.069   5.510  -4.243
  956    HE1  PHE  41           HE1      PHE  41   6.116   2.719  -0.695
  957    HE2  PHE  41           HE2      PHE  41   8.521   3.093  -4.195
  958    HZ   PHE  41           HZ       PHE  41   7.572   1.695  -2.499
  959    H    ASP  42           H        ASP  42   6.402   9.372  -0.749
  960    HA   ASP  42           HA       ASP  42   4.577  11.421  -1.367
  961   1HB   ASP  42          1HB       ASP  42   6.625  11.259   0.313
  962   2HB   ASP  42          2HB       ASP  42   7.461  12.072  -1.000
  963    H    GLU  43           H        GLU  43   4.892  13.272  -2.746
  964    HA   GLU  43           HA       GLU  43   5.561  12.624  -5.418
  965   1HB   GLU  43          1HB       GLU  43   4.232  14.709  -4.124
  966   2HB   GLU  43          2HB       GLU  43   5.633  15.469  -4.867
  967   1HG   GLU  43          1HG       GLU  43   4.430  13.678  -6.738
  968   2HG   GLU  43          2HG       GLU  43   3.201  14.754  -6.074
  969    H    GLU  44           H        GLU  44   7.228  14.319  -2.834
  970    HA   GLU  44           HA       GLU  44   9.472  15.187  -4.298
  971   1HB   GLU  44          1HB       GLU  44   8.682  14.958  -1.498
  972   2HB   GLU  44          2HB       GLU  44  10.403  14.704  -1.751
  973   1HG   GLU  44          1HG       GLU  44  10.311  16.968  -1.403
  974   2HG   GLU  44          2HG       GLU  44  10.254  16.874  -3.163
  975    H    LYS  45           H        LYS  45   8.692  12.154  -2.725
  976    HA   LYS  45           HA       LYS  45  11.302  11.043  -2.846
  977   1HB   LYS  45          1HB       LYS  45   8.582   9.754  -2.599
  978   2HB   LYS  45          2HB       LYS  45  10.101   8.862  -2.515
  979   1HG   LYS  45          1HG       LYS  45  10.557  10.779  -0.665
  980   2HG   LYS  45          2HG       LYS  45   8.807  10.599  -0.531
  981   1HD   LYS  45          1HD       LYS  45   8.988   8.604   0.465
  982   2HD   LYS  45          2HD       LYS  45  10.208   8.052  -0.686
  983   1HE   LYS  45          1HE       LYS  45  11.452   8.086   1.233
  984   2HE   LYS  45          2HE       LYS  45  11.743   9.720   0.643
  985   1HZ   LYS  45          1HZ       LYS  45   9.587   9.077   2.578
  986   2HZ   LYS  45          2HZ       LYS  45  10.195  10.609   2.163
  987   3HZ   LYS  45          3HZ       LYS  45  11.149   9.529   3.061
  988    H    HIS  46           H        HIS  46   8.755  11.426  -5.134
  989    HA   HIS  46           HA       HIS  46   9.719   9.378  -6.930
  990   1HB   HIS  46          1HB       HIS  46   7.315  10.644  -6.708
  991   2HB   HIS  46          2HB       HIS  46   8.029  11.500  -8.072
  992    HD1  HIS  46           HD1      HIS  46   8.053  10.311 -10.300
  993    HD2  HIS  46           HD2      HIS  46   7.021   7.807  -7.136
  994    HE1  HIS  46           HE1      HIS  46   7.291   8.161 -11.355
  995    HE2  HIS  46           HE2      HIS  46   6.470   6.744  -9.436
  996    H    THR  47           H        THR  47  10.089  12.844  -6.507
  997    HA   THR  47           HA       THR  47  11.459  13.404  -8.913
  998    HB   THR  47           HB       THR  47  12.308  14.932  -6.544
  999    HG1  THR  47           HG1      THR  47  10.291  15.740  -6.071
 1000   1HG2  THR  47          1HG2      THR  47  12.656  15.665  -8.874
 1001   2HG2  THR  47          2HG2      THR  47  11.687  16.815  -7.951
 1002   3HG2  THR  47          3HG2      THR  47  10.907  15.726  -9.097
 1003    H    ARG  48           H        ARG  48  12.567  12.521  -5.664
 1004    HA   ARG  48           HA       ARG  48  15.337  12.446  -6.323
 1005   1HB   ARG  48          1HB       ARG  48  14.071  10.792  -4.156
 1006   2HB   ARG  48          2HB       ARG  48  15.700  11.451  -4.212
 1007   1HG   ARG  48          1HG       ARG  48  13.232  13.161  -4.032
 1008   2HG   ARG  48          2HG       ARG  48  14.109  12.566  -2.622
 1009   1HD   ARG  48          1HD       ARG  48  16.163  13.658  -3.564
 1010   2HD   ARG  48          2HD       ARG  48  15.126  14.405  -4.779
 1011    HE   ARG  48           HE       ARG  48  13.972  14.994  -2.349
 1012   1HH1  ARG  48          1HH1      ARG  48  17.076  15.603  -3.889
 1013   2HH1  ARG  48          2HH1      ARG  48  17.350  17.086  -3.012
 1014   1HH2  ARG  48          1HH2      ARG  48  14.336  16.946  -1.230
 1015   2HH2  ARG  48          2HH2      ARG  48  15.805  17.836  -1.496
 1016    H    PHE  49           H        PHE  49  12.731  10.086  -6.320
 1017    HA   PHE  49           HA       PHE  49  14.181   7.755  -6.748
 1018   1HB   PHE  49          1HB       PHE  49  11.441   8.578  -6.902
 1019   2HB   PHE  49          2HB       PHE  49  11.815   7.590  -8.306
 1020    HD1  PHE  49           HD1      PHE  49  13.909   6.749  -5.591
 1021    HD2  PHE  49           HD2      PHE  49   9.994   6.157  -7.149
 1022    HE1  PHE  49           HE1      PHE  49  13.673   4.718  -4.224
 1023    HE2  PHE  49           HE2      PHE  49   9.751   4.130  -5.781
 1024    HZ   PHE  49           HZ       PHE  49  11.585   3.404  -4.326
 1025    H    LYS  50           H        LYS  50  12.845  10.031  -9.121
 1026    HA   LYS  50           HA       LYS  50  13.689   8.686 -11.430
 1027   1HB   LYS  50          1HB       LYS  50  12.698  11.359 -10.751
 1028   2HB   LYS  50          2HB       LYS  50  13.781  11.343 -12.137
 1029   1HG   LYS  50          1HG       LYS  50  11.214   9.814 -11.802
 1030   2HG   LYS  50          2HG       LYS  50  11.549  11.125 -12.934
 1031   1HD   LYS  50          1HD       LYS  50  13.304   9.649 -13.962
 1032   2HD   LYS  50          2HD       LYS  50  12.699   8.340 -12.945
 1033   1HE   LYS  50          1HE       LYS  50  10.485   9.558 -14.238
 1034   2HE   LYS  50          2HE       LYS  50  11.721   9.235 -15.452
 1035   1HZ   LYS  50          1HZ       LYS  50  11.576   6.990 -13.823
 1036   2HZ   LYS  50          2HZ       LYS  50  11.082   7.133 -15.437
 1037   3HZ   LYS  50          3HZ       LYS  50   9.974   7.422 -14.184
 1038    H    ALA  51           H        ALA  51  15.243  11.354  -9.656
 1039    HA   ALA  51           HA       ALA  51  17.530  11.478 -11.293
 1040   1HB   ALA  51          1HB       ALA  51  16.518  12.938  -9.190
 1041   2HB   ALA  51          2HB       ALA  51  18.041  13.231 -10.028
 1042   3HB   ALA  51          3HB       ALA  51  18.020  12.274  -8.547
 1043    H    ALA  52           H        ALA  52  16.944   9.788  -8.220
 1044    HA   ALA  52           HA       ALA  52  19.577   8.795  -7.963
 1045   1HB   ALA  52          1HB       ALA  52  17.799   7.035  -6.654
 1046   2HB   ALA  52          2HB       ALA  52  17.151   8.665  -6.492
 1047   3HB   ALA  52          3HB       ALA  52  18.791   8.313  -5.954
 1048    H    CYS  53           H        CYS  53  16.662   7.447  -9.462
 1049    HA   CYS  53           HA       CYS  53  17.755   4.877  -9.890
 1050   1HB   CYS  53          1HB       CYS  53  15.843   4.392 -11.141
 1051   2HB   CYS  53          2HB       CYS  53  15.284   5.626 -10.022
 1052    HG   CYS  53           HG       CYS  53  15.682   7.678 -12.061
 1053    H    ALA  54           H        ALA  54  17.953   7.888 -11.651
 1054    HA   ALA  54           HA       ALA  54  19.154   6.727 -14.000
 1055   1HB   ALA  54          1HB       ALA  54  18.606   8.709 -14.837
 1056   2HB   ALA  54          2HB       ALA  54  19.819   9.470 -13.807
 1057   3HB   ALA  54          3HB       ALA  54  18.163   9.285 -13.232
 1058    H    ARG  55           H        ARG  55  20.206   7.957 -10.937
 1059    HA   ARG  55           HA       ARG  55  22.983   8.203 -11.632
 1060   1HB   ARG  55          1HB       ARG  55  21.307   8.862  -9.404
 1061   2HB   ARG  55          2HB       ARG  55  22.660   7.897  -8.830
 1062   1HG   ARG  55          1HG       ARG  55  23.757   9.769 -10.604
 1063   2HG   ARG  55          2HG       ARG  55  22.606  10.650  -9.595
 1064   1HD   ARG  55          1HD       ARG  55  24.511  10.766  -8.308
 1065   2HD   ARG  55          2HD       ARG  55  23.729   9.330  -7.650
 1066    HE   ARG  55           HE       ARG  55  25.841   9.124  -9.697
 1067   1HH1  ARG  55          1HH1      ARG  55  24.493   8.223  -6.590
 1068   2HH1  ARG  55          2HH1      ARG  55  25.771   7.098  -6.223
 1069   1HH2  ARG  55          1HH2      ARG  55  27.491   7.633  -9.246
 1070   2HH2  ARG  55          2HH2      ARG  55  27.464   6.733  -7.755
 1071    H    LYS  56           H        LYS  56  20.916   5.798 -10.179
 1072    HA   LYS  56           HA       LYS  56  23.190   4.111  -9.525
 1073   1HB   LYS  56          1HB       LYS  56  20.553   4.534  -8.488
 1074   2HB   LYS  56          2HB       LYS  56  20.752   2.832  -8.880
 1075   1HG   LYS  56          1HG       LYS  56  23.023   3.984  -7.458
 1076   2HG   LYS  56          2HG       LYS  56  21.509   4.020  -6.551
 1077   1HD   LYS  56          1HD       LYS  56  21.865   1.892  -6.028
 1078   2HD   LYS  56          2HD       LYS  56  21.593   1.494  -7.726
 1079   1HE   LYS  56          1HE       LYS  56  23.698   0.555  -6.979
 1080   2HE   LYS  56          2HE       LYS  56  23.989   1.828  -8.165
 1081   1HZ   LYS  56          1HZ       LYS  56  24.002   2.525  -5.316
 1082   2HZ   LYS  56          2HZ       LYS  56  24.860   3.221  -6.603
 1083   3HZ   LYS  56          3HZ       LYS  56  25.354   1.730  -5.961
 1084    H    GLY  57           H        GLY  57  20.895   4.432 -12.015
 1085   1HA   GLY  57          1HA       GLY  57  20.560   3.170 -13.926
 1086   2HA   GLY  57          2HA       GLY  57  21.827   2.076 -13.380
 1087    H    THR  58           H        THR  58  18.644   3.110 -12.234
 1088    HA   THR  58           HA       THR  58  17.949   0.285 -11.777
 1089    HB   THR  58           HB       THR  58  17.024   2.410  -9.892
 1090    HG1  THR  58           HG1      THR  58  19.598   1.171  -9.763
 1091   1HG2  THR  58          1HG2      THR  58  18.018  -0.334  -9.215
 1092   2HG2  THR  58          2HG2      THR  58  16.389  -0.088  -9.851
 1093   3HG2  THR  58          3HG2      THR  58  16.876   0.686  -8.340
 1094    H    SER  59           H        SER  59  15.739  -0.246 -11.907
 1095    HA   SER  59           HA       SER  59  14.126   1.531 -13.539
 1096   1HB   SER  59          1HB       SER  59  12.700  -0.818 -12.760
 1097   2HB   SER  59          2HB       SER  59  13.377  -0.433 -14.343
 1098    HG   SER  59           HG       SER  59  15.328  -1.377 -13.703
 1099    H    ILE  60           H        ILE  60  11.794   1.857 -12.951
 1100    HA   ILE  60           HA       ILE  60  11.628   3.118 -10.453
 1101    HB   ILE  60           HB       ILE  60  10.274   3.681 -12.497
 1102   1HG1  ILE  60          1HG1      ILE  60   8.121   4.062 -11.009
 1103   2HG1  ILE  60          2HG1      ILE  60   9.184   3.503  -9.719
 1104   1HG2  ILE  60          1HG2      ILE  60   9.172   1.922 -13.361
 1105   2HG2  ILE  60          2HG2      ILE  60   7.919   2.402 -12.216
 1106   3HG2  ILE  60          3HG2      ILE  60   9.042   1.103 -11.806
 1107   1HD1  ILE  60          1HD1      ILE  60  10.303   5.431  -9.664
 1108   2HD1  ILE  60          2HD1      ILE  60   8.937   6.081 -10.568
 1109   3HD1  ILE  60          3HD1      ILE  60  10.383   5.544 -11.422
 1110    H    THR  61           H        THR  61  10.834  -0.119 -11.417
 1111    HA   THR  61           HA       THR  61   9.442  -0.722  -8.952
 1112    HB   THR  61           HB       THR  61  10.415  -2.968 -10.575
 1113    HG1  THR  61           HG1      THR  61   8.371  -1.494 -11.816
 1114   1HG2  THR  61          1HG2      THR  61   7.554  -2.243 -10.054
 1115   2HG2  THR  61          2HG2      THR  61   8.573  -2.858  -8.754
 1116   3HG2  THR  61          3HG2      THR  61   8.294  -3.838 -10.193
 1117    H    ASP  62           H        ASP  62  12.584  -1.184 -10.437
 1118    HA   ASP  62           HA       ASP  62  13.610  -3.036  -8.588
 1119   1HB   ASP  62          1HB       ASP  62  14.498  -1.785 -10.960
 1120   2HB   ASP  62          2HB       ASP  62  15.723  -1.472  -9.733
 1121    H    VAL  63           H        VAL  63  13.676   0.502  -8.655
 1122    HA   VAL  63           HA       VAL  63  15.616   0.887  -6.669
 1123    HB   VAL  63           HB       VAL  63  14.187   3.022  -6.131
 1124   1HG1  VAL  63          1HG1      VAL  63  16.280   2.483  -7.788
 1125   2HG1  VAL  63          2HG1      VAL  63  15.654   4.089  -7.419
 1126   3HG1  VAL  63          3HG1      VAL  63  15.131   3.253  -8.880
 1127   1HG2  VAL  63          1HG2      VAL  63  13.034   2.237  -8.801
 1128   2HG2  VAL  63          2HG2      VAL  63  12.746   3.741  -7.925
 1129   3HG2  VAL  63          3HG2      VAL  63  12.162   2.212  -7.268
 1130    H    VAL  64           H        VAL  64  12.150   0.313  -6.445
 1131    HA   VAL  64           HA       VAL  64  11.961   0.612  -3.630
 1132    HB   VAL  64           HB       VAL  64  10.141  -1.219  -5.150
 1133   1HG1  VAL  64          1HG1      VAL  64   9.653   0.797  -2.961
 1134   2HG1  VAL  64          2HG1      VAL  64   9.865  -0.937  -2.724
 1135   3HG1  VAL  64          3HG1      VAL  64   8.475  -0.333  -3.625
 1136   1HG2  VAL  64          1HG2      VAL  64   9.053   1.378  -5.252
 1137   2HG2  VAL  64          2HG2      VAL  64   9.544   0.353  -6.599
 1138   3HG2  VAL  64          3HG2      VAL  64  10.694   1.486  -5.888
 1139    H    ASN  65           H        ASN  65  12.431  -2.170  -5.772
 1140    HA   ASN  65           HA       ASN  65  12.485  -4.188  -3.820
 1141   1HB   ASN  65          1HB       ASN  65  12.589  -4.281  -6.457
 1142   2HB   ASN  65          2HB       ASN  65  14.326  -4.299  -6.183
 1143   1HD2  ASN  65          1HD2      ASN  65  13.726  -6.412  -7.387
 1144   2HD2  ASN  65          2HD2      ASN  65  13.508  -7.795  -6.363
 1145    H    GLN  66           H        GLN  66  14.903  -1.870  -4.834
 1146    HA   GLN  66           HA       GLN  66  17.117  -3.106  -3.543
 1147   1HB   GLN  66          1HB       GLN  66  16.725  -0.974  -5.303
 1148   2HB   GLN  66          2HB       GLN  66  17.426  -0.254  -3.859
 1149   1HG   GLN  66          1HG       GLN  66  19.407  -1.335  -4.115
 1150   2HG   GLN  66          2HG       GLN  66  18.672  -2.726  -4.911
 1151   1HE2  GLN  66          1HE2      GLN  66  19.432   0.690  -5.392
 1152   2HE2  GLN  66          2HE2      GLN  66  19.706   0.567  -7.096
 1153    H    LEU  67           H        LEU  67  14.885  -0.491  -2.587
 1154    HA   LEU  67           HA       LEU  67  16.328   0.100  -0.208
 1155   1HB   LEU  67          1HB       LEU  67  14.032   1.133   0.484
 1156   2HB   LEU  67          2HB       LEU  67  15.025   1.890  -0.742
 1157    HG   LEU  67           HG       LEU  67  13.418   0.254  -2.242
 1158   1HD1  LEU  67          1HD1      LEU  67  11.761   1.394   0.003
 1159   2HD1  LEU  67          2HD1      LEU  67  12.081  -0.321  -0.274
 1160   3HD1  LEU  67          3HD1      LEU  67  11.148   0.606  -1.450
 1161   1HD2  LEU  67          1HD2      LEU  67  12.148   2.400  -2.667
 1162   2HD2  LEU  67          2HD2      LEU  67  13.895   2.477  -2.887
 1163   3HD2  LEU  67          3HD2      LEU  67  13.159   3.136  -1.426
 1164    H    VAL  68           H        VAL  68  13.614  -2.003  -0.969
 1165    HA   VAL  68           HA       VAL  68  13.020  -2.801   1.686
 1166    HB   VAL  68           HB       VAL  68  12.746  -4.567  -0.750
 1167   1HG1  VAL  68          1HG1      VAL  68  12.126  -5.943   0.927
 1168   2HG1  VAL  68          2HG1      VAL  68  10.602  -5.066   0.793
 1169   3HG1  VAL  68          3HG1      VAL  68  11.770  -4.615   2.032
 1170   1HG2  VAL  68          1HG2      VAL  68  11.750  -2.315  -1.135
 1171   2HG2  VAL  68          2HG2      VAL  68  10.704  -2.599   0.257
 1172   3HG2  VAL  68          3HG2      VAL  68  10.585  -3.640  -1.163
 1173    H    ASP  69           H        ASP  69  15.279  -3.927  -0.754
 1174    HA   ASP  69           HA       ASP  69  16.218  -6.256   0.423
 1175   1HB   ASP  69          1HB       ASP  69  17.163  -4.360  -1.592
 1176   2HB   ASP  69          2HB       ASP  69  18.477  -5.128  -0.698
 1177    H    ASN  70           H        ASN  70  17.677  -3.023   0.657
 1178    HA   ASN  70           HA       ASN  70  19.670  -3.689   2.462
 1179   1HB   ASN  70          1HB       ASN  70  19.363  -1.509   1.150
 1180   2HB   ASN  70          2HB       ASN  70  18.324  -0.995   2.478
 1181   1HD2  ASN  70          1HD2      ASN  70  19.342   0.265   3.846
 1182   2HD2  ASN  70          2HD2      ASN  70  21.009   0.130   4.317
 1183    H    TRP  71           H        TRP  71  16.510  -2.212   3.202
 1184    HA   TRP  71           HA       TRP  71  16.860  -2.197   5.978
 1185   1HB   TRP  71          1HB       TRP  71  15.119  -0.904   4.766
 1186   2HB   TRP  71          2HB       TRP  71  14.238  -2.402   4.480
 1187    HD1  TRP  71           HD1      TRP  71  14.931   0.202   7.133
 1188    HE1  TRP  71           HE1      TRP  71  13.458  -0.255   9.200
 1189    HE3  TRP  71           HE3      TRP  71  13.077  -4.389   5.805
 1190    HZ2  TRP  71           HZ2      TRP  71  11.743  -2.293  10.127
 1191    HZ3  TRP  71           HZ3      TRP  71  11.517  -5.509   7.335
 1192    HH2  TRP  71           HH2      TRP  71  10.866  -4.486   9.451
 1193    H    LEU  72           H        LEU  72  14.998  -4.484   3.997
 1194    HA   LEU  72           HA       LEU  72  14.016  -6.066   5.987
 1195   1HB   LEU  72          1HB       LEU  72  13.665  -6.093   3.406
 1196   2HB   LEU  72          2HB       LEU  72  14.923  -7.315   3.421
 1197    HG   LEU  72           HG       LEU  72  13.051  -8.060   5.395
 1198   1HD1  LEU  72          1HD1      LEU  72  11.797  -6.515   3.386
 1199   2HD1  LEU  72          2HD1      LEU  72  11.047  -7.445   4.683
 1200   3HD1  LEU  72          3HD1      LEU  72  11.355  -8.201   3.120
 1201   1HD2  LEU  72          1HD2      LEU  72  14.471  -9.547   4.055
 1202   2HD2  LEU  72          2HD2      LEU  72  13.537  -9.140   2.617
 1203   3HD2  LEU  72          3HD2      LEU  72  12.773 -10.010   3.946
 1204    H    LYS  73           H        LYS  73  17.106  -6.516   4.301
 1205    HA   LYS  73           HA       LYS  73  17.648  -8.865   5.890
 1206   1HB   LYS  73          1HB       LYS  73  19.398  -7.528   3.826
 1207   2HB   LYS  73          2HB       LYS  73  19.575  -9.160   4.455
 1208   1HG   LYS  73          1HG       LYS  73  17.904  -9.990   3.155
 1209   2HG   LYS  73          2HG       LYS  73  16.976  -8.489   3.216
 1210   1HD   LYS  73          1HD       LYS  73  17.817  -7.807   1.273
 1211   2HD   LYS  73          2HD       LYS  73  19.468  -8.092   1.824
 1212   1HE   LYS  73          1HE       LYS  73  19.541  -9.718   0.297
 1213   2HE   LYS  73          2HE       LYS  73  18.504 -10.633   1.391
 1214   1HZ   LYS  73          1HZ       LYS  73  17.798 -10.318  -1.053
 1215   2HZ   LYS  73          2HZ       LYS  73  17.305  -8.770  -0.558
 1216   3HZ   LYS  73          3HZ       LYS  73  16.632 -10.153   0.167
 1217    H    GLU  74           H        GLU  74  18.476  -5.506   6.052
 1218    HA   GLU  74           HA       GLU  74  20.787  -6.078   7.744
 1219   1HB   GLU  74          1HB       GLU  74  19.920  -3.820   6.119
 1220   2HB   GLU  74          2HB       GLU  74  20.531  -3.340   7.696
 1221   1HG   GLU  74          1HG       GLU  74  22.016  -5.140   5.803
 1222   2HG   GLU  74          2HG       GLU  74  22.226  -3.391   5.875
 1223    H    ASN  75           H        ASN  75  17.560  -4.659   8.000
 1224    HA   ASN  75           HA       ASN  75  18.055  -3.649  10.650
 1225   1HB   ASN  75          1HB       ASN  75  16.367  -2.838   8.757
 1226   2HB   ASN  75          2HB       ASN  75  15.271  -3.913   9.627
 1227   1HD2  ASN  75          1HD2      ASN  75  17.332  -1.102   9.899
 1228   2HD2  ASN  75          2HD2      ASN  75  16.554  -0.433  11.305
 1229    H    GLU  76           H        GLU  76  16.785  -6.561   9.318
 1230    HA   GLU  76           HA       GLU  76  15.512  -7.375  11.790
 1231   1HB   GLU  76          1HB       GLU  76  15.392  -8.159   9.050
 1232   2HB   GLU  76          2HB       GLU  76  15.835  -9.567  10.010
 1233   1HG   GLU  76          1HG       GLU  76  13.678  -8.034  11.209
 1234   2HG   GLU  76          2HG       GLU  76  13.288  -8.615   9.591
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -28.779  54.081 -56.250
    2   2H    MET   1          2H        MET   1 -28.909  54.616 -57.854
    3   3H    MET   1          3H        MET   1 -29.174  52.984 -57.483
    4    HA   MET   1           HA       MET   1 -31.173  54.516 -57.888
    5   1HB   MET   1          1HB       MET   1 -31.077  52.135 -57.004
    6   2HB   MET   1          2HB       MET   1 -31.136  52.826 -55.390
    7   1HG   MET   1          1HG       MET   1 -33.341  52.209 -55.918
    8   2HG   MET   1          2HG       MET   1 -33.276  53.963 -56.074
    9   1HE   MET   1          1HE       MET   1 -35.551  54.040 -58.804
   10   2HE   MET   1          2HE       MET   1 -34.171  55.133 -58.705
   11   3HE   MET   1          3HE       MET   1 -34.954  54.569 -57.230
   12    H    SER   2           H        SER   2 -30.940  54.162 -54.380
   13    HA   SER   2           HA       SER   2 -31.237  57.088 -54.164
   14   1HB   SER   2          1HB       SER   2 -32.389  55.509 -51.973
   15   2HB   SER   2          2HB       SER   2 -33.084  56.856 -52.877
   16    HG   SER   2           HG       SER   2 -33.895  55.487 -54.353
   17    H    LEU   3           H        LEU   3 -28.937  57.195 -53.881
   18    HA   LEU   3           HA       LEU   3 -27.027  57.363 -52.666
   19   1HB   LEU   3          1HB       LEU   3 -29.208  57.829 -50.810
   20   2HB   LEU   3          2HB       LEU   3 -27.811  57.152 -49.998
   21    HG   LEU   3           HG       LEU   3 -27.878  59.636 -49.978
   22   1HD1  LEU   3          1HD1      LEU   3 -25.634  59.760 -49.990
   23   2HD1  LEU   3          2HD1      LEU   3 -25.496  59.065 -51.606
   24   3HD1  LEU   3          3HD1      LEU   3 -25.744  58.015 -50.210
   25   1HD2  LEU   3          1HD2      LEU   3 -28.878  59.847 -52.259
   26   2HD2  LEU   3          2HD2      LEU   3 -27.296  59.436 -52.924
   27   3HD2  LEU   3          3HD2      LEU   3 -27.494  60.901 -51.960
   28    H    GLU   4           H        GLU   4 -27.207  54.962 -53.633
   29    HA   GLU   4           HA       GLU   4 -26.232  52.924 -53.495
   30   1HB   GLU   4          1HB       GLU   4 -25.373  54.147 -50.964
   31   2HB   GLU   4          2HB       GLU   4 -25.384  52.390 -50.967
   32   1HG   GLU   4          1HG       GLU   4 -23.882  54.204 -52.836
   33   2HG   GLU   4          2HG       GLU   4 -23.210  53.143 -51.596
   34    H    LYS   5           H        LYS   5 -29.009  53.763 -52.128
   35    HA   LYS   5           HA       LYS   5 -29.555  51.084 -51.046
   36   1HB   LYS   5          1HB       LYS   5 -30.079  53.103 -49.619
   37   2HB   LYS   5          2HB       LYS   5 -31.303  53.535 -50.805
   38   1HG   LYS   5          1HG       LYS   5 -32.760  52.190 -49.830
   39   2HG   LYS   5          2HG       LYS   5 -31.675  50.813 -50.055
   40   1HD   LYS   5          1HD       LYS   5 -30.492  51.441 -47.984
   41   2HD   LYS   5          2HD       LYS   5 -31.644  52.760 -47.749
   42   1HE   LYS   5          1HE       LYS   5 -33.472  51.100 -47.688
   43   2HE   LYS   5          2HE       LYS   5 -32.276  49.811 -47.833
   44   1HZ   LYS   5          1HZ       LYS   5 -31.770  51.684 -45.688
   45   2HZ   LYS   5          2HZ       LYS   5 -31.713  49.990 -45.691
   46   3HZ   LYS   5          3HZ       LYS   5 -33.197  50.784 -45.508
   47    H    ALA   6           H        ALA   6 -30.691  49.708 -52.245
   48    HA   ALA   6           HA       ALA   6 -32.530  50.775 -54.274
   49   1HB   ALA   6          1HB       ALA   6 -30.524  48.598 -54.844
   50   2HB   ALA   6          2HB       ALA   6 -30.388  50.268 -55.393
   51   3HB   ALA   6          3HB       ALA   6 -31.714  49.255 -55.965
   52    H    HIS   7           H        HIS   7 -31.328  47.541 -53.370
   53    HA   HIS   7           HA       HIS   7 -33.977  46.874 -52.324
   54   1HB   HIS   7          1HB       HIS   7 -33.201  46.097 -54.889
   55   2HB   HIS   7          2HB       HIS   7 -32.893  44.677 -53.896
   56    HD1  HIS   7           HD1      HIS   7 -34.995  44.148 -55.824
   57    HD2  HIS   7           HD2      HIS   7 -35.841  46.098 -52.246
   58    HE1  HIS   7           HE1      HIS   7 -37.466  43.838 -55.447
   59    HE2  HIS   7           HE2      HIS   7 -37.983  45.170 -53.364
   60    H    THR   8           H        THR   8 -32.841  46.977 -50.325
   61    HA   THR   8           HA       THR   8 -30.654  45.141 -49.851
   62    HB   THR   8           HB       THR   8 -31.789  46.329 -47.464
   63    HG1  THR   8           HG1      THR   8 -32.506  47.973 -48.841
   64   1HG2  THR   8          1HG2      THR   8 -29.516  47.204 -47.221
   65   2HG2  THR   8          2HG2      THR   8 -29.143  46.706 -48.873
   66   3HG2  THR   8          3HG2      THR   8 -29.499  45.491 -47.643
   67    H    SER   9           H        SER   9 -31.984  43.252 -50.419
   68    HA   SER   9           HA       SER   9 -33.791  42.426 -48.251
   69   1HB   SER   9          1HB       SER   9 -33.723  40.851 -50.753
   70   2HB   SER   9          2HB       SER   9 -35.103  41.405 -49.800
   71    HG   SER   9           HG       SER   9 -34.563  43.568 -50.672
   72    H    VAL  10           H        VAL  10 -30.677  42.056 -49.215
   73    HA   VAL  10           HA       VAL  10 -30.473  39.218 -48.534
   74    HB   VAL  10           HB       VAL  10 -28.358  41.175 -49.459
   75   1HG1  VAL  10          1HG1      VAL  10 -26.861  39.259 -49.637
   76   2HG1  VAL  10          2HG1      VAL  10 -28.113  38.206 -48.974
   77   3HG1  VAL  10          3HG1      VAL  10 -27.405  39.473 -47.974
   78   1HG2  VAL  10          1HG2      VAL  10 -29.312  38.768 -50.957
   79   2HG2  VAL  10          2HG2      VAL  10 -28.503  40.213 -51.566
   80   3HG2  VAL  10          3HG2      VAL  10 -30.189  40.294 -51.052
   81    H    LYS  11           H        LYS  11 -29.808  38.505 -46.614
   82    HA   LYS  11           HA       LYS  11 -28.231  40.177 -44.854
   83   1HB   LYS  11          1HB       LYS  11 -30.891  40.413 -44.517
   84   2HB   LYS  11          2HB       LYS  11 -30.608  38.979 -43.540
   85   1HG   LYS  11          1HG       LYS  11 -28.648  40.527 -42.597
   86   2HG   LYS  11          2HG       LYS  11 -29.794  41.777 -43.085
   87   1HD   LYS  11          1HD       LYS  11 -31.548  40.607 -41.771
   88   2HD   LYS  11          2HD       LYS  11 -30.319  39.470 -41.211
   89   1HE   LYS  11          1HE       LYS  11 -29.125  41.817 -40.614
   90   2HE   LYS  11          2HE       LYS  11 -30.819  42.267 -40.432
   91   1HZ   LYS  11          1HZ       LYS  11 -29.544  39.943 -39.094
   92   2HZ   LYS  11          2HZ       LYS  11 -31.128  40.500 -38.860
   93   3HZ   LYS  11          3HZ       LYS  11 -29.814  41.445 -38.362
   94    H    LYS  12           H        LYS  12 -26.982  38.964 -43.463
   95    HA   LYS  12           HA       LYS  12 -26.691  36.206 -44.124
   96   1HB   LYS  12          1HB       LYS  12 -25.198  38.197 -42.665
   97   2HB   LYS  12          2HB       LYS  12 -25.261  36.695 -41.753
   98   1HG   LYS  12          1HG       LYS  12 -24.334  36.968 -44.604
   99   2HG   LYS  12          2HG       LYS  12 -23.289  36.813 -43.191
  100   1HD   LYS  12          1HD       LYS  12 -23.879  34.599 -42.841
  101   2HD   LYS  12          2HD       LYS  12 -25.390  34.756 -43.739
  102   1HE   LYS  12          1HE       LYS  12 -23.016  35.285 -45.353
  103   2HE   LYS  12          2HE       LYS  12 -23.058  33.652 -44.689
  104   1HZ   LYS  12          1HZ       LYS  12 -24.228  33.340 -46.597
  105   2HZ   LYS  12          2HZ       LYS  12 -24.847  34.918 -46.633
  106   3HZ   LYS  12          3HZ       LYS  12 -25.515  33.772 -45.579
  107    H    MET  13           H        MET  13 -28.026  34.698 -43.462
  108    HA   MET  13           HA       MET  13 -29.643  35.069 -41.104
  109   1HB   MET  13          1HB       MET  13 -30.224  33.932 -43.422
  110   2HB   MET  13          2HB       MET  13 -29.602  32.494 -42.620
  111   1HG   MET  13          1HG       MET  13 -31.499  34.025 -41.013
  112   2HG   MET  13          2HG       MET  13 -32.176  33.390 -42.512
  113   1HE   MET  13          1HE       MET  13 -32.847  31.635 -39.013
  114   2HE   MET  13          2HE       MET  13 -32.038  33.184 -39.262
  115   3HE   MET  13          3HE       MET  13 -31.125  31.793 -38.677
  116    H    THR  14           H        THR  14 -28.275  34.964 -39.358
  117    HA   THR  14           HA       THR  14 -26.453  32.792 -38.961
  118    HB   THR  14           HB       THR  14 -26.770  33.966 -36.511
  119    HG1  THR  14           HG1      THR  14 -26.672  36.313 -37.786
  120   1HG2  THR  14          1HG2      THR  14 -24.639  33.600 -37.634
  121   2HG2  THR  14          2HG2      THR  14 -24.758  35.269 -37.079
  122   3HG2  THR  14          3HG2      THR  14 -25.008  34.887 -38.783
  123    H    PHE  15           H        PHE  15 -27.097  30.826 -38.404
  124    HA   PHE  15           HA       PHE  15 -29.708  30.325 -37.311
  125   1HB   PHE  15          1HB       PHE  15 -28.945  27.939 -37.257
  126   2HB   PHE  15          2HB       PHE  15 -28.853  28.692 -38.843
  127    HD1  PHE  15           HD1      PHE  15 -26.674  29.274 -39.813
  128    HD2  PHE  15           HD2      PHE  15 -26.984  27.206 -36.109
  129    HE1  PHE  15           HE1      PHE  15 -24.314  28.612 -39.991
  130    HE2  PHE  15           HE2      PHE  15 -24.625  26.540 -36.277
  131    HZ   PHE  15           HZ       PHE  15 -23.283  27.240 -38.215
  132    H    GLY  16           H        GLY  16 -26.483  30.669 -36.114
  133   1HA   GLY  16          1HA       GLY  16 -25.671  30.881 -33.986
  134   2HA   GLY  16          2HA       GLY  16 -27.333  31.184 -33.504
  135    H    GLU  17           H        GLU  17 -25.088  28.576 -34.284
  136    HA   GLU  17           HA       GLU  17 -26.512  26.770 -32.466
  137   1HB   GLU  17          1HB       GLU  17 -24.881  26.382 -34.783
  138   2HB   GLU  17          2HB       GLU  17 -24.075  25.627 -33.414
  139   1HG   GLU  17          1HG       GLU  17 -26.925  25.048 -33.527
  140   2HG   GLU  17          2HG       GLU  17 -26.045  24.505 -34.952
  141    H    ASN  18           H        ASN  18 -23.601  28.623 -32.893
  142    HA   ASN  18           HA       ASN  18 -21.857  29.163 -31.552
  143   1HB   ASN  18          1HB       ASN  18 -23.773  30.282 -30.400
  144   2HB   ASN  18          2HB       ASN  18 -23.882  28.890 -29.328
  145   1HD2  ASN  18          1HD2      ASN  18 -23.341  29.866 -27.456
  146   2HD2  ASN  18          2HD2      ASN  18 -21.784  30.553 -27.137
  147    H    ARG  19           H        ARG  19 -21.240  26.854 -32.204
  148    HA   ARG  19           HA       ARG  19 -21.161  24.965 -30.005
  149   1HB   ARG  19          1HB       ARG  19 -21.227  24.682 -32.721
  150   2HB   ARG  19          2HB       ARG  19 -19.519  24.426 -32.392
  151   1HG   ARG  19          1HG       ARG  19 -20.818  22.913 -30.469
  152   2HG   ARG  19          2HG       ARG  19 -21.773  22.684 -31.934
  153   1HD   ARG  19          1HD       ARG  19 -20.216  21.366 -32.817
  154   2HD   ARG  19          2HD       ARG  19 -18.967  22.581 -32.544
  155    HE   ARG  19           HE       ARG  19 -19.800  20.889 -30.296
  156   1HH1  ARG  19          1HH1      ARG  19 -17.381  21.816 -32.655
  157   2HH1  ARG  19          2HH1      ARG  19 -16.105  20.905 -31.898
  158   1HH2  ARG  19          1HH2      ARG  19 -18.112  19.704 -29.284
  159   2HH2  ARG  19          2HH2      ARG  19 -16.523  19.688 -30.002
  160    H    ASP  20           H        ASP  20 -19.926  27.162 -29.133
  161    HA   ASP  20           HA       ASP  20 -17.049  26.894 -29.516
  162   1HB   ASP  20          1HB       ASP  20 -17.948  29.162 -29.429
  163   2HB   ASP  20          2HB       ASP  20 -18.684  28.837 -27.864
  164    H    LEU  21           H        LEU  21 -15.675  26.038 -28.025
  165    HA   LEU  21           HA       LEU  21 -16.903  24.959 -25.570
  166   1HB   LEU  21          1HB       LEU  21 -15.386  23.660 -27.713
  167   2HB   LEU  21          2HB       LEU  21 -14.787  23.291 -26.108
  168    HG   LEU  21           HG       LEU  21 -17.236  22.688 -25.552
  169   1HD1  LEU  21          1HD1      LEU  21 -18.000  23.727 -27.771
  170   2HD1  LEU  21          2HD1      LEU  21 -18.700  22.182 -27.290
  171   3HD1  LEU  21          3HD1      LEU  21 -17.425  22.229 -28.506
  172   1HD2  LEU  21          1HD2      LEU  21 -16.358  20.672 -27.460
  173   2HD2  LEU  21          2HD2      LEU  21 -16.558  20.567 -25.711
  174   3HD2  LEU  21          3HD2      LEU  21 -15.068  21.220 -26.392
  175    H    GLU  22           H        GLU  22 -15.573  24.779 -23.727
  176    HA   GLU  22           HA       GLU  22 -13.494  26.808 -23.595
  177   1HB   GLU  22          1HB       GLU  22 -15.448  25.930 -21.830
  178   2HB   GLU  22          2HB       GLU  22 -13.966  25.254 -21.170
  179   1HG   GLU  22          1HG       GLU  22 -13.439  27.941 -21.874
  180   2HG   GLU  22          2HG       GLU  22 -14.958  27.903 -20.979
  181    H    ARG  23           H        ARG  23 -12.069  25.507 -25.011
  182    HA   ARG  23           HA       ARG  23 -10.974  23.080 -23.871
  183   1HB   ARG  23          1HB       ARG  23 -11.433  23.794 -26.425
  184   2HB   ARG  23          2HB       ARG  23  -9.748  24.280 -26.287
  185   1HG   ARG  23          1HG       ARG  23  -9.842  22.052 -27.147
  186   2HG   ARG  23          2HG       ARG  23  -9.205  21.992 -25.502
  187   1HD   ARG  23          1HD       ARG  23 -11.270  21.201 -24.639
  188   2HD   ARG  23          2HD       ARG  23 -12.111  21.552 -26.148
  189    HE   ARG  23           HE       ARG  23 -11.032  19.680 -27.146
  190   1HH1  ARG  23          1HH1      ARG  23 -10.486  19.993 -23.698
  191   2HH1  ARG  23          2HH1      ARG  23 -10.012  18.334 -23.490
  192   1HH2  ARG  23          1HH2      ARG  23 -10.421  17.486 -26.877
  193   2HH2  ARG  23          2HH2      ARG  23 -10.032  16.895 -25.286
  194    H    VAL  24           H        VAL  24 -10.249  24.459 -21.993
  195    HA   VAL  24           HA       VAL  24  -7.647  25.699 -22.530
  196    HB   VAL  24           HB       VAL  24  -9.048  27.143 -21.264
  197   1HG1  VAL  24          1HG1      VAL  24  -9.551  25.939 -18.819
  198   2HG1  VAL  24          2HG1      VAL  24  -9.930  24.697 -20.011
  199   3HG1  VAL  24          3HG1      VAL  24 -10.718  26.274 -20.097
  200   1HG2  VAL  24          1HG2      VAL  24  -7.370  26.026 -19.071
  201   2HG2  VAL  24          2HG2      VAL  24  -7.622  27.700 -19.559
  202   3HG2  VAL  24          3HG2      VAL  24  -6.585  26.650 -20.523
  203    H    VAL  25           H        VAL  25  -5.845  24.602 -22.098
  204    HA   VAL  25           HA       VAL  25  -6.108  22.158 -20.485
  205    HB   VAL  25           HB       VAL  25  -3.810  21.768 -21.914
  206   1HG1  VAL  25          1HG1      VAL  25  -5.368  20.036 -21.673
  207   2HG1  VAL  25          2HG1      VAL  25  -5.297  20.346 -23.408
  208   3HG1  VAL  25          3HG1      VAL  25  -6.649  20.961 -22.457
  209   1HG2  VAL  25          1HG2      VAL  25  -5.713  23.336 -23.642
  210   2HG2  VAL  25          2HG2      VAL  25  -4.477  22.263 -24.297
  211   3HG2  VAL  25          3HG2      VAL  25  -4.008  23.661 -23.328
  212    H    THR  26           H        THR  26  -5.720  23.775 -18.724
  213    HA   THR  26           HA       THR  26  -2.931  24.496 -18.321
  214    HB   THR  26           HB       THR  26  -5.150  24.704 -16.288
  215    HG1  THR  26           HG1      THR  26  -4.383  26.646 -18.242
  216   1HG2  THR  26          1HG2      THR  26  -3.699  25.879 -15.039
  217   2HG2  THR  26          2HG2      THR  26  -3.086  26.771 -16.431
  218   3HG2  THR  26          3HG2      THR  26  -2.455  25.166 -16.066
  219    H    ALA  27           H        ALA  27  -1.533  23.056 -17.552
  220    HA   ALA  27           HA       ALA  27  -2.405  20.513 -16.586
  221   1HB   ALA  27          1HB       ALA  27   0.240  20.508 -16.053
  222   2HB   ALA  27          2HB       ALA  27   0.165  21.788 -17.263
  223   3HB   ALA  27          3HB       ALA  27  -0.442  20.177 -17.645
  224    HA   PRO  28           HA       PRO  28  -2.635  21.799 -12.320
  225   1HB   PRO  28          1HB       PRO  28  -3.365  19.068 -11.698
  226   2HB   PRO  28          2HB       PRO  28  -4.386  20.506 -11.694
  227   1HG   PRO  28          1HG       PRO  28  -4.659  18.473 -13.495
  228   2HG   PRO  28          2HG       PRO  28  -5.112  20.152 -13.840
  229   1HD   PRO  28          1HD       PRO  28  -2.638  18.658 -14.621
  230   2HD   PRO  28          2HD       PRO  28  -3.618  19.794 -15.575
  231    H    VAL  29           H        VAL  29  -0.191  21.845 -12.568
  232    HA   VAL  29           HA       VAL  29   1.260  19.508 -11.734
  233    HB   VAL  29           HB       VAL  29   3.174  21.293 -11.574
  234   1HG1  VAL  29          1HG1      VAL  29   1.875  20.438 -14.155
  235   2HG1  VAL  29          2HG1      VAL  29   3.123  19.580 -13.251
  236   3HG1  VAL  29          3HG1      VAL  29   3.496  21.119 -14.028
  237   1HG2  VAL  29          1HG2      VAL  29   1.623  23.230 -11.664
  238   2HG2  VAL  29          2HG2      VAL  29   1.192  22.767 -13.310
  239   3HG2  VAL  29          3HG2      VAL  29   2.846  23.255 -12.937
  240    H    SER  30           H        SER  30  -0.371  19.673  -9.748
  241    HA   SER  30           HA       SER  30   0.279  21.447  -7.652
  242   1HB   SER  30          1HB       SER  30  -0.880  18.848  -6.892
  243   2HB   SER  30          2HB       SER  30  -1.488  20.480  -6.605
  244    HG   SER  30           HG       SER  30  -2.196  20.521  -8.791
  245    H    SER  31           H        SER  31   1.696  21.319  -6.020
  246    HA   SER  31           HA       SER  31   3.807  19.366  -6.175
  247   1HB   SER  31          1HB       SER  31   3.823  21.029  -3.792
  248   2HB   SER  31          2HB       SER  31   4.988  20.960  -5.115
  249    HG   SER  31           HG       SER  31   3.709  22.399  -6.281
  250    H    GLY  32           H        GLY  32   1.046  20.054  -4.137
  251   1HA   GLY  32          1HA       GLY  32   1.706  17.970  -2.225
  252   2HA   GLY  32          2HA       GLY  32   0.260  18.971  -2.232
  253    H    LYS  33           H        LYS  33   1.800  16.560  -4.341
  254    HA   LYS  33           HA       LYS  33  -0.804  15.208  -4.544
  255   1HB   LYS  33          1HB       LYS  33   1.202  15.836  -6.688
  256   2HB   LYS  33          2HB       LYS  33   0.138  14.445  -6.848
  257   1HG   LYS  33          1HG       LYS  33  -1.482  16.635  -6.117
  258   2HG   LYS  33          2HG       LYS  33  -0.399  17.191  -7.396
  259   1HD   LYS  33          1HD       LYS  33  -1.212  15.649  -8.928
  260   2HD   LYS  33          2HD       LYS  33  -1.837  14.581  -7.671
  261   1HE   LYS  33          1HE       LYS  33  -3.812  15.492  -8.306
  262   2HE   LYS  33          2HE       LYS  33  -3.326  16.752  -7.173
  263   1HZ   LYS  33          1HZ       LYS  33  -2.618  18.132  -8.918
  264   2HZ   LYS  33          2HZ       LYS  33  -4.104  17.502  -9.438
  265   3HZ   LYS  33          3HZ       LYS  33  -2.660  16.874 -10.059
  266    H    ILE  34           H        ILE  34  -0.773  12.984  -4.482
  267    HA   ILE  34           HA       ILE  34   1.763  11.814  -3.548
  268    HB   ILE  34           HB       ILE  34  -1.088  10.870  -3.146
  269   1HG1  ILE  34          1HG1      ILE  34  -0.417  12.907  -1.866
  270   2HG1  ILE  34          2HG1      ILE  34  -0.797  11.528  -0.838
  271   1HG2  ILE  34          1HG2      ILE  34   0.374   9.494  -1.342
  272   2HG2  ILE  34          2HG2      ILE  34   1.510   9.576  -2.690
  273   3HG2  ILE  34          3HG2      ILE  34  -0.089   8.869  -2.926
  274   1HD1  ILE  34          1HD1      ILE  34   1.102  12.254   0.172
  275   2HD1  ILE  34          2HD1      ILE  34   1.790  12.884  -1.324
  276   3HD1  ILE  34          3HD1      ILE  34   1.812  11.150  -1.005
  277    H    LYS  35           H        LYS  35   2.603  10.038  -4.494
  278    HA   LYS  35           HA       LYS  35   1.439   9.287  -7.094
  279   1HB   LYS  35          1HB       LYS  35   4.294   8.741  -6.445
  280   2HB   LYS  35          2HB       LYS  35   3.559   9.199  -7.977
  281   1HG   LYS  35          1HG       LYS  35   3.251  11.352  -6.148
  282   2HG   LYS  35          2HG       LYS  35   4.935  10.829  -6.126
  283   1HD   LYS  35          1HD       LYS  35   4.959  12.351  -7.846
  284   2HD   LYS  35          2HD       LYS  35   4.665  10.852  -8.725
  285   1HE   LYS  35          1HE       LYS  35   2.410  11.352  -9.057
  286   2HE   LYS  35          2HE       LYS  35   2.391  12.550  -7.763
  287   1HZ   LYS  35          1HZ       LYS  35   4.119  13.731  -9.289
  288   2HZ   LYS  35          2HZ       LYS  35   2.459  13.887  -9.605
  289   3HZ   LYS  35          3HZ       LYS  35   3.397  12.798 -10.511
  290    H    ARG  36           H        ARG  36   1.687   7.064  -7.774
  291    HA   ARG  36           HA       ARG  36   1.794   5.225  -5.468
  292   1HB   ARG  36          1HB       ARG  36   0.383   3.806  -7.299
  293   2HB   ARG  36          2HB       ARG  36  -0.345   4.799  -6.045
  294   1HG   ARG  36          1HG       ARG  36  -1.441   5.812  -7.682
  295   2HG   ARG  36          2HG       ARG  36   0.090   6.587  -8.088
  296   1HD   ARG  36          1HD       ARG  36  -0.254   5.674 -10.110
  297   2HD   ARG  36          2HD       ARG  36   0.373   4.211  -9.353
  298    HE   ARG  36           HE       ARG  36  -1.698   3.270  -9.540
  299   1HH1  ARG  36          1HH1      ARG  36  -1.987   6.733  -9.961
  300   2HH1  ARG  36          2HH1      ARG  36  -3.704   6.693 -10.251
  301   1HH2  ARG  36          1HH2      ARG  36  -3.940   3.192 -10.021
  302   2HH2  ARG  36          2HH2      ARG  36  -4.809   4.674 -10.309
  303    H    VAL  37           H        VAL  37   3.136   3.553  -5.526
  304    HA   VAL  37           HA       VAL  37   4.438   2.904  -8.089
  305    HB   VAL  37           HB       VAL  37   5.726   3.120  -5.366
  306   1HG1  VAL  37          1HG1      VAL  37   7.260   2.208  -7.750
  307   2HG1  VAL  37          2HG1      VAL  37   6.309   1.032  -6.843
  308   3HG1  VAL  37          3HG1      VAL  37   7.580   1.948  -6.034
  309   1HG2  VAL  37          1HG2      VAL  37   7.291   4.326  -7.345
  310   2HG2  VAL  37          2HG2      VAL  37   6.311   5.129  -6.118
  311   3HG2  VAL  37          3HG2      VAL  37   5.628   4.791  -7.708
  312    H    ASN  38           H        ASN  38   4.372   0.837  -8.642
  313    HA   ASN  38           HA       ASN  38   3.218  -1.066  -6.731
  314   1HB   ASN  38          1HB       ASN  38   2.297  -0.517  -9.158
  315   2HB   ASN  38          2HB       ASN  38   3.520  -1.690  -9.639
  316   1HD2  ASN  38          1HD2      ASN  38   2.646  -3.593  -9.956
  317   2HD2  ASN  38          2HD2      ASN  38   1.395  -4.320  -8.993
  318    H    VAL  39           H        VAL  39   4.687  -2.216  -5.700
  319    HA   VAL  39           HA       VAL  39   7.215  -2.828  -7.047
  320    HB   VAL  39           HB       VAL  39   6.700  -3.225  -4.114
  321   1HG1  VAL  39          1HG1      VAL  39   8.854  -3.765  -4.063
  322   2HG1  VAL  39          2HG1      VAL  39   9.295  -2.242  -4.840
  323   3HG1  VAL  39          3HG1      VAL  39   8.886  -3.648  -5.824
  324   1HG2  VAL  39          1HG2      VAL  39   6.068  -0.884  -4.881
  325   2HG2  VAL  39          2HG2      VAL  39   7.774  -0.663  -5.264
  326   3HG2  VAL  39          3HG2      VAL  39   7.279  -0.999  -3.606
  327    H    ASN  40           H        ASN  40   8.065  -4.875  -7.096
  328    HA   ASN  40           HA       ASN  40   6.202  -7.070  -6.522
  329   1HB   ASN  40          1HB       ASN  40   7.974  -6.527  -8.754
  330   2HB   ASN  40          2HB       ASN  40   8.364  -8.078  -8.011
  331   1HD2  ASN  40          1HD2      ASN  40   6.600  -6.671 -10.353
  332   2HD2  ASN  40          2HD2      ASN  40   5.293  -7.812 -10.484
  333    H    PHE  41           H        PHE  41   6.612  -7.866  -4.580
  334    HA   PHE  41           HA       PHE  41   9.375  -7.863  -3.586
  335   1HB   PHE  41          1HB       PHE  41   6.676  -7.891  -2.273
  336   2HB   PHE  41          2HB       PHE  41   8.071  -8.505  -1.393
  337    HD1  PHE  41           HD1      PHE  41  10.059  -6.520  -2.641
  338    HD2  PHE  41           HD2      PHE  41   6.239  -6.043  -0.826
  339    HE1  PHE  41           HE1      PHE  41  10.662  -4.225  -1.994
  340    HE2  PHE  41           HE2      PHE  41   6.834  -3.742  -0.176
  341    HZ   PHE  41           HZ       PHE  41   9.018  -2.840  -0.719
  342    H    ASP  42           H        ASP  42  10.461  -9.687  -3.273
  343    HA   ASP  42           HA       ASP  42   9.505 -12.161  -4.250
  344   1HB   ASP  42          1HB       ASP  42  11.754 -12.259  -4.378
  345   2HB   ASP  42          2HB       ASP  42  11.962 -11.092  -3.078
  346    H    GLU  43           H        GLU  43   8.919 -14.037  -3.159
  347    HA   GLU  43           HA       GLU  43   7.154 -13.719  -1.076
  348   1HB   GLU  43          1HB       GLU  43   8.282 -15.953  -2.546
  349   2HB   GLU  43          2HB       GLU  43   7.910 -16.380  -0.880
  350   1HG   GLU  43          1HG       GLU  43   5.928 -14.997  -2.651
  351   2HG   GLU  43          2HG       GLU  43   6.098 -16.751  -2.613
  352    H    GLU  44           H        GLU  44  10.544 -14.680  -0.885
  353    HA   GLU  44           HA       GLU  44  10.606 -15.339   1.865
  354   1HB   GLU  44          1HB       GLU  44  12.420 -15.362  -0.199
  355   2HB   GLU  44          2HB       GLU  44  13.007 -14.031   0.792
  356   1HG   GLU  44          1HG       GLU  44  13.803 -16.522   1.156
  357   2HG   GLU  44          2HG       GLU  44  13.625 -15.390   2.494
  358    H    LYS  45           H        LYS  45  11.532 -12.388   0.144
  359    HA   LYS  45           HA       LYS  45  12.017 -10.761   2.348
  360   1HB   LYS  45          1HB       LYS  45  11.109 -10.169  -0.461
  361   2HB   LYS  45          2HB       LYS  45  11.354  -8.885   0.717
  362   1HG   LYS  45          1HG       LYS  45  13.698  -9.772   1.012
  363   2HG   LYS  45          2HG       LYS  45  13.395 -10.769  -0.414
  364   1HD   LYS  45          1HD       LYS  45  13.367  -8.977  -1.834
  365   2HD   LYS  45          2HD       LYS  45  12.775  -7.868  -0.592
  366   1HE   LYS  45          1HE       LYS  45  14.853  -7.338   0.108
  367   2HE   LYS  45          2HE       LYS  45  15.459  -8.976  -0.121
  368   1HZ   LYS  45          1HZ       LYS  45  16.469  -7.329  -1.636
  369   2HZ   LYS  45          2HZ       LYS  45  14.946  -7.072  -2.344
  370   3HZ   LYS  45          3HZ       LYS  45  15.685  -8.592  -2.455
  371    H    HIS  46           H        HIS  46   9.012 -11.367   0.588
  372    HA   HIS  46           HA       HIS  46   7.523  -9.395   1.978
  373   1HB   HIS  46          1HB       HIS  46   6.988 -10.486  -0.279
  374   2HB   HIS  46          2HB       HIS  46   6.292 -11.801   0.662
  375    HD1  HIS  46           HD1      HIS  46   3.897 -11.560   1.188
  376    HD2  HIS  46           HD2      HIS  46   5.694  -7.879   0.432
  377    HE1  HIS  46           HE1      HIS  46   2.037  -9.861   1.278
  378    HE2  HIS  46           HE2      HIS  46   3.137  -7.639   0.839
  379    H    THR  47           H        THR  47   8.105 -12.807   2.614
  380    HA   THR  47           HA       THR  47   6.120 -13.027   4.660
  381    HB   THR  47           HB       THR  47   8.606 -14.719   4.347
  382    HG1  THR  47           HG1      THR  47   7.436 -14.825   2.425
  383   1HG2  THR  47          1HG2      THR  47   7.691 -15.241   6.431
  384   2HG2  THR  47          2HG2      THR  47   6.941 -16.425   5.359
  385   3HG2  THR  47          3HG2      THR  47   6.036 -14.998   5.869
  386    H    ARG  48           H        ARG  48   9.565 -12.237   4.593
  387    HA   ARG  48           HA       ARG  48   9.857 -11.935   7.417
  388   1HB   ARG  48          1HB       ARG  48  11.860 -12.176   6.135
  389   2HB   ARG  48          2HB       ARG  48  11.421 -10.844   5.075
  390   1HG   ARG  48          1HG       ARG  48  12.698  -9.556   6.347
  391   2HG   ARG  48          2HG       ARG  48  11.459  -9.704   7.595
  392   1HD   ARG  48          1HD       ARG  48  13.331 -10.379   8.739
  393   2HD   ARG  48          2HD       ARG  48  12.702 -11.919   8.163
  394    HE   ARG  48           HE       ARG  48  14.879 -10.468   6.799
  395   1HH1  ARG  48          1HH1      ARG  48  13.415 -13.417   7.990
  396   2HH1  ARG  48          2HH1      ARG  48  14.723 -14.433   7.464
  397   1HH2  ARG  48          1HH2      ARG  48  16.619 -11.814   6.122
  398   2HH2  ARG  48          2HH2      ARG  48  16.554 -13.525   6.437
  399    H    PHE  49           H        PHE  49   8.979  -9.840   4.745
  400    HA   PHE  49           HA       PHE  49   8.961  -7.360   5.938
  401   1HB   PHE  49          1HB       PHE  49   8.195  -8.339   3.516
  402   2HB   PHE  49          2HB       PHE  49   6.631  -7.934   4.214
  403    HD1  PHE  49           HD1      PHE  49   9.931  -6.231   4.489
  404    HD2  PHE  49           HD2      PHE  49   5.900  -6.041   3.152
  405    HE1  PHE  49           HE1      PHE  49  10.263  -3.882   3.840
  406    HE2  PHE  49           HE2      PHE  49   6.222  -3.693   2.495
  407    HZ   PHE  49           HZ       PHE  49   8.405  -2.609   2.841
  408    H    LYS  50           H        LYS  50   6.214  -9.624   5.756
  409    HA   LYS  50           HA       LYS  50   4.455  -8.126   7.346
  410   1HB   LYS  50          1HB       LYS  50   4.575 -11.124   6.972
  411   2HB   LYS  50          2HB       LYS  50   3.209 -10.237   7.630
  412   1HG   LYS  50          1HG       LYS  50   2.558  -9.455   5.594
  413   2HG   LYS  50          2HG       LYS  50   4.203  -9.452   4.950
  414   1HD   LYS  50          1HD       LYS  50   3.094 -11.185   3.810
  415   2HD   LYS  50          2HD       LYS  50   4.082 -11.987   5.031
  416   1HE   LYS  50          1HE       LYS  50   1.625 -11.456   6.268
  417   2HE   LYS  50          2HE       LYS  50   1.228 -12.041   4.653
  418   1HZ   LYS  50          1HZ       LYS  50   1.747 -13.627   6.742
  419   2HZ   LYS  50          2HZ       LYS  50   3.283 -13.546   6.030
  420   3HZ   LYS  50          3HZ       LYS  50   1.954 -14.091   5.124
  421    H    ALA  51           H        ALA  51   6.623 -10.798   8.228
  422    HA   ALA  51           HA       ALA  51   5.895 -10.917  10.929
  423   1HB   ALA  51          1HB       ALA  51   7.112 -12.757  10.680
  424   2HB   ALA  51          2HB       ALA  51   8.555 -11.749  10.788
  425   3HB   ALA  51          3HB       ALA  51   7.863 -12.128   9.213
  426    H    ALA  52           H        ALA  52   8.779  -9.417   9.462
  427    HA   ALA  52           HA       ALA  52   9.859  -8.411  11.819
  428   1HB   ALA  52          1HB       ALA  52  10.342  -8.125   8.984
  429   2HB   ALA  52          2HB       ALA  52  11.477  -8.135  10.336
  430   3HB   ALA  52          3HB       ALA  52  10.676  -6.635   9.867
  431    H    CYS  53           H        CYS  53   7.788  -6.688   9.445
  432    HA   CYS  53           HA       CYS  53   7.848  -4.248  10.824
  433   1HB   CYS  53          1HB       CYS  53   6.009  -3.554   9.432
  434   2HB   CYS  53          2HB       CYS  53   7.139  -4.491   8.465
  435    HG   CYS  53           HG       CYS  53   5.595  -6.596   8.022
  436    H    ALA  54           H        ALA  54   5.730  -7.049  11.165
  437    HA   ALA  54           HA       ALA  54   3.844  -5.807  12.895
  438   1HB   ALA  54          1HB       ALA  54   2.908  -7.901  13.164
  439   2HB   ALA  54          2HB       ALA  54   4.465  -8.726  13.052
  440   3HB   ALA  54          3HB       ALA  54   3.711  -8.063  11.602
  441    H    ARG  55           H        ARG  55   6.958  -7.299  13.354
  442    HA   ARG  55           HA       ARG  55   6.818  -7.550  16.186
  443   1HB   ARG  55          1HB       ARG  55   8.983  -7.671  14.136
  444   2HB   ARG  55          2HB       ARG  55   9.444  -7.450  15.817
  445   1HG   ARG  55          1HG       ARG  55   8.990  -9.572  16.345
  446   2HG   ARG  55          2HG       ARG  55   7.501  -9.589  15.397
  447   1HD   ARG  55          1HD       ARG  55   8.814 -11.111  14.265
  448   2HD   ARG  55          2HD       ARG  55   9.099  -9.630  13.357
  449    HE   ARG  55           HE       ARG  55  11.265  -9.501  14.264
  450   1HH1  ARG  55          1HH1      ARG  55   9.510 -12.351  15.304
  451   2HH1  ARG  55          2HH1      ARG  55  10.932 -13.173  15.880
  452   1HH2  ARG  55          1HH2      ARG  55  13.142 -10.579  15.016
  453   2HH2  ARG  55          2HH2      ARG  55  13.003 -12.165  15.718
  454    H    LYS  56           H        LYS  56   8.093  -5.057  14.004
  455    HA   LYS  56           HA       LYS  56   9.025  -3.418  16.170
  456   1HB   LYS  56          1HB       LYS  56   8.607  -2.361  13.400
  457   2HB   LYS  56          2HB       LYS  56   9.866  -1.962  14.559
  458   1HG   LYS  56          1HG       LYS  56   9.680  -4.671  13.290
  459   2HG   LYS  56          2HG       LYS  56  10.520  -3.327  12.514
  460   1HD   LYS  56          1HD       LYS  56  12.308  -3.624  13.800
  461   2HD   LYS  56          2HD       LYS  56  11.328  -3.576  15.267
  462   1HE   LYS  56          1HE       LYS  56  11.785  -5.738  15.533
  463   2HE   LYS  56          2HE       LYS  56  10.777  -6.054  14.122
  464   1HZ   LYS  56          1HZ       LYS  56  12.908  -5.571  12.802
  465   2HZ   LYS  56          2HZ       LYS  56  12.781  -7.064  13.598
  466   3HZ   LYS  56          3HZ       LYS  56  13.714  -5.819  14.271
  467    H    GLY  57           H        GLY  57   6.215  -3.409  14.020
  468   1HA   GLY  57          1HA       GLY  57   4.104  -2.585  14.968
  469   2HA   GLY  57          2HA       GLY  57   5.036  -1.301  15.727
  470    H    THR  58           H        THR  58   5.699  -2.329  12.483
  471    HA   THR  58           HA       THR  58   4.766   0.274  11.494
  472    HB   THR  58           HB       THR  58   6.701  -1.613  10.141
  473    HG1  THR  58           HG1      THR  58   7.203   0.562  11.930
  474   1HG2  THR  58          1HG2      THR  58   6.796  -0.111   8.505
  475   2HG2  THR  58          2HG2      THR  58   7.047   1.210   9.648
  476   3HG2  THR  58          3HG2      THR  58   5.410   0.691   9.245
  477    H    SER  59           H        SER  59   3.249   0.388   9.893
  478    HA   SER  59           HA       SER  59   1.750  -1.964   9.226
  479   1HB   SER  59          1HB       SER  59   1.318   0.444   7.588
  480   2HB   SER  59          2HB       SER  59   0.163  -0.498   8.533
  481    HG   SER  59           HG       SER  59   0.653   1.735   9.255
  482    H    ILE  60           H        ILE  60   1.750  -3.144   7.384
  483    HA   ILE  60           HA       ILE  60   4.069  -3.659   6.138
  484    HB   ILE  60           HB       ILE  60   2.159  -5.146   6.026
  485   1HG1  ILE  60          1HG1      ILE  60   2.402  -5.256   3.246
  486   2HG1  ILE  60          2HG1      ILE  60   3.905  -4.525   3.800
  487   1HG2  ILE  60          1HG2      ILE  60   0.978  -3.731   3.703
  488   2HG2  ILE  60          2HG2      ILE  60   0.626  -3.120   5.319
  489   3HG2  ILE  60          3HG2      ILE  60   0.218  -4.784   4.898
  490   1HD1  ILE  60          1HD1      ILE  60   4.096  -6.450   5.415
  491   2HD1  ILE  60          2HD1      ILE  60   4.282  -6.843   3.706
  492   3HD1  ILE  60          3HD1      ILE  60   2.767  -7.203   4.534
  493    H    THR  61           H        THR  61   1.625  -1.459   4.762
  494    HA   THR  61           HA       THR  61   3.170  -0.952   2.429
  495    HB   THR  61           HB       THR  61   1.205   1.099   3.188
  496    HG1  THR  61           HG1      THR  61  -0.442  -0.709   2.549
  497   1HG2  THR  61          1HG2      THR  61   2.288  -0.047   0.852
  498   2HG2  THR  61          2HG2      THR  61   1.092   1.245   0.964
  499   3HG2  THR  61          3HG2      THR  61   0.569  -0.435   0.851
  500    H    ASP  62           H        ASP  62   2.845   0.542   5.566
  501    HA   ASP  62           HA       ASP  62   4.235   2.948   4.987
  502   1HB   ASP  62          1HB       ASP  62   2.724   2.425   6.993
  503   2HB   ASP  62          2HB       ASP  62   4.135   1.637   7.693
  504    H    VAL  63           H        VAL  63   5.263  -0.298   5.811
  505    HA   VAL  63           HA       VAL  63   7.927   0.285   6.565
  506    HB   VAL  63           HB       VAL  63   7.324  -2.179   4.978
  507   1HG1  VAL  63          1HG1      VAL  63   9.584  -1.409   6.066
  508   2HG1  VAL  63          2HG1      VAL  63   9.090  -3.100   6.104
  509   3HG1  VAL  63          3HG1      VAL  63   8.856  -2.082   7.524
  510   1HG2  VAL  63          1HG2      VAL  63   6.876  -2.720   7.723
  511   2HG2  VAL  63          2HG2      VAL  63   5.769  -2.921   6.367
  512   3HG2  VAL  63          3HG2      VAL  63   5.817  -1.393   7.245
  513    H    VAL  64           H        VAL  64   6.429  -0.406   3.429
  514    HA   VAL  64           HA       VAL  64   8.749  -0.291   1.861
  515    HB   VAL  64           HB       VAL  64   6.186   0.816   0.787
  516   1HG1  VAL  64          1HG1      VAL  64   8.651  -0.193  -0.246
  517   2HG1  VAL  64          2HG1      VAL  64   7.301   0.546  -1.112
  518   3HG1  VAL  64          3HG1      VAL  64   7.322  -1.195  -0.830
  519   1HG2  VAL  64          1HG2      VAL  64   5.611  -1.153   2.237
  520   2HG2  VAL  64          2HG2      VAL  64   6.630  -2.139   1.187
  521   3HG2  VAL  64          3HG2      VAL  64   5.199  -1.342   0.531
  522    H    ASN  65           H        ASN  65   6.502   2.223   2.911
  523    HA   ASN  65           HA       ASN  65   7.750   4.378   1.572
  524   1HB   ASN  65          1HB       ASN  65   5.509   4.070   3.174
  525   2HB   ASN  65          2HB       ASN  65   6.564   5.102   4.133
  526   1HD2  ASN  65          1HD2      ASN  65   4.107   5.212   2.072
  527   2HD2  ASN  65          2HD2      ASN  65   4.403   6.729   1.297
  528    H    GLN  66           H        GLN  66   8.403   2.765   4.611
  529    HA   GLN  66           HA       GLN  66  10.194   4.718   5.656
  530   1HB   GLN  66          1HB       GLN  66   8.979   2.459   6.637
  531   2HB   GLN  66          2HB       GLN  66  10.660   1.955   6.506
  532   1HG   GLN  66          1HG       GLN  66  10.707   2.817   8.596
  533   2HG   GLN  66          2HG       GLN  66  11.059   4.289   7.689
  534   1HE2  GLN  66          1HE2      GLN  66   8.955   2.758   9.853
  535   2HE2  GLN  66          2HE2      GLN  66   7.746   4.001   9.939
  536    H    LEU  67           H        LEU  67  10.714   1.671   3.847
  537    HA   LEU  67           HA       LEU  67  13.553   1.887   3.934
  538   1HB   LEU  67          1HB       LEU  67  12.850   0.506   1.565
  539   2HB   LEU  67          2HB       LEU  67  13.470  -0.154   3.063
  540    HG   LEU  67           HG       LEU  67  10.597   0.370   3.141
  541   1HD1  LEU  67          1HD1      LEU  67  11.785  -1.362   1.010
  542   2HD1  LEU  67          2HD1      LEU  67  10.426  -0.243   0.912
  543   3HD1  LEU  67          3HD1      LEU  67  10.239  -1.783   1.748
  544   1HD2  LEU  67          1HD2      LEU  67  12.161  -2.169   3.564
  545   2HD2  LEU  67          2HD2      LEU  67  10.551  -1.780   4.171
  546   3HD2  LEU  67          3HD2      LEU  67  11.960  -0.923   4.797
  547    H    VAL  68           H        VAL  68  11.082   2.916   1.650
  548    HA   VAL  68           HA       VAL  68  12.773   3.954  -0.353
  549    HB   VAL  68           HB       VAL  68   9.966   4.675   0.488
  550   1HG1  VAL  68          1HG1      VAL  68  10.890   6.703  -0.416
  551   2HG1  VAL  68          2HG1      VAL  68   9.804   5.986  -1.607
  552   3HG1  VAL  68          3HG1      VAL  68  11.552   5.832  -1.802
  553   1HG2  VAL  68          1HG2      VAL  68   9.786   3.787  -2.037
  554   2HG2  VAL  68          2HG2      VAL  68   9.693   2.733  -0.627
  555   3HG2  VAL  68          3HG2      VAL  68  11.212   2.896  -1.507
  556    H    ASP  69           H        ASP  69  11.390   5.358   2.568
  557    HA   ASP  69           HA       ASP  69  12.363   7.974   2.311
  558   1HB   ASP  69          1HB       ASP  69  11.073   6.392   4.316
  559   2HB   ASP  69          2HB       ASP  69  12.443   7.212   5.056
  560    H    ASN  70           H        ASN  70  13.728   5.185   4.021
  561    HA   ASN  70           HA       ASN  70  16.039   6.449   4.948
  562   1HB   ASN  70          1HB       ASN  70  15.192   3.621   4.554
  563   2HB   ASN  70          2HB       ASN  70  16.902   3.929   4.835
  564   1HD2  ASN  70          1HD2      ASN  70  13.701   4.074   6.182
  565   2HD2  ASN  70          2HD2      ASN  70  14.186   4.308   7.832
  566    H    TRP  71           H        TRP  71  15.686   4.300   2.136
  567    HA   TRP  71           HA       TRP  71  18.309   4.488   1.177
  568   1HB   TRP  71          1HB       TRP  71  16.321   2.947   0.507
  569   2HB   TRP  71          2HB       TRP  71  15.933   4.219  -0.638
  570    HD1  TRP  71           HD1      TRP  71  18.739   1.653   0.110
  571    HE1  TRP  71           HE1      TRP  71  20.013   1.229  -2.086
  572    HE3  TRP  71           HE3      TRP  71  16.411   5.105  -2.854
  573    HZ2  TRP  71           HZ2      TRP  71  20.008   2.215  -4.735
  574    HZ3  TRP  71           HZ3      TRP  71  17.087   5.288  -5.208
  575    HH2  TRP  71           HH2      TRP  71  18.848   3.866  -6.131
  576    H    LEU  72           H        LEU  72  15.474   6.503   0.501
  577    HA   LEU  72           HA       LEU  72  16.757   8.031  -1.522
  578   1HB   LEU  72          1HB       LEU  72  14.161   7.924  -0.249
  579   2HB   LEU  72          2HB       LEU  72  14.677   9.583  -0.494
  580    HG   LEU  72           HG       LEU  72  14.807   9.301  -2.848
  581   1HD1  LEU  72          1HD1      LEU  72  13.941   6.668  -3.338
  582   2HD1  LEU  72          2HD1      LEU  72  15.275   6.559  -2.187
  583   3HD1  LEU  72          3HD1      LEU  72  15.503   7.388  -3.729
  584   1HD2  LEU  72          1HD2      LEU  72  12.555   8.699  -3.427
  585   2HD2  LEU  72          2HD2      LEU  72  12.542   9.538  -1.876
  586   3HD2  LEU  72          3HD2      LEU  72  12.374   7.782  -1.930
  587    H    LYS  73           H        LYS  73  15.935   8.793   1.873
  588    HA   LYS  73           HA       LYS  73  17.043  11.388   1.734
  589   1HB   LYS  73          1HB       LYS  73  16.412   9.672   4.139
  590   2HB   LYS  73          2HB       LYS  73  16.832  11.378   4.217
  591   1HG   LYS  73          1HG       LYS  73  14.842  11.940   2.920
  592   2HG   LYS  73          2HG       LYS  73  14.434  10.226   2.800
  593   1HD   LYS  73          1HD       LYS  73  14.579  11.876   5.325
  594   2HD   LYS  73          2HD       LYS  73  13.120  11.255   4.550
  595   1HE   LYS  73          1HE       LYS  73  13.344   9.257   5.508
  596   2HE   LYS  73          2HE       LYS  73  15.052   9.160   5.081
  597   1HZ   LYS  73          1HZ       LYS  73  14.586   9.139   7.500
  598   2HZ   LYS  73          2HZ       LYS  73  14.011  10.730   7.375
  599   3HZ   LYS  73          3HZ       LYS  73  15.633  10.380   7.018
  600    H    GLU  74           H        GLU  74  18.445   8.292   2.539
  601    HA   GLU  74           HA       GLU  74  20.793   9.543   3.687
  602   1HB   GLU  74          1HB       GLU  74  19.991   6.668   3.290
  603   2HB   GLU  74          2HB       GLU  74  21.577   7.130   3.892
  604   1HG   GLU  74          1HG       GLU  74  18.939   7.788   5.181
  605   2HG   GLU  74          2HG       GLU  74  20.077   6.549   5.706
  606    H    ASN  75           H        ASN  75  20.201   7.325   0.947
  607    HA   ASN  75           HA       ASN  75  22.915   7.775   0.041
  608   1HB   ASN  75          1HB       ASN  75  22.692   5.649  -0.582
  609   2HB   ASN  75          2HB       ASN  75  20.984   5.679  -0.191
  610   1HD2  ASN  75          1HD2      ASN  75  19.485   6.055  -1.814
  611   2HD2  ASN  75          2HD2      ASN  75  19.894   5.948  -3.490
  612    H    GLU  76           H        GLU  76  19.680   8.669  -0.936
  613    HA   GLU  76           HA       GLU  76  20.751   9.865  -3.390
  614   1HB   GLU  76          1HB       GLU  76  18.485   8.321  -2.926
  615   2HB   GLU  76          2HB       GLU  76  17.853   9.954  -3.064
  616   1HG   GLU  76          1HG       GLU  76  17.924   8.627  -5.190
  617   2HG   GLU  76          2HG       GLU  76  18.697  10.209  -5.247
  618   1H    MET   1          1H        MET   1 -41.339 -69.554 -15.265
  619   2H    MET   1          2H        MET   1 -39.719 -69.419 -15.755
  620   3H    MET   1          3H        MET   1 -40.106 -69.478 -14.102
  621    HA   MET   1           HA       MET   1 -41.239 -71.741 -15.119
  622   1HB   MET   1          1HB       MET   1 -39.148 -70.846 -16.847
  623   2HB   MET   1          2HB       MET   1 -38.584 -72.288 -16.011
  624   1HG   MET   1          1HG       MET   1 -41.128 -72.056 -17.605
  625   2HG   MET   1          2HG       MET   1 -39.638 -72.840 -18.129
  626   1HE   MET   1          1HE       MET   1 -39.509 -74.969 -18.337
  627   2HE   MET   1          2HE       MET   1 -40.224 -76.282 -17.397
  628   3HE   MET   1          3HE       MET   1 -38.812 -75.424 -16.784
  629    H    SER   2           H        SER   2 -39.739 -73.724 -14.418
  630    HA   SER   2           HA       SER   2 -39.338 -73.469 -11.668
  631   1HB   SER   2          1HB       SER   2 -37.824 -75.625 -12.944
  632   2HB   SER   2          2HB       SER   2 -39.134 -75.711 -11.765
  633    HG   SER   2           HG       SER   2 -40.571 -75.870 -13.328
  634    H    LEU   3           H        LEU   3 -37.506 -73.439 -10.390
  635    HA   LEU   3           HA       LEU   3 -35.464 -72.778  -9.689
  636   1HB   LEU   3          1HB       LEU   3 -34.920 -74.140 -12.215
  637   2HB   LEU   3          2HB       LEU   3 -33.716 -72.931 -11.819
  638    HG   LEU   3           HG       LEU   3 -32.837 -74.874 -10.890
  639   1HD1  LEU   3          1HD1      LEU   3 -34.317 -74.112  -8.443
  640   2HD1  LEU   3          2HD1      LEU   3 -33.366 -72.863  -9.246
  641   3HD1  LEU   3          3HD1      LEU   3 -32.590 -74.349  -8.698
  642   1HD2  LEU   3          1HD2      LEU   3 -35.632 -75.632 -10.642
  643   2HD2  LEU   3          2HD2      LEU   3 -34.668 -76.088  -9.236
  644   3HD2  LEU   3          3HD2      LEU   3 -34.197 -76.639 -10.845
  645    H    GLU   4           H        GLU   4 -37.344 -70.952 -10.888
  646    HA   GLU   4           HA       GLU   4 -37.554 -68.791 -11.561
  647   1HB   GLU   4          1HB       GLU   4 -35.309 -68.946  -9.745
  648   2HB   GLU   4          2HB       GLU   4 -35.104 -67.620 -10.880
  649   1HG   GLU   4          1HG       GLU   4 -37.279 -68.057  -8.874
  650   2HG   GLU   4          2HG       GLU   4 -36.200 -66.676  -9.056
  651    H    LYS   5           H        LYS   5 -36.956 -70.270 -13.701
  652    HA   LYS   5           HA       LYS   5 -34.819 -68.848 -15.125
  653   1HB   LYS   5          1HB       LYS   5 -35.903 -71.558 -15.242
  654   2HB   LYS   5          2HB       LYS   5 -35.751 -70.812 -16.827
  655   1HG   LYS   5          1HG       LYS   5 -33.626 -71.430 -16.801
  656   2HG   LYS   5          2HG       LYS   5 -33.365 -70.208 -15.554
  657   1HD   LYS   5          1HD       LYS   5 -32.642 -71.943 -14.321
  658   2HD   LYS   5          2HD       LYS   5 -34.361 -72.266 -14.086
  659   1HE   LYS   5          1HE       LYS   5 -33.661 -74.318 -14.797
  660   2HE   LYS   5          2HE       LYS   5 -34.079 -73.583 -16.343
  661   1HZ   LYS   5          1HZ       LYS   5 -31.716 -74.732 -15.774
  662   2HZ   LYS   5          2HZ       LYS   5 -31.364 -73.097 -15.500
  663   3HZ   LYS   5          3HZ       LYS   5 -31.959 -73.596 -17.007
  664    H    ALA   6           H        ALA   6 -35.244 -67.534 -16.807
  665    HA   ALA   6           HA       ALA   6 -37.754 -67.580 -18.214
  666   1HB   ALA   6          1HB       ALA   6 -37.762 -64.927 -17.398
  667   2HB   ALA   6          2HB       ALA   6 -37.439 -65.838 -15.921
  668   3HB   ALA   6          3HB       ALA   6 -38.874 -66.193 -16.882
  669    H    HIS   7           H        HIS   7 -36.441 -64.446 -17.920
  670    HA   HIS   7           HA       HIS   7 -34.400 -64.850 -19.927
  671   1HB   HIS   7          1HB       HIS   7 -35.278 -63.238 -21.532
  672   2HB   HIS   7          2HB       HIS   7 -36.408 -64.567 -21.322
  673    HD1  HIS   7           HD1      HIS   7 -36.180 -60.938 -21.289
  674    HD2  HIS   7           HD2      HIS   7 -38.720 -63.814 -19.678
  675    HE1  HIS   7           HE1      HIS   7 -38.286 -59.710 -20.659
  676    HE2  HIS   7           HE2      HIS   7 -39.871 -61.501 -19.858
  677    H    THR   8           H        THR   8 -32.723 -63.850 -19.100
  678    HA   THR   8           HA       THR   8 -32.870 -61.964 -17.040
  679    HB   THR   8           HB       THR   8 -30.383 -61.557 -18.209
  680    HG1  THR   8           HG1      THR   8 -30.255 -64.219 -18.341
  681   1HG2  THR   8          1HG2      THR   8 -30.559 -61.936 -15.887
  682   2HG2  THR   8          2HG2      THR   8 -29.654 -63.317 -16.509
  683   3HG2  THR   8          3HG2      THR   8 -31.367 -63.487 -16.120
  684    H    SER   9           H        SER   9 -33.273 -59.860 -17.055
  685    HA   SER   9           HA       SER   9 -32.841 -58.354 -19.551
  686   1HB   SER   9          1HB       SER   9 -34.997 -57.410 -17.766
  687   2HB   SER   9          2HB       SER   9 -34.953 -57.509 -19.526
  688    HG   SER   9           HG       SER   9 -34.962 -59.983 -18.722
  689    H    VAL  10           H        VAL  10 -30.885 -58.517 -17.683
  690    HA   VAL  10           HA       VAL  10 -31.091 -56.134 -15.988
  691    HB   VAL  10           HB       VAL  10 -28.636 -57.077 -15.409
  692   1HG1  VAL  10          1HG1      VAL  10 -30.382 -58.639 -13.845
  693   2HG1  VAL  10          2HG1      VAL  10 -31.242 -57.152 -14.243
  694   3HG1  VAL  10          3HG1      VAL  10 -29.669 -57.076 -13.448
  695   1HG2  VAL  10          1HG2      VAL  10 -30.245 -59.518 -16.158
  696   2HG2  VAL  10          2HG2      VAL  10 -28.707 -59.522 -15.295
  697   3HG2  VAL  10          3HG2      VAL  10 -28.782 -58.949 -16.961
  698    H    LYS  11           H        LYS  11 -30.599 -56.390 -19.018
  699    HA   LYS  11           HA       LYS  11 -27.985 -55.418 -19.509
  700   1HB   LYS  11          1HB       LYS  11 -29.346 -56.535 -21.234
  701   2HB   LYS  11          2HB       LYS  11 -30.475 -55.187 -21.212
  702   1HG   LYS  11          1HG       LYS  11 -29.265 -54.445 -22.941
  703   2HG   LYS  11          2HG       LYS  11 -28.146 -53.893 -21.695
  704   1HD   LYS  11          1HD       LYS  11 -26.949 -56.063 -21.889
  705   2HD   LYS  11          2HD       LYS  11 -28.004 -56.476 -23.242
  706   1HE   LYS  11          1HE       LYS  11 -26.607 -55.414 -24.605
  707   2HE   LYS  11          2HE       LYS  11 -26.999 -53.908 -23.777
  708   1HZ   LYS  11          1HZ       LYS  11 -24.887 -55.782 -22.858
  709   2HZ   LYS  11          2HZ       LYS  11 -25.186 -54.211 -22.297
  710   3HZ   LYS  11          3HZ       LYS  11 -24.590 -54.448 -23.862
  711    H    LYS  12           H        LYS  12 -27.270 -53.552 -18.764
  712    HA   LYS  12           HA       LYS  12 -29.104 -51.284 -18.499
  713   1HB   LYS  12          1HB       LYS  12 -27.025 -52.229 -16.909
  714   2HB   LYS  12          2HB       LYS  12 -26.346 -50.814 -17.698
  715   1HG   LYS  12          1HG       LYS  12 -29.044 -50.554 -16.500
  716   2HG   LYS  12          2HG       LYS  12 -27.660 -50.661 -15.411
  717   1HD   LYS  12          1HD       LYS  12 -26.597 -48.807 -16.696
  718   2HD   LYS  12          2HD       LYS  12 -28.099 -48.647 -17.608
  719   1HE   LYS  12          1HE       LYS  12 -28.612 -48.675 -14.770
  720   2HE   LYS  12          2HE       LYS  12 -27.447 -47.418 -15.186
  721   1HZ   LYS  12          1HZ       LYS  12 -29.149 -46.893 -17.052
  722   2HZ   LYS  12          2HZ       LYS  12 -29.432 -46.338 -15.474
  723   3HZ   LYS  12          3HZ       LYS  12 -30.241 -47.714 -16.049
  724    H    MET  13           H        MET  13 -29.168 -49.759 -20.015
  725    HA   MET  13           HA       MET  13 -27.619 -49.909 -22.353
  726   1HB   MET  13          1HB       MET  13 -29.862 -48.879 -22.248
  727   2HB   MET  13          2HB       MET  13 -29.198 -47.556 -21.300
  728   1HG   MET  13          1HG       MET  13 -28.166 -46.596 -23.091
  729   2HG   MET  13          2HG       MET  13 -27.967 -48.129 -23.938
  730   1HE   MET  13          1HE       MET  13 -31.642 -45.639 -23.358
  731   2HE   MET  13          2HE       MET  13 -30.744 -46.553 -22.143
  732   3HE   MET  13          3HE       MET  13 -32.070 -47.316 -23.018
  733    H    THR  14           H        THR  14 -25.768 -48.968 -22.994
  734    HA   THR  14           HA       THR  14 -23.972 -47.888 -21.116
  735    HB   THR  14           HB       THR  14 -22.956 -47.078 -23.500
  736    HG1  THR  14           HG1      THR  14 -23.508 -48.752 -25.005
  737   1HG2  THR  14          1HG2      THR  14 -21.882 -48.536 -21.822
  738   2HG2  THR  14          2HG2      THR  14 -21.652 -49.125 -23.467
  739   3HG2  THR  14          3HG2      THR  14 -22.842 -49.894 -22.415
  740    H    PHE  15           H        PHE  15 -23.542 -45.857 -20.524
  741    HA   PHE  15           HA       PHE  15 -25.563 -43.942 -20.871
  742   1HB   PHE  15          1HB       PHE  15 -22.938 -44.038 -19.475
  743   2HB   PHE  15          2HB       PHE  15 -23.671 -42.458 -19.733
  744    HD1  PHE  15           HD1      PHE  15 -24.099 -41.950 -17.458
  745    HD2  PHE  15           HD2      PHE  15 -25.585 -45.552 -19.167
  746    HE1  PHE  15           HE1      PHE  15 -25.538 -42.289 -15.491
  747    HE2  PHE  15           HE2      PHE  15 -27.024 -45.897 -17.207
  748    HZ   PHE  15           HZ       PHE  15 -27.001 -44.266 -15.361
  749    H    GLY  16           H        GLY  16 -22.485 -44.371 -22.472
  750   1HA   GLY  16          1HA       GLY  16 -21.909 -43.467 -24.547
  751   2HA   GLY  16          2HA       GLY  16 -23.263 -42.358 -24.419
  752    H    GLU  17           H        GLU  17 -22.907 -40.880 -22.303
  753    HA   GLU  17           HA       GLU  17 -20.527 -39.363 -22.927
  754   1HB   GLU  17          1HB       GLU  17 -23.059 -38.686 -22.097
  755   2HB   GLU  17          2HB       GLU  17 -22.118 -38.488 -20.624
  756   1HG   GLU  17          1HG       GLU  17 -21.058 -37.304 -23.126
  757   2HG   GLU  17          2HG       GLU  17 -22.443 -36.531 -22.357
  758    H    ASN  18           H        ASN  18 -21.929 -40.331 -19.802
  759    HA   ASN  18           HA       ASN  18 -21.001 -41.014 -17.843
  760   1HB   ASN  18          1HB       ASN  18 -19.481 -42.385 -19.924
  761   2HB   ASN  18          2HB       ASN  18 -18.562 -42.178 -18.437
  762   1HD2  ASN  18          1HD2      ASN  18 -20.269 -44.341 -19.982
  763   2HD2  ASN  18          2HD2      ASN  18 -21.054 -45.164 -18.670
  764    H    ARG  19           H        ARG  19 -20.697 -38.502 -17.853
  765    HA   ARG  19           HA       ARG  19 -18.059 -37.481 -18.023
  766   1HB   ARG  19          1HB       ARG  19 -19.312 -35.635 -18.078
  767   2HB   ARG  19          2HB       ARG  19 -20.698 -36.482 -17.421
  768   1HG   ARG  19          1HG       ARG  19 -19.009 -36.071 -15.243
  769   2HG   ARG  19          2HG       ARG  19 -18.954 -34.569 -16.168
  770   1HD   ARG  19          1HD       ARG  19 -21.275 -34.266 -16.020
  771   2HD   ARG  19          2HD       ARG  19 -21.546 -35.933 -15.519
  772    HE   ARG  19           HE       ARG  19 -20.769 -33.701 -13.848
  773   1HH1  ARG  19          1HH1      ARG  19 -21.056 -37.183 -14.126
  774   2HH1  ARG  19          2HH1      ARG  19 -21.041 -37.450 -12.406
  775   1HH2  ARG  19          1HH2      ARG  19 -20.754 -34.046 -11.582
  776   2HH2  ARG  19          2HH2      ARG  19 -20.885 -35.670 -10.968
  777    H    ASP  20           H        ASP  20 -16.518 -37.158 -16.519
  778    HA   ASP  20           HA       ASP  20 -17.020 -38.199 -13.809
  779   1HB   ASP  20          1HB       ASP  20 -15.554 -39.727 -15.093
  780   2HB   ASP  20          2HB       ASP  20 -14.436 -38.396 -15.375
  781    H    LEU  21           H        LEU  21 -17.086 -36.506 -12.498
  782    HA   LEU  21           HA       LEU  21 -15.796 -34.028 -13.178
  783   1HB   LEU  21          1HB       LEU  21 -18.009 -34.709 -11.716
  784   2HB   LEU  21          2HB       LEU  21 -16.859 -34.295 -10.462
  785    HG   LEU  21           HG       LEU  21 -18.361 -32.423 -11.224
  786   1HD1  LEU  21          1HD1      LEU  21 -15.738 -31.345 -11.843
  787   2HD1  LEU  21          2HD1      LEU  21 -15.723 -32.394 -10.425
  788   3HD1  LEU  21          3HD1      LEU  21 -16.811 -31.005 -10.487
  789   1HD2  LEU  21          1HD2      LEU  21 -18.303 -31.561 -13.318
  790   2HD2  LEU  21          2HD2      LEU  21 -17.869 -33.222 -13.721
  791   3HD2  LEU  21          3HD2      LEU  21 -16.611 -31.993 -13.572
  792    H    GLU  22           H        GLU  22 -13.695 -33.787 -12.910
  793    HA   GLU  22           HA       GLU  22 -12.408 -34.975 -10.548
  794   1HB   GLU  22          1HB       GLU  22 -10.920 -33.761 -12.862
  795   2HB   GLU  22          2HB       GLU  22 -10.365 -34.963 -11.708
  796   1HG   GLU  22          1HG       GLU  22 -10.993 -36.623 -13.029
  797   2HG   GLU  22          2HG       GLU  22 -12.619 -35.961 -13.186
  798    H    ARG  23           H        ARG  23 -11.252 -33.694  -9.140
  799    HA   ARG  23           HA       ARG  23 -11.406 -30.792  -9.603
  800   1HB   ARG  23          1HB       ARG  23 -12.926 -32.031  -7.756
  801   2HB   ARG  23          2HB       ARG  23 -11.473 -31.758  -6.802
  802   1HG   ARG  23          1HG       ARG  23 -12.960 -29.928  -6.451
  803   2HG   ARG  23          2HG       ARG  23 -11.599 -29.352  -7.413
  804   1HD   ARG  23          1HD       ARG  23 -14.007 -30.342  -8.848
  805   2HD   ARG  23          2HD       ARG  23 -14.113 -28.779  -8.040
  806    HE   ARG  23           HE       ARG  23 -12.546 -29.442 -10.389
  807   1HH1  ARG  23          1HH1      ARG  23 -13.147 -27.132  -7.821
  808   2HH1  ARG  23          2HH1      ARG  23 -12.382 -25.810  -8.660
  809   1HH2  ARG  23          1HH2      ARG  23 -11.540 -27.720 -11.488
  810   2HH2  ARG  23          2HH2      ARG  23 -11.490 -26.141 -10.761
  811    H    VAL  24           H        VAL  24  -9.341 -30.482 -10.216
  812    HA   VAL  24           HA       VAL  24  -7.194 -31.560  -8.541
  813    HB   VAL  24           HB       VAL  24  -6.852 -29.989 -11.096
  814   1HG1  VAL  24          1HG1      VAL  24  -4.790 -31.652 -11.057
  815   2HG1  VAL  24          2HG1      VAL  24  -5.103 -31.603  -9.321
  816   3HG1  VAL  24          3HG1      VAL  24  -4.759 -30.111 -10.198
  817   1HG2  VAL  24          1HG2      VAL  24  -6.771 -32.975 -11.044
  818   2HG2  VAL  24          2HG2      VAL  24  -7.048 -31.882 -12.400
  819   3HG2  VAL  24          3HG2      VAL  24  -8.319 -32.146 -11.208
  820    H    VAL  25           H        VAL  25  -7.695 -30.165  -6.766
  821    HA   VAL  25           HA       VAL  25  -7.051 -27.330  -7.208
  822    HB   VAL  25           HB       VAL  25  -7.904 -27.719  -4.535
  823   1HG1  VAL  25          1HG1      VAL  25  -8.506 -25.683  -5.261
  824   2HG1  VAL  25          2HG1      VAL  25  -9.999 -26.494  -5.732
  825   3HG1  VAL  25          3HG1      VAL  25  -8.728 -26.224  -6.925
  826   1HG2  VAL  25          1HG2      VAL  25  -8.970 -29.777  -5.055
  827   2HG2  VAL  25          2HG2      VAL  25  -9.664 -29.121  -6.537
  828   3HG2  VAL  25          3HG2      VAL  25 -10.234 -28.552  -4.968
  829    H    THR  26           H        THR  26  -5.279 -29.761  -6.883
  830    HA   THR  26           HA       THR  26  -3.931 -29.453  -4.388
  831    HB   THR  26           HB       THR  26  -2.367 -30.658  -6.546
  832    HG1  THR  26           HG1      THR  26  -5.022 -31.570  -5.992
  833   1HG2  THR  26          1HG2      THR  26  -3.518 -31.934  -4.068
  834   2HG2  THR  26          2HG2      THR  26  -2.070 -30.928  -4.045
  835   3HG2  THR  26          3HG2      THR  26  -2.090 -32.423  -4.978
  836    H    ALA  27           H        ALA  27  -3.048 -27.511  -4.003
  837    HA   ALA  27           HA       ALA  27  -0.899 -26.627  -5.772
  838   1HB   ALA  27          1HB       ALA  27  -2.151 -24.992  -6.636
  839   2HB   ALA  27          2HB       ALA  27  -2.041 -24.224  -5.052
  840   3HB   ALA  27          3HB       ALA  27  -3.434 -25.232  -5.450
  841    HA   PRO  28           HA       PRO  28   0.470 -26.315  -1.482
  842   1HB   PRO  28          1HB       PRO  28   3.016 -27.010  -1.904
  843   2HB   PRO  28          2HB       PRO  28   1.721 -28.213  -1.965
  844   1HG   PRO  28          1HG       PRO  28   3.161 -26.860  -4.208
  845   2HG   PRO  28          2HG       PRO  28   2.647 -28.550  -4.061
  846   1HD   PRO  28          1HD       PRO  28   1.280 -26.589  -5.462
  847   2HD   PRO  28          2HD       PRO  28   0.561 -28.095  -4.864
  848    H    VAL  29           H        VAL  29   2.865 -25.368  -0.779
  849    HA   VAL  29           HA       VAL  29   2.730 -22.588  -1.427
  850    HB   VAL  29           HB       VAL  29   3.366 -23.374   0.820
  851   1HG1  VAL  29          1HG1      VAL  29   6.099 -23.960   0.536
  852   2HG1  VAL  29          2HG1      VAL  29   5.250 -24.962  -0.644
  853   3HG1  VAL  29          3HG1      VAL  29   4.805 -25.041   1.061
  854   1HG2  VAL  29          1HG2      VAL  29   4.518 -21.497   1.182
  855   2HG2  VAL  29          2HG2      VAL  29   4.421 -21.246  -0.561
  856   3HG2  VAL  29          3HG2      VAL  29   5.849 -22.008   0.140
  857    H    SER  30           H        SER  30   4.215 -21.340  -2.559
  858    HA   SER  30           HA       SER  30   5.524 -22.683  -4.732
  859   1HB   SER  30          1HB       SER  30   6.125 -19.847  -4.463
  860   2HB   SER  30          2HB       SER  30   5.269 -20.688  -5.757
  861    HG   SER  30           HG       SER  30   3.380 -20.403  -4.733
  862    H    SER  31           H        SER  31   7.797 -21.810  -5.349
  863    HA   SER  31           HA       SER  31   9.492 -21.893  -2.942
  864   1HB   SER  31          1HB       SER  31  10.727 -22.598  -5.524
  865   2HB   SER  31          2HB       SER  31  10.873 -23.384  -3.952
  866    HG   SER  31           HG       SER  31   8.639 -24.152  -4.385
  867    H    GLY  32           H        GLY  32   9.216 -19.573  -2.844
  868   1HA   GLY  32          1HA       GLY  32  10.242 -17.510  -3.066
  869   2HA   GLY  32          2HA       GLY  32  11.299 -18.202  -4.288
  870    H    LYS  33           H        LYS  33   7.897 -17.288  -3.826
  871    HA   LYS  33           HA       LYS  33   7.640 -16.727  -6.668
  872   1HB   LYS  33          1HB       LYS  33   5.875 -17.655  -4.747
  873   2HB   LYS  33          2HB       LYS  33   5.392 -15.977  -4.951
  874   1HG   LYS  33          1HG       LYS  33   5.689 -16.834  -7.537
  875   2HG   LYS  33          2HG       LYS  33   5.037 -18.259  -6.722
  876   1HD   LYS  33          1HD       LYS  33   3.570 -16.090  -5.741
  877   2HD   LYS  33          2HD       LYS  33   3.717 -15.813  -7.478
  878   1HE   LYS  33          1HE       LYS  33   2.655 -17.826  -8.006
  879   2HE   LYS  33          2HE       LYS  33   2.916 -18.493  -6.394
  880   1HZ   LYS  33          1HZ       LYS  33   0.655 -17.216  -7.324
  881   2HZ   LYS  33          2HZ       LYS  33   1.374 -16.111  -6.256
  882   3HZ   LYS  33          3HZ       LYS  33   0.981 -17.675  -5.727
  883    H    ILE  34           H        ILE  34   5.820 -14.590  -6.508
  884    HA   ILE  34           HA       ILE  34   7.364 -12.429  -5.257
  885    HB   ILE  34           HB       ILE  34   6.186 -11.475  -7.704
  886   1HG1  ILE  34          1HG1      ILE  34   8.448 -13.084  -8.569
  887   2HG1  ILE  34          2HG1      ILE  34   7.119 -14.091  -8.001
  888   1HG2  ILE  34          1HG2      ILE  34   9.028 -11.647  -6.716
  889   2HG2  ILE  34          2HG2      ILE  34   7.902 -10.314  -6.459
  890   3HG2  ILE  34          3HG2      ILE  34   8.483 -10.677  -8.085
  891   1HD1  ILE  34          1HD1      ILE  34   7.414 -12.739 -10.481
  892   2HD1  ILE  34          2HD1      ILE  34   6.003 -12.094  -9.641
  893   3HD1  ILE  34          3HD1      ILE  34   6.129 -13.824  -9.953
  894    H    LYS  35           H        LYS  35   6.141 -10.480  -4.932
  895    HA   LYS  35           HA       LYS  35   3.226 -10.886  -4.796
  896   1HB   LYS  35          1HB       LYS  35   5.114  -9.856  -2.671
  897   2HB   LYS  35          2HB       LYS  35   3.367  -9.661  -2.584
  898   1HG   LYS  35          1HG       LYS  35   4.506 -12.386  -2.968
  899   2HG   LYS  35          2HG       LYS  35   4.561 -11.641  -1.368
  900   1HD   LYS  35          1HD       LYS  35   2.402 -12.062  -1.029
  901   2HD   LYS  35          2HD       LYS  35   1.955 -11.320  -2.566
  902   1HE   LYS  35          1HE       LYS  35   1.365 -13.372  -3.209
  903   2HE   LYS  35          2HE       LYS  35   3.093 -13.702  -3.335
  904   1HZ   LYS  35          1HZ       LYS  35   3.115 -14.673  -1.205
  905   2HZ   LYS  35          2HZ       LYS  35   1.755 -15.323  -1.989
  906   3HZ   LYS  35          3HZ       LYS  35   1.563 -14.098  -0.829
  907    H    ARG  36           H        ARG  36   1.960  -9.002  -4.998
  908    HA   ARG  36           HA       ARG  36   3.435  -6.702  -6.108
  909   1HB   ARG  36          1HB       ARG  36   0.539  -7.448  -6.552
  910   2HB   ARG  36          2HB       ARG  36   1.423  -6.160  -7.355
  911   1HG   ARG  36          1HG       ARG  36   1.701  -7.654  -8.988
  912   2HG   ARG  36          2HG       ARG  36   2.964  -8.317  -7.950
  913   1HD   ARG  36          1HD       ARG  36   1.793 -10.228  -8.220
  914   2HD   ARG  36          2HD       ARG  36   0.830  -9.557  -6.904
  915    HE   ARG  36           HE       ARG  36  -0.457  -8.564  -9.004
  916   1HH1  ARG  36          1HH1      ARG  36   0.742 -11.793  -8.390
  917   2HH1  ARG  36          2HH1      ARG  36  -0.464 -12.567  -9.381
  918   1HH2  ARG  36          1HH2      ARG  36  -2.044  -9.566 -10.309
  919   2HH2  ARG  36          2HH2      ARG  36  -2.070 -11.305 -10.446
  920    H    VAL  37           H        VAL  37   3.617  -5.065  -4.762
  921    HA   VAL  37           HA       VAL  37   1.347  -4.436  -2.979
  922    HB   VAL  37           HB       VAL  37   4.200  -3.690  -2.357
  923   1HG1  VAL  37          1HG1      VAL  37   1.796  -2.910  -1.259
  924   2HG1  VAL  37          2HG1      VAL  37   3.377  -2.787  -0.484
  925   3HG1  VAL  37          3HG1      VAL  37   2.346  -4.181  -0.165
  926   1HG2  VAL  37          1HG2      VAL  37   4.624  -5.872  -2.075
  927   2HG2  VAL  37          2HG2      VAL  37   2.917  -6.311  -2.110
  928   3HG2  VAL  37          3HG2      VAL  37   3.643  -5.715  -0.619
  929    H    ASN  38           H        ASN  38   0.454  -2.483  -3.280
  930    HA   ASN  38           HA       ASN  38   1.941  -0.554  -4.933
  931   1HB   ASN  38          1HB       ASN  38  -0.451  -1.410  -5.558
  932   2HB   ASN  38          2HB       ASN  38  -0.981  -0.275  -4.316
  933   1HD2  ASN  38          1HD2      ASN  38   0.851  -0.552  -7.295
  934   2HD2  ASN  38          2HD2      ASN  38   0.618   1.087  -7.814
  935    H    VAL  39           H        VAL  39   2.835   1.073  -3.933
  936    HA   VAL  39           HA       VAL  39   1.757   1.898  -1.312
  937    HB   VAL  39           HB       VAL  39   4.552   2.570  -2.097
  938   1HG1  VAL  39          1HG1      VAL  39   4.590   3.216   0.022
  939   2HG1  VAL  39          2HG1      VAL  39   4.287   1.557   0.533
  940   3HG1  VAL  39          3HG1      VAL  39   2.934   2.648   0.240
  941   1HG2  VAL  39          1HG2      VAL  39   5.317   0.485  -2.215
  942   2HG2  VAL  39          2HG2      VAL  39   3.650  -0.085  -2.220
  943   3HG2  VAL  39          3HG2      VAL  39   4.526   0.062  -0.696
  944    H    ASN  40           H        ASN  40   1.716   4.117  -0.817
  945    HA   ASN  40           HA       ASN  40   1.702   5.844  -3.195
  946   1HB   ASN  40          1HB       ASN  40  -0.125   5.532  -0.927
  947   2HB   ASN  40          2HB       ASN  40   0.316   7.211  -1.231
  948   1HD2  ASN  40          1HD2      ASN  40   0.587   7.132  -4.009
  949   2HD2  ASN  40          2HD2      ASN  40  -0.980   6.867  -4.698
  950    H    PHE  41           H        PHE  41   3.529   6.958  -3.306
  951    HA   PHE  41           HA       PHE  41   4.760   7.950  -0.827
  952   1HB   PHE  41          1HB       PHE  41   6.005   7.794  -3.579
  953   2HB   PHE  41          2HB       PHE  41   6.825   8.137  -2.061
  954    HD1  PHE  41           HD1      PHE  41   6.507   6.229  -0.234
  955    HD2  PHE  41           HD2      PHE  41   6.199   5.678  -4.440
  956    HE1  PHE  41           HE1      PHE  41   6.985   3.833   0.049
  957    HE2  PHE  41           HE2      PHE  41   6.682   3.281  -4.163
  958    HZ   PHE  41           HZ       PHE  41   7.119   2.364  -1.946
  959    H    ASP  42           H        ASP  42   5.769  10.109  -0.973
  960    HA   ASP  42           HA       ASP  42   3.930  12.053  -1.956
  961   1HB   ASP  42          1HB       ASP  42   5.382  12.298   0.092
  962   2HB   ASP  42          2HB       ASP  42   6.757  12.513  -0.986
  963    H    GLU  43           H        GLU  43   4.775  13.961  -3.258
  964    HA   GLU  43           HA       GLU  43   5.591  13.125  -5.835
  965   1HB   GLU  43          1HB       GLU  43   4.680  15.538  -4.585
  966   2HB   GLU  43          2HB       GLU  43   6.123  15.894  -5.525
  967   1HG   GLU  43          1HG       GLU  43   3.949  14.278  -6.760
  968   2HG   GLU  43          2HG       GLU  43   3.750  16.023  -6.604
  969    H    GLU  44           H        GLU  44   7.260  14.598  -3.096
  970    HA   GLU  44           HA       GLU  44   9.766  15.056  -4.283
  971   1HB   GLU  44          1HB       GLU  44   8.662  15.244  -1.723
  972   2HB   GLU  44          2HB       GLU  44   9.974  14.080  -1.567
  973   1HG   GLU  44          1HG       GLU  44  11.090  16.018  -1.148
  974   2HG   GLU  44          2HG       GLU  44  11.321  15.894  -2.892
  975    H    LYS  45           H        LYS  45   8.364  12.214  -2.780
  976    HA   LYS  45           HA       LYS  45  10.689  10.613  -2.778
  977   1HB   LYS  45          1HB       LYS  45   7.747   9.929  -2.733
  978   2HB   LYS  45          2HB       LYS  45   9.022   8.727  -2.558
  979   1HG   LYS  45          1HG       LYS  45   9.764  10.506  -0.669
  980   2HG   LYS  45          2HG       LYS  45   8.011  10.713  -0.651
  981   1HD   LYS  45          1HD       LYS  45   7.628   8.592   0.097
  982   2HD   LYS  45          2HD       LYS  45   9.084   7.945  -0.661
  983   1HE   LYS  45          1HE       LYS  45  10.054   8.016   1.335
  984   2HE   LYS  45          2HE       LYS  45  10.002   9.774   1.226
  985   1HZ   LYS  45          1HZ       LYS  45   8.996   8.847   3.281
  986   2HZ   LYS  45          2HZ       LYS  45   7.793   8.123   2.331
  987   3HZ   LYS  45          3HZ       LYS  45   7.931   9.811   2.376
  988    H    HIS  46           H        HIS  46   8.279  11.332  -5.173
  989    HA   HIS  46           HA       HIS  46   9.070   9.190  -6.938
  990   1HB   HIS  46          1HB       HIS  46   6.757  10.134  -6.920
  991   2HB   HIS  46          2HB       HIS  46   7.406  11.625  -7.594
  992    HD1  HIS  46           HD1      HIS  46   7.408  11.764 -10.061
  993    HD2  HIS  46           HD2      HIS  46   7.287   7.829  -8.724
  994    HE1  HIS  46           HE1      HIS  46   7.167  10.350 -12.132
  995    HE2  HIS  46           HE2      HIS  46   7.310   7.966 -11.310
  996    H    THR  47           H        THR  47   9.596  12.698  -6.748
  997    HA   THR  47           HA       THR  47  11.103  12.906  -9.127
  998    HB   THR  47           HB       THR  47  11.592  14.687  -6.757
  999    HG1  THR  47           HG1      THR  47   9.611  15.475  -6.872
 1000   1HG2  THR  47          1HG2      THR  47  11.096  15.883  -9.364
 1001   2HG2  THR  47          2HG2      THR  47  12.430  14.726  -9.397
 1002   3HG2  THR  47          3HG2      THR  47  12.469  16.086  -8.273
 1003    H    ARG  48           H        ARG  48  12.024  12.329  -5.761
 1004    HA   ARG  48           HA       ARG  48  14.825  12.210  -6.201
 1005   1HB   ARG  48          1HB       ARG  48  13.330  12.264  -3.985
 1006   2HB   ARG  48          2HB       ARG  48  13.586  10.527  -4.088
 1007   1HG   ARG  48          1HG       ARG  48  15.783  10.675  -3.580
 1008   2HG   ARG  48          2HG       ARG  48  15.981  12.234  -4.385
 1009   1HD   ARG  48          1HD       ARG  48  14.898  13.364  -2.541
 1010   2HD   ARG  48          2HD       ARG  48  14.554  11.821  -1.761
 1011    HE   ARG  48           HE       ARG  48  17.306  11.951  -2.128
 1012   1HH1  ARG  48          1HH1      ARG  48  14.865  13.778  -0.396
 1013   2HH1  ARG  48          2HH1      ARG  48  15.931  14.181   0.920
 1014   1HH2  ARG  48          1HH2      ARG  48  18.708  12.494  -0.425
 1015   2HH2  ARG  48          2HH2      ARG  48  18.129  13.506   0.874
 1016    H    PHE  49           H        PHE  49  12.231   9.826  -6.331
 1017    HA   PHE  49           HA       PHE  49  13.856   7.543  -6.656
 1018   1HB   PHE  49          1HB       PHE  49  11.045   8.157  -6.720
 1019   2HB   PHE  49          2HB       PHE  49  11.452   7.098  -8.065
 1020    HD1  PHE  49           HD1      PHE  49  13.854   5.892  -6.355
 1021    HD2  PHE  49           HD2      PHE  49   9.670   6.376  -5.760
 1022    HE1  PHE  49           HE1      PHE  49  13.852   3.962  -4.832
 1023    HE2  PHE  49           HE2      PHE  49   9.659   4.442  -4.243
 1024    HZ   PHE  49           HZ       PHE  49  11.751   3.233  -3.776
 1025    H    LYS  50           H        LYS  50  12.495   9.842  -8.961
 1026    HA   LYS  50           HA       LYS  50  13.160   8.484 -11.332
 1027   1HB   LYS  50          1HB       LYS  50  12.518  11.275 -10.570
 1028   2HB   LYS  50          2HB       LYS  50  13.391  11.068 -12.081
 1029   1HG   LYS  50          1HG       LYS  50  11.135   9.243 -11.799
 1030   2HG   LYS  50          2HG       LYS  50  10.675  10.948 -11.765
 1031   1HD   LYS  50          1HD       LYS  50  12.580   9.990 -13.854
 1032   2HD   LYS  50          2HD       LYS  50  10.857   9.660 -14.041
 1033   1HE   LYS  50          1HE       LYS  50  10.462  11.748 -14.688
 1034   2HE   LYS  50          2HE       LYS  50  11.272  12.396 -13.262
 1035   1HZ   LYS  50          1HZ       LYS  50  12.665  13.205 -14.819
 1036   2HZ   LYS  50          2HZ       LYS  50  12.286  12.010 -15.962
 1037   3HZ   LYS  50          3HZ       LYS  50  13.374  11.667 -14.705
 1038    H    ALA  51           H        ALA  51  14.939  10.848  -9.402
 1039    HA   ALA  51           HA       ALA  51  17.284  10.911 -10.984
 1040   1HB   ALA  51          1HB       ALA  51  17.228  11.362  -8.020
 1041   2HB   ALA  51          2HB       ALA  51  16.542  12.529  -9.150
 1042   3HB   ALA  51          3HB       ALA  51  18.255  12.121  -9.234
 1043    H    ALA  52           H        ALA  52  16.300   8.966  -8.196
 1044    HA   ALA  52           HA       ALA  52  18.707   7.575  -7.803
 1045   1HB   ALA  52          1HB       ALA  52  17.573   6.529  -6.187
 1046   2HB   ALA  52          2HB       ALA  52  16.300   6.009  -7.293
 1047   3HB   ALA  52          3HB       ALA  52  16.254   7.626  -6.593
 1048    H    CYS  53           H        CYS  53  15.896   6.840  -9.834
 1049    HA   CYS  53           HA       CYS  53  16.795   4.331 -10.765
 1050   1HB   CYS  53          1HB       CYS  53  14.947   6.327 -12.085
 1051   2HB   CYS  53          2HB       CYS  53  15.140   4.649 -12.576
 1052    HG   CYS  53           HG       CYS  53  13.843   5.747  -9.608
 1053    H    ALA  54           H        ALA  54  17.444   7.616 -11.788
 1054    HA   ALA  54           HA       ALA  54  18.714   6.868 -14.255
 1055   1HB   ALA  54          1HB       ALA  54  18.075   9.020 -14.497
 1056   2HB   ALA  54          2HB       ALA  54  19.655   9.357 -13.788
 1057   3HB   ALA  54          3HB       ALA  54  18.213   9.369 -12.775
 1058    H    ARG  55           H        ARG  55  19.790   7.839 -11.034
 1059    HA   ARG  55           HA       ARG  55  22.554   7.780 -11.497
 1060   1HB   ARG  55          1HB       ARG  55  20.931   8.403  -9.374
 1061   2HB   ARG  55          2HB       ARG  55  21.704   6.927  -8.816
 1062   1HG   ARG  55          1HG       ARG  55  23.345   8.254  -8.123
 1063   2HG   ARG  55          2HG       ARG  55  23.816   8.346  -9.821
 1064   1HD   ARG  55          1HD       ARG  55  23.680  10.574  -8.916
 1065   2HD   ARG  55          2HD       ARG  55  22.371  10.336 -10.074
 1066    HE   ARG  55           HE       ARG  55  21.729   9.868  -7.268
 1067   1HH1  ARG  55          1HH1      ARG  55  21.613  12.031 -10.027
 1068   2HH1  ARG  55          2HH1      ARG  55  20.382  13.050  -9.336
 1069   1HH2  ARG  55          1HH2      ARG  55  20.141  11.205  -6.353
 1070   2HH2  ARG  55          2HH2      ARG  55  19.561  12.597  -7.224
 1071    H    LYS  56           H        LYS  56  20.364   5.271 -10.279
 1072    HA   LYS  56           HA       LYS  56  22.491   3.326 -10.101
 1073   1HB   LYS  56          1HB       LYS  56  19.734   3.556  -9.209
 1074   2HB   LYS  56          2HB       LYS  56  20.077   1.967  -9.881
 1075   1HG   LYS  56          1HG       LYS  56  20.437   2.168  -7.417
 1076   2HG   LYS  56          2HG       LYS  56  21.828   1.587  -8.335
 1077   1HD   LYS  56          1HD       LYS  56  22.693   3.149  -6.797
 1078   2HD   LYS  56          2HD       LYS  56  22.651   3.983  -8.349
 1079   1HE   LYS  56          1HE       LYS  56  20.927   5.365  -7.712
 1080   2HE   LYS  56          2HE       LYS  56  20.311   4.222  -6.520
 1081   1HZ   LYS  56          1HZ       LYS  56  21.387   6.230  -5.566
 1082   2HZ   LYS  56          2HZ       LYS  56  22.867   5.698  -6.212
 1083   3HZ   LYS  56          3HZ       LYS  56  22.072   4.766  -5.040
 1084    H    GLY  57           H        GLY  57  20.194   4.327 -12.461
 1085   1HA   GLY  57          1HA       GLY  57  19.901   3.681 -14.640
 1086   2HA   GLY  57          2HA       GLY  57  21.332   2.678 -14.467
 1087    H    THR  58           H        THR  58  18.154   2.629 -12.884
 1088    HA   THR  58           HA       THR  58  17.575   0.045 -14.068
 1089    HB   THR  58           HB       THR  58  18.979  -0.306 -11.960
 1090    HG1  THR  58           HG1      THR  58  17.358  -1.829 -12.985
 1091   1HG2  THR  58          1HG2      THR  58  17.593   1.502 -10.725
 1092   2HG2  THR  58          2HG2      THR  58  18.090   0.055  -9.846
 1093   3HG2  THR  58          3HG2      THR  58  16.440   0.195 -10.453
 1094    H    SER  59           H        SER  59  15.387  -0.758 -13.115
 1095    HA   SER  59           HA       SER  59  13.518   1.330 -13.657
 1096   1HB   SER  59          1HB       SER  59  12.359  -1.159 -12.711
 1097   2HB   SER  59          2HB       SER  59  12.221  -0.384 -14.293
 1098    HG   SER  59           HG       SER  59  14.073  -2.282 -13.368
 1099    H    ILE  60           H        ILE  60  11.566   1.693 -12.355
 1100    HA   ILE  60           HA       ILE  60  12.232   2.648  -9.821
 1101    HB   ILE  60           HB       ILE  60  10.376   3.508 -11.235
 1102   1HG1  ILE  60          1HG1      ILE  60   8.847   3.038  -8.834
 1103   2HG1  ILE  60          2HG1      ILE  60  10.538   3.329  -8.438
 1104   1HG2  ILE  60          1HG2      ILE  60   9.157   0.892 -10.502
 1105   2HG2  ILE  60          2HG2      ILE  60   9.169   1.735 -12.049
 1106   3HG2  ILE  60          3HG2      ILE  60   8.120   2.297 -10.747
 1107   1HD1  ILE  60          1HD1      ILE  60  10.503   5.472  -9.294
 1108   2HD1  ILE  60          2HD1      ILE  60   8.903   5.318  -8.564
 1109   3HD1  ILE  60          3HD1      ILE  60   9.096   5.154 -10.310
 1110    H    THR  61           H        THR  61  10.929  -0.448 -10.781
 1111    HA   THR  61           HA       THR  61  10.070  -1.225  -8.198
 1112    HB   THR  61           HB       THR  61  10.876  -3.432  -9.907
 1113    HG1  THR  61           HG1      THR  61  10.251  -2.638 -11.754
 1114   1HG2  THR  61          1HG2      THR  61   8.794  -4.273  -9.361
 1115   2HG2  THR  61          2HG2      THR  61   8.053  -2.675  -9.284
 1116   3HG2  THR  61          3HG2      THR  61   9.115  -3.217  -7.986
 1117    H    ASP  62           H        ASP  62  13.051  -1.606 -10.013
 1118    HA   ASP  62           HA       ASP  62  14.217  -3.467  -8.224
 1119   1HB   ASP  62          1HB       ASP  62  15.520  -1.754 -10.345
 1120   2HB   ASP  62          2HB       ASP  62  16.274  -3.122  -9.530
 1121    H    VAL  63           H        VAL  63  14.309   0.050  -8.423
 1122    HA   VAL  63           HA       VAL  63  16.456   0.333  -6.557
 1123    HB   VAL  63           HB       VAL  63  15.324   2.665  -6.170
 1124   1HG1  VAL  63          1HG1      VAL  63  16.340   3.404  -8.420
 1125   2HG1  VAL  63          2HG1      VAL  63  16.799   1.711  -8.593
 1126   3HG1  VAL  63          3HG1      VAL  63  17.390   2.650  -7.221
 1127   1HG2  VAL  63          1HG2      VAL  63  13.931   3.457  -7.920
 1128   2HG2  VAL  63          2HG2      VAL  63  13.215   1.951  -7.337
 1129   3HG2  VAL  63          3HG2      VAL  63  14.132   1.969  -8.843
 1130    H    VAL  64           H        VAL  64  12.978  -0.053  -6.283
 1131    HA   VAL  64           HA       VAL  64  12.837   0.468  -3.475
 1132    HB   VAL  64           HB       VAL  64  10.999  -1.275  -5.127
 1133   1HG1  VAL  64          1HG1      VAL  64   9.509  -1.258  -3.375
 1134   2HG1  VAL  64          2HG1      VAL  64  10.178   0.214  -2.677
 1135   3HG1  VAL  64          3HG1      VAL  64  11.043  -1.314  -2.506
 1136   1HG2  VAL  64          1HG2      VAL  64  10.870   1.675  -4.512
 1137   2HG2  VAL  64          2HG2      VAL  64   9.539   0.740  -5.192
 1138   3HG2  VAL  64          3HG2      VAL  64  11.040   0.923  -6.099
 1139    H    ASN  65           H        ASN  65  13.512  -2.329  -5.476
 1140    HA   ASN  65           HA       ASN  65  13.511  -4.265  -3.408
 1141   1HB   ASN  65          1HB       ASN  65  13.804  -4.355  -6.131
 1142   2HB   ASN  65          2HB       ASN  65  15.443  -4.697  -5.586
 1143   1HD2  ASN  65          1HD2      ASN  65  13.391  -6.375  -6.896
 1144   2HD2  ASN  65          2HD2      ASN  65  13.246  -7.770  -5.878
 1145    H    GLN  66           H        GLN  66  15.810  -1.867  -4.437
 1146    HA   GLN  66           HA       GLN  66  18.061  -2.959  -3.045
 1147   1HB   GLN  66          1HB       GLN  66  17.556  -0.769  -4.793
 1148   2HB   GLN  66          2HB       GLN  66  18.314  -0.135  -3.341
 1149   1HG   GLN  66          1HG       GLN  66  19.464  -1.630  -5.526
 1150   2HG   GLN  66          2HG       GLN  66  20.250  -0.676  -4.265
 1151   1HE2  GLN  66          1HE2      GLN  66  19.268  -3.826  -5.288
 1152   2HE2  GLN  66          2HE2      GLN  66  20.097  -4.712  -4.047
 1153    H    LEU  67           H        LEU  67  15.667  -0.427  -2.282
 1154    HA   LEU  67           HA       LEU  67  16.870   0.201   0.220
 1155   1HB   LEU  67          1HB       LEU  67  14.386   1.048   0.659
 1156   2HB   LEU  67          2HB       LEU  67  15.556   1.956  -0.274
 1157    HG   LEU  67           HG       LEU  67  14.253   0.290  -2.122
 1158   1HD1  LEU  67          1HD1      LEU  67  12.506  -0.137  -0.510
 1159   2HD1  LEU  67          2HD1      LEU  67  11.902   0.931  -1.776
 1160   3HD1  LEU  67          3HD1      LEU  67  12.334   1.590  -0.197
 1161   1HD2  LEU  67          1HD2      LEU  67  13.645   3.183  -1.561
 1162   2HD2  LEU  67          2HD2      LEU  67  13.585   2.334  -3.106
 1163   3HD2  LEU  67          3HD2      LEU  67  15.139   2.647  -2.331
 1164    H    VAL  68           H        VAL  68  14.297  -1.986  -0.785
 1165    HA   VAL  68           HA       VAL  68  13.637  -2.807   1.871
 1166    HB   VAL  68           HB       VAL  68  12.201  -3.074  -0.266
 1167   1HG1  VAL  68          1HG1      VAL  68  13.781  -5.638  -0.418
 1168   2HG1  VAL  68          2HG1      VAL  68  13.855  -4.316  -1.585
 1169   3HG1  VAL  68          3HG1      VAL  68  12.358  -5.227  -1.376
 1170   1HG2  VAL  68          1HG2      VAL  68  11.780  -5.594   0.947
 1171   2HG2  VAL  68          2HG2      VAL  68  10.911  -4.084   1.222
 1172   3HG2  VAL  68          3HG2      VAL  68  12.324  -4.480   2.200
 1173    H    ASP  69           H        ASP  69  16.102  -3.598  -0.400
 1174    HA   ASP  69           HA       ASP  69  16.973  -6.102   0.565
 1175   1HB   ASP  69          1HB       ASP  69  17.863  -4.245  -1.333
 1176   2HB   ASP  69          2HB       ASP  69  19.151  -4.297  -0.139
 1177    H    ASN  70           H        ASN  70  18.124  -2.838   1.287
 1178    HA   ASN  70           HA       ASN  70  19.883  -3.465   3.331
 1179   1HB   ASN  70          1HB       ASN  70  19.706  -1.250   2.219
 1180   2HB   ASN  70          2HB       ASN  70  18.214  -0.953   3.108
 1181   1HD2  ASN  70          1HD2      ASN  70  21.563  -1.960   3.714
 1182   2HD2  ASN  70          2HD2      ASN  70  21.768  -1.002   5.143
 1183    H    TRP  71           H        TRP  71  16.563  -2.226   3.727
 1184    HA   TRP  71           HA       TRP  71  16.473  -2.460   6.494
 1185   1HB   TRP  71          1HB       TRP  71  14.849  -1.174   5.148
 1186   2HB   TRP  71          2HB       TRP  71  14.149  -2.683   4.572
 1187    HD1  TRP  71           HD1      TRP  71  14.265  -0.401   7.612
 1188    HE1  TRP  71           HE1      TRP  71  12.462  -1.139   9.300
 1189    HE3  TRP  71           HE3      TRP  71  12.817  -4.769   5.371
 1190    HZ2  TRP  71           HZ2      TRP  71  10.668  -3.305   9.631
 1191    HZ3  TRP  71           HZ3      TRP  71  11.041  -6.108   6.429
 1192    HH2  TRP  71           HH2      TRP  71   9.987  -5.389   8.512
 1193    H    LEU  72           H        LEU  72  15.094  -4.740   4.118
 1194    HA   LEU  72           HA       LEU  72  13.975  -6.468   5.938
 1195   1HB   LEU  72          1HB       LEU  72  14.048  -6.343   3.255
 1196   2HB   LEU  72          2HB       LEU  72  15.090  -7.729   3.520
 1197    HG   LEU  72           HG       LEU  72  12.724  -7.975   5.121
 1198   1HD1  LEU  72          1HD1      LEU  72  11.497  -8.393   2.700
 1199   2HD1  LEU  72          2HD1      LEU  72  12.353  -6.867   2.457
 1200   3HD1  LEU  72          3HD1      LEU  72  11.207  -7.035   3.790
 1201   1HD2  LEU  72          1HD2      LEU  72  12.735  -9.876   3.074
 1202   2HD2  LEU  72          2HD2      LEU  72  13.375 -10.055   4.708
 1203   3HD2  LEU  72          3HD2      LEU  72  14.433  -9.521   3.398
 1204    H    LYS  73           H        LYS  73  17.261  -6.517   4.669
 1205    HA   LYS  73           HA       LYS  73  17.760  -9.029   6.022
 1206   1HB   LYS  73          1HB       LYS  73  19.740  -7.389   4.452
 1207   2HB   LYS  73          2HB       LYS  73  19.791  -9.116   4.787
 1208   1HG   LYS  73          1HG       LYS  73  17.686  -9.346   3.434
 1209   2HG   LYS  73          2HG       LYS  73  17.886  -7.654   2.968
 1210   1HD   LYS  73          1HD       LYS  73  19.884  -9.866   2.465
 1211   2HD   LYS  73          2HD       LYS  73  18.769  -9.201   1.270
 1212   1HE   LYS  73          1HE       LYS  73  19.835  -6.958   1.702
 1213   2HE   LYS  73          2HE       LYS  73  21.067  -7.814   2.628
 1214   1HZ   LYS  73          1HZ       LYS  73  20.645  -7.707  -0.245
 1215   2HZ   LYS  73          2HZ       LYS  73  21.089  -9.223   0.376
 1216   3HZ   LYS  73          3HZ       LYS  73  22.083  -7.874   0.638
 1217    H    GLU  74           H        GLU  74  18.190  -5.696   6.704
 1218    HA   GLU  74           HA       GLU  74  20.267  -6.267   8.680
 1219   1HB   GLU  74          1HB       GLU  74  20.899  -4.099   8.549
 1220   2HB   GLU  74          2HB       GLU  74  20.058  -4.179   7.010
 1221   1HG   GLU  74          1HG       GLU  74  18.674  -2.578   7.643
 1222   2HG   GLU  74          2HG       GLU  74  18.191  -3.507   9.062
 1223    H    ASN  75           H        ASN  75  16.889  -5.342   8.489
 1224    HA   ASN  75           HA       ASN  75  16.672  -4.608  11.239
 1225   1HB   ASN  75          1HB       ASN  75  14.750  -3.712  10.549
 1226   2HB   ASN  75          2HB       ASN  75  15.081  -4.348   8.943
 1227   1HD2  ASN  75          1HD2      ASN  75  14.123  -6.331   8.317
 1228   2HD2  ASN  75          2HD2      ASN  75  12.719  -6.931   9.127
 1229    H    GLU  76           H        GLU  76  16.388  -7.599   9.520
 1230    HA   GLU  76           HA       GLU  76  15.882  -8.983  12.026
 1231   1HB   GLU  76          1HB       GLU  76  13.745  -8.455  10.448
 1232   2HB   GLU  76          2HB       GLU  76  14.283  -9.974   9.745
 1233   1HG   GLU  76          1HG       GLU  76  12.593 -10.367  11.421
 1234   2HG   GLU  76          2HG       GLU  76  14.137 -11.042  11.938
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1  25.530  86.292  10.212
    2   2H    MET   1          2H        MET   1  25.810  86.350  11.885
    3   3H    MET   1          3H        MET   1  24.975  87.614  11.122
    4    HA   MET   1           HA       MET   1  23.141  86.169  10.611
    5   1HB   MET   1          1HB       MET   1  25.149  84.187  11.413
    6   2HB   MET   1          2HB       MET   1  23.568  83.900  12.125
    7   1HG   MET   1          1HG       MET   1  22.873  82.992  10.239
    8   2HG   MET   1          2HG       MET   1  23.194  84.500   9.380
    9   1HE   MET   1          1HE       MET   1  23.469  81.969   7.538
   10   2HE   MET   1          2HE       MET   1  23.493  81.070   9.055
   11   3HE   MET   1          3HE       MET   1  24.818  80.893   7.907
   12    H    SER   2           H        SER   2  21.454  85.683  12.198
   13    HA   SER   2           HA       SER   2  21.792  87.309  14.557
   14   1HB   SER   2          1HB       SER   2  19.291  85.778  14.299
   15   2HB   SER   2          2HB       SER   2  19.538  87.511  14.508
   16    HG   SER   2           HG       SER   2  19.213  87.743  12.458
   17    H    LEU   3           H        LEU   3  23.209  86.201  15.860
   18    HA   LEU   3           HA       LEU   3  23.772  84.905  17.631
   19   1HB   LEU   3          1HB       LEU   3  21.059  83.610  17.377
   20   2HB   LEU   3          2HB       LEU   3  22.153  83.481  18.741
   21    HG   LEU   3           HG       LEU   3  21.211  86.194  17.932
   22   1HD1  LEU   3          1HD1      LEU   3  19.144  86.006  18.991
   23   2HD1  LEU   3          2HD1      LEU   3  19.566  84.474  19.752
   24   3HD1  LEU   3          3HD1      LEU   3  19.252  84.540  18.019
   25   1HD2  LEU   3          1HD2      LEU   3  22.720  85.100  20.026
   26   2HD2  LEU   3          2HD2      LEU   3  21.175  85.569  20.733
   27   3HD2  LEU   3          3HD2      LEU   3  22.146  86.760  19.867
   28    H    GLU   4           H        GLU   4  21.977  83.014  15.210
   29    HA   GLU   4           HA       GLU   4  22.531  81.177  13.995
   30   1HB   GLU   4          1HB       GLU   4  25.124  82.200  14.729
   31   2HB   GLU   4          2HB       GLU   4  25.139  80.442  14.766
   32   1HG   GLU   4          1HG       GLU   4  24.293  82.155  12.438
   33   2HG   GLU   4          2HG       GLU   4  25.824  81.297  12.595
   34    H    LYS   5           H        LYS   5  22.083  81.373  17.119
   35    HA   LYS   5           HA       LYS   5  21.935  78.482  17.430
   36   1HB   LYS   5          1HB       LYS   5  23.545  80.320  19.156
   37   2HB   LYS   5          2HB       LYS   5  22.721  78.963  19.910
   38   1HG   LYS   5          1HG       LYS   5  24.092  77.426  18.970
   39   2HG   LYS   5          2HG       LYS   5  24.335  78.376  17.501
   40   1HD   LYS   5          1HD       LYS   5  25.461  79.295  20.120
   41   2HD   LYS   5          2HD       LYS   5  26.308  78.085  19.153
   42   1HE   LYS   5          1HE       LYS   5  27.177  79.723  17.929
   43   2HE   LYS   5          2HE       LYS   5  25.553  80.149  17.391
   44   1HZ   LYS   5          1HZ       LYS   5  26.992  81.923  18.529
   45   2HZ   LYS   5          2HZ       LYS   5  26.573  81.137  19.975
   46   3HZ   LYS   5          3HZ       LYS   5  25.361  81.790  18.987
   47    H    ALA   6           H        ALA   6  20.139  80.883  17.066
   48    HA   ALA   6           HA       ALA   6  18.730  81.286  19.505
   49   1HB   ALA   6          1HB       ALA   6  17.297  82.619  18.296
   50   2HB   ALA   6          2HB       ALA   6  17.409  81.616  16.851
   51   3HB   ALA   6          3HB       ALA   6  18.743  82.681  17.291
   52    H    HIS   7           H        HIS   7  18.351  79.114  16.761
   53    HA   HIS   7           HA       HIS   7  16.095  77.782  18.085
   54   1HB   HIS   7          1HB       HIS   7  16.545  78.400  15.426
   55   2HB   HIS   7          2HB       HIS   7  16.973  76.690  15.513
   56    HD1  HIS   7           HD1      HIS   7  14.392  78.101  14.128
   57    HD2  HIS   7           HD2      HIS   7  14.501  75.901  17.662
   58    HE1  HIS   7           HE1      HIS   7  12.054  77.225  14.460
   59    HE2  HIS   7           HE2      HIS   7  12.122  75.964  16.643
   60    H    THR   8           H        THR   8  18.200  77.353  19.580
   61    HA   THR   8           HA       THR   8  19.810  75.135  18.722
   62    HB   THR   8           HB       THR   8  20.053  75.269  21.478
   63    HG1  THR   8           HG1      THR   8  20.062  77.968  20.668
   64   1HG2  THR   8          1HG2      THR   8  22.086  76.705  20.906
   65   2HG2  THR   8          2HG2      THR   8  21.542  76.610  19.231
   66   3HG2  THR   8          3HG2      THR   8  21.965  75.138  20.106
   67    H    SER   9           H        SER   9  19.762  73.018  19.596
   68    HA   SER   9           HA       SER   9  17.131  72.016  20.106
   69   1HB   SER   9          1HB       SER   9  19.469  70.266  20.591
   70   2HB   SER   9          2HB       SER   9  18.033  69.982  19.612
   71    HG   SER   9           HG       SER   9  18.928  71.335  18.002
   72    H    VAL  10           H        VAL  10  16.370  72.787  22.062
   73    HA   VAL  10           HA       VAL  10  18.001  72.192  24.443
   74    HB   VAL  10           HB       VAL  10  15.706  74.144  24.155
   75   1HG1  VAL  10          1HG1      VAL  10  15.966  74.721  26.381
   76   2HG1  VAL  10          2HG1      VAL  10  17.586  74.031  26.479
   77   3HG1  VAL  10          3HG1      VAL  10  16.177  72.971  26.424
   78   1HG2  VAL  10          1HG2      VAL  10  17.504  75.845  24.510
   79   2HG2  VAL  10          2HG2      VAL  10  17.614  74.978  22.978
   80   3HG2  VAL  10          3HG2      VAL  10  18.688  74.554  24.310
   81    H    LYS  11           H        LYS  11  17.474  70.304  25.254
   82    HA   LYS  11           HA       LYS  11  16.314  68.573  26.137
   83   1HB   LYS  11          1HB       LYS  11  14.012  70.531  26.238
   84   2HB   LYS  11          2HB       LYS  11  14.047  68.964  27.033
   85   1HG   LYS  11          1HG       LYS  11  15.396  69.685  28.699
   86   2HG   LYS  11          2HG       LYS  11  16.260  70.820  27.661
   87   1HD   LYS  11          1HD       LYS  11  15.056  72.444  28.595
   88   2HD   LYS  11          2HD       LYS  11  13.654  71.785  27.751
   89   1HE   LYS  11          1HE       LYS  11  12.941  70.587  29.617
   90   2HE   LYS  11          2HE       LYS  11  14.518  70.673  30.398
   91   1HZ   LYS  11          1HZ       LYS  11  14.015  72.618  31.337
   92   2HZ   LYS  11          2HZ       LYS  11  12.402  72.281  30.933
   93   3HZ   LYS  11          3HZ       LYS  11  13.344  73.252  29.914
   94    H    LYS  12           H        LYS  12  16.269  69.321  23.226
   95    HA   LYS  12           HA       LYS  12  14.518  67.227  22.330
   96   1HB   LYS  12          1HB       LYS  12  13.440  69.806  22.482
   97   2HB   LYS  12          2HB       LYS  12  13.869  69.603  20.789
   98   1HG   LYS  12          1HG       LYS  12  11.845  68.670  20.625
   99   2HG   LYS  12          2HG       LYS  12  12.637  67.242  21.298
  100   1HD   LYS  12          1HD       LYS  12  11.993  68.749  23.524
  101   2HD   LYS  12          2HD       LYS  12  10.607  68.970  22.455
  102   1HE   LYS  12          1HE       LYS  12   9.900  67.034  23.345
  103   2HE   LYS  12          2HE       LYS  12  11.038  66.304  22.213
  104   1HZ   LYS  12          1HZ       LYS  12  11.074  65.778  24.784
  105   2HZ   LYS  12          2HZ       LYS  12  12.085  67.136  24.808
  106   3HZ   LYS  12          3HZ       LYS  12  12.490  65.796  23.853
  107    H    MET  13           H        MET  13  16.388  66.328  21.451
  108    HA   MET  13           HA       MET  13  17.650  67.881  19.283
  109   1HB   MET  13          1HB       MET  13  19.071  67.100  21.257
  110   2HB   MET  13          2HB       MET  13  18.847  65.470  20.637
  111   1HG   MET  13          1HG       MET  13  19.832  67.545  18.764
  112   2HG   MET  13          2HG       MET  13  20.940  66.943  19.996
  113   1HE   MET  13          1HE       MET  13  22.753  65.523  18.371
  114   2HE   MET  13          2HE       MET  13  21.945  66.763  17.416
  115   3HE   MET  13          3HE       MET  13  22.120  65.129  16.773
  116    H    THR  14           H        THR  14  16.690  64.593  20.220
  117    HA   THR  14           HA       THR  14  16.151  64.058  17.376
  118    HB   THR  14           HB       THR  14  16.654  61.681  18.971
  119    HG1  THR  14           HG1      THR  14  18.770  63.553  18.550
  120   1HG2  THR  14          1HG2      THR  14  17.967  61.047  17.040
  121   2HG2  THR  14          2HG2      THR  14  17.915  62.702  16.428
  122   3HG2  THR  14          3HG2      THR  14  16.436  61.745  16.512
  123    H    PHE  15           H        PHE  15  14.169  63.285  16.912
  124    HA   PHE  15           HA       PHE  15  12.381  62.867  19.217
  125   1HB   PHE  15          1HB       PHE  15  11.263  63.661  16.574
  126   2HB   PHE  15          2HB       PHE  15  10.763  64.136  18.195
  127    HD1  PHE  15           HD1      PHE  15  12.030  65.894  19.409
  128    HD2  PHE  15           HD2      PHE  15  12.785  64.974  15.323
  129    HE1  PHE  15           HE1      PHE  15  13.179  68.051  19.140
  130    HE2  PHE  15           HE2      PHE  15  13.935  67.131  15.049
  131    HZ   PHE  15           HZ       PHE  15  14.198  68.639  16.974
  132    H    GLY  16           H        GLY  16  13.489  61.573  16.210
  133   1HA   GLY  16          1HA       GLY  16  13.289  59.139  15.955
  134   2HA   GLY  16          2HA       GLY  16  11.654  59.285  16.584
  135    H    GLU  17           H        GLU  17  13.699  60.472  13.940
  136    HA   GLU  17           HA       GLU  17  11.349  60.278  12.167
  137   1HB   GLU  17          1HB       GLU  17  13.694  62.170  11.897
  138   2HB   GLU  17          2HB       GLU  17  12.294  62.093  10.837
  139   1HG   GLU  17          1HG       GLU  17  10.939  63.173  12.311
  140   2HG   GLU  17          2HG       GLU  17  11.810  62.569  13.721
  141    H    ASN  18           H        ASN  18  13.506  58.346  12.941
  142    HA   ASN  18           HA       ASN  18  15.097  58.048  10.539
  143   1HB   ASN  18          1HB       ASN  18  15.434  57.285  13.186
  144   2HB   ASN  18          2HB       ASN  18  15.091  55.767  12.361
  145   1HD2  ASN  18          1HD2      ASN  18  17.405  55.586  13.272
  146   2HD2  ASN  18          2HD2      ASN  18  18.672  55.984  12.156
  147    H    ARG  19           H        ARG  19  12.542  56.280  12.222
  148    HA   ARG  19           HA       ARG  19  10.917  54.866  11.526
  149   1HB   ARG  19          1HB       ARG  19  10.976  56.774   9.613
  150   2HB   ARG  19          2HB       ARG  19  11.323  55.352   8.638
  151   1HG   ARG  19          1HG       ARG  19   9.070  55.294   8.502
  152   2HG   ARG  19          2HG       ARG  19   9.247  54.407  10.017
  153   1HD   ARG  19          1HD       ARG  19   8.846  57.388   9.875
  154   2HD   ARG  19          2HD       ARG  19   7.520  56.236  10.022
  155    HE   ARG  19           HE       ARG  19   8.491  55.538  12.161
  156   1HH1  ARG  19          1HH1      ARG  19   9.491  58.628  10.820
  157   2HH1  ARG  19          2HH1      ARG  19   9.993  59.267  12.360
  158   1HH2  ARG  19          1HH2      ARG  19   9.176  56.379  14.173
  159   2HH2  ARG  19          2HH2      ARG  19   9.836  57.984  14.256
  160    H    ASP  20           H        ASP  20  11.255  52.778  11.739
  161    HA   ASP  20           HA       ASP  20  13.114  51.447   9.874
  162   1HB   ASP  20          1HB       ASP  20  13.508  51.380  12.470
  163   2HB   ASP  20          2HB       ASP  20  12.214  50.187  12.448
  164    H    LEU  21           H        LEU  21  10.972  51.810   8.607
  165    HA   LEU  21           HA       LEU  21   9.039  49.687   9.183
  166   1HB   LEU  21          1HB       LEU  21   8.850  52.349   8.130
  167   2HB   LEU  21          2HB       LEU  21   8.208  51.212   6.959
  168    HG   LEU  21           HG       LEU  21   6.715  50.300   8.731
  169   1HD1  LEU  21          1HD1      LEU  21   8.379  51.753  10.439
  170   2HD1  LEU  21          2HD1      LEU  21   6.914  50.866  10.859
  171   3HD1  LEU  21          3HD1      LEU  21   6.822  52.584  10.468
  172   1HD2  LEU  21          1HD2      LEU  21   6.000  52.032   7.100
  173   2HD2  LEU  21          2HD2      LEU  21   6.392  53.264   8.300
  174   3HD2  LEU  21          3HD2      LEU  21   5.124  52.084   8.628
  175    H    GLU  22           H        GLU  22   9.994  47.871   8.414
  176    HA   GLU  22           HA       GLU  22  10.381  47.759   5.504
  177   1HB   GLU  22          1HB       GLU  22  12.348  47.272   7.576
  178   2HB   GLU  22          2HB       GLU  22  12.100  45.834   6.594
  179   1HG   GLU  22          1HG       GLU  22  13.673  46.783   5.307
  180   2HG   GLU  22          2HG       GLU  22  12.298  47.673   4.657
  181    H    ARG  23           H        ARG  23   8.840  46.478   4.748
  182    HA   ARG  23           HA       ARG  23   7.813  44.322   6.441
  183   1HB   ARG  23          1HB       ARG  23   6.734  45.913   4.165
  184   2HB   ARG  23          2HB       ARG  23   6.131  44.276   4.375
  185   1HG   ARG  23          1HG       ARG  23   6.132  46.317   6.580
  186   2HG   ARG  23          2HG       ARG  23   4.783  46.096   5.462
  187   1HD   ARG  23          1HD       ARG  23   5.035  43.579   6.186
  188   2HD   ARG  23          2HD       ARG  23   5.796  44.295   7.607
  189    HE   ARG  23           HE       ARG  23   3.011  44.709   6.743
  190   1HH1  ARG  23          1HH1      ARG  23   5.516  45.011   9.180
  191   2HH1  ARG  23          2HH1      ARG  23   4.393  45.383  10.460
  192   1HH2  ARG  23          1HH2      ARG  23   1.548  45.227   8.406
  193   2HH2  ARG  23          2HH2      ARG  23   2.133  45.450  10.030
  194    H    VAL  24           H        VAL  24   8.496  42.328   6.140
  195    HA   VAL  24           HA       VAL  24   9.853  41.624   3.648
  196    HB   VAL  24           HB       VAL  24   9.598  39.951   6.149
  197   1HG1  VAL  24          1HG1      VAL  24  11.741  38.964   5.189
  198   2HG1  VAL  24          2HG1      VAL  24  11.317  39.792   3.690
  199   3HG1  VAL  24          3HG1      VAL  24  10.236  38.570   4.357
  200   1HG2  VAL  24          1HG2      VAL  24  11.596  40.837   6.976
  201   2HG2  VAL  24          2HG2      VAL  24  10.710  42.254   6.414
  202   3HG2  VAL  24          3HG2      VAL  24  12.013  41.583   5.434
  203    H    VAL  25           H        VAL  25   8.551  40.901   2.082
  204    HA   VAL  25           HA       VAL  25   6.107  39.468   2.765
  205    HB   VAL  25           HB       VAL  25   7.170  40.312   0.061
  206   1HG1  VAL  25          1HG1      VAL  25   4.450  39.983  -0.164
  207   2HG1  VAL  25          2HG1      VAL  25   4.930  38.628   0.856
  208   3HG1  VAL  25          3HG1      VAL  25   5.677  38.849  -0.726
  209   1HG2  VAL  25          1HG2      VAL  25   6.337  42.333   0.449
  210   2HG2  VAL  25          2HG2      VAL  25   6.018  41.847   2.114
  211   3HG2  VAL  25          3HG2      VAL  25   4.772  41.647   0.884
  212    H    THR  26           H        THR  26   6.130  37.347   3.002
  213    HA   THR  26           HA       THR  26   7.960  35.746   1.329
  214    HB   THR  26           HB       THR  26   6.996  34.617   3.909
  215    HG1  THR  26           HG1      THR  26   7.665  36.527   4.763
  216   1HG2  THR  26          1HG2      THR  26   9.803  34.576   2.870
  217   2HG2  THR  26          2HG2      THR  26   8.567  33.571   2.117
  218   3HG2  THR  26          3HG2      THR  26   8.944  33.367   3.826
  219    H    ALA  27           H        ALA  27   7.058  34.078   0.209
  220    HA   ALA  27           HA       ALA  27   4.337  33.226   0.846
  221   1HB   ALA  27          1HB       ALA  27   4.850  35.152  -1.136
  222   2HB   ALA  27          2HB       ALA  27   3.337  34.305  -0.814
  223   3HB   ALA  27          3HB       ALA  27   4.484  33.649  -1.982
  224    HA   PRO  28           HA       PRO  28   6.846  29.696  -0.596
  225   1HB   PRO  28          1HB       PRO  28   6.106  27.969   1.323
  226   2HB   PRO  28          2HB       PRO  28   7.320  29.219   1.611
  227   1HG   PRO  28          1HG       PRO  28   4.457  29.131   2.433
  228   2HG   PRO  28          2HG       PRO  28   5.858  29.775   3.305
  229   1HD   PRO  28          1HD       PRO  28   4.018  31.282   1.856
  230   2HD   PRO  28          2HD       PRO  28   5.638  31.821   2.343
  231    H    VAL  29           H        VAL  29   6.061  28.613  -2.283
  232    HA   VAL  29           HA       VAL  29   3.241  27.840  -2.347
  233    HB   VAL  29           HB       VAL  29   5.209  27.341  -4.568
  234   1HG1  VAL  29          1HG1      VAL  29   3.076  27.764  -5.900
  235   2HG1  VAL  29          2HG1      VAL  29   2.231  27.631  -4.358
  236   3HG1  VAL  29          3HG1      VAL  29   3.166  26.269  -4.971
  237   1HG2  VAL  29          1HG2      VAL  29   3.686  29.894  -4.069
  238   2HG2  VAL  29          2HG2      VAL  29   4.603  29.513  -5.526
  239   3HG2  VAL  29          3HG2      VAL  29   5.435  29.695  -3.982
  240    H    SER  30           H        SER  30   3.158  26.147  -0.929
  241    HA   SER  30           HA       SER  30   5.072  23.999  -1.089
  242   1HB   SER  30          1HB       SER  30   2.605  23.899   0.618
  243   2HB   SER  30          2HB       SER  30   4.229  23.305   0.967
  244    HG   SER  30           HG       SER  30   4.919  25.446   1.216
  245    H    SER  31           H        SER  31   4.884  22.433  -2.531
  246    HA   SER  31           HA       SER  31   2.336  21.777  -3.725
  247   1HB   SER  31          1HB       SER  31   4.686  20.065  -4.273
  248   2HB   SER  31          2HB       SER  31   3.554  20.824  -5.395
  249    HG   SER  31           HG       SER  31   4.636  22.811  -5.032
  250    H    GLY  32           H        GLY  32   1.017  20.225  -3.043
  251   1HA   GLY  32          1HA       GLY  32   2.134  18.136  -1.269
  252   2HA   GLY  32          2HA       GLY  32   0.567  18.885  -0.983
  253    H    LYS  33           H        LYS  33   2.371  17.020  -3.407
  254    HA   LYS  33           HA       LYS  33  -0.192  15.813  -4.219
  255   1HB   LYS  33          1HB       LYS  33   1.606  17.270  -5.778
  256   2HB   LYS  33          2HB       LYS  33   1.923  15.593  -6.196
  257   1HG   LYS  33          1HG       LYS  33   0.277  16.620  -7.678
  258   2HG   LYS  33          2HG       LYS  33  -0.406  15.268  -6.775
  259   1HD   LYS  33          1HD       LYS  33  -1.225  17.027  -5.111
  260   2HD   LYS  33          2HD       LYS  33  -0.841  18.211  -6.362
  261   1HE   LYS  33          1HE       LYS  33  -3.062  17.788  -6.794
  262   2HE   LYS  33          2HE       LYS  33  -2.267  16.654  -7.885
  263   1HZ   LYS  33          1HZ       LYS  33  -2.789  15.595  -5.251
  264   2HZ   LYS  33          2HZ       LYS  33  -3.071  14.907  -6.774
  265   3HZ   LYS  33          3HZ       LYS  33  -4.190  16.000  -6.119
  266    H    ILE  34           H        ILE  34  -0.354  13.716  -3.868
  267    HA   ILE  34           HA       ILE  34   2.111  12.176  -3.376
  268    HB   ILE  34           HB       ILE  34  -0.695  11.359  -2.610
  269   1HG1  ILE  34          1HG1      ILE  34   1.012  12.199  -0.409
  270   2HG1  ILE  34          2HG1      ILE  34   0.707  13.513  -1.537
  271   1HG2  ILE  34          1HG2      ILE  34   1.630   9.905  -2.698
  272   2HG2  ILE  34          2HG2      ILE  34   0.207   9.518  -1.729
  273   3HG2  ILE  34          3HG2      ILE  34   1.548  10.410  -1.009
  274   1HD1  ILE  34          1HD1      ILE  34  -0.888  13.194   0.443
  275   2HD1  ILE  34          2HD1      ILE  34  -1.539  11.843  -0.486
  276   3HD1  ILE  34          3HD1      ILE  34  -1.579  13.476  -1.155
  277    H    LYS  35           H        LYS  35   2.608  10.479  -4.627
  278    HA   LYS  35           HA       LYS  35   0.800   9.864  -6.865
  279   1HB   LYS  35          1HB       LYS  35   3.765   9.948  -6.525
  280   2HB   LYS  35          2HB       LYS  35   3.096   8.814  -7.693
  281   1HG   LYS  35          1HG       LYS  35   1.862  11.351  -8.068
  282   2HG   LYS  35          2HG       LYS  35   3.613  11.564  -8.016
  283   1HD   LYS  35          1HD       LYS  35   3.839  10.677 -10.047
  284   2HD   LYS  35          2HD       LYS  35   2.924   9.243  -9.573
  285   1HE   LYS  35          1HE       LYS  35   1.422   9.965 -11.070
  286   2HE   LYS  35          2HE       LYS  35   0.950  11.099  -9.808
  287   1HZ   LYS  35          1HZ       LYS  35   1.802  12.824 -10.926
  288   2HZ   LYS  35          2HZ       LYS  35   1.690  11.805 -12.280
  289   3HZ   LYS  35          3HZ       LYS  35   3.164  11.964 -11.460
  290    H    ARG  36           H        ARG  36   0.304   7.730  -7.352
  291    HA   ARG  36           HA       ARG  36   0.920   5.810  -5.213
  292   1HB   ARG  36          1HB       ARG  36  -1.019   4.503  -6.278
  293   2HB   ARG  36          2HB       ARG  36  -1.413   5.963  -5.383
  294   1HG   ARG  36          1HG       ARG  36  -1.819   7.185  -7.347
  295   2HG   ARG  36          2HG       ARG  36  -1.051   5.961  -8.359
  296   1HD   ARG  36          1HD       ARG  36  -3.113   4.663  -6.943
  297   2HD   ARG  36          2HD       ARG  36  -3.788   6.178  -7.541
  298    HE   ARG  36           HE       ARG  36  -2.814   3.938  -9.132
  299   1HH1  ARG  36          1HH1      ARG  36  -4.173   7.165  -9.034
  300   2HH1  ARG  36          2HH1      ARG  36  -4.488   7.212 -10.744
  301   1HH2  ARG  36          1HH2      ARG  36  -3.265   3.984 -11.356
  302   2HH2  ARG  36          2HH2      ARG  36  -3.985   5.407 -12.061
  303    H    VAL  37           H        VAL  37   2.217   4.167  -5.576
  304    HA   VAL  37           HA       VAL  37   2.785   3.383  -8.366
  305    HB   VAL  37           HB       VAL  37   4.844   3.466  -6.152
  306   1HG1  VAL  37          1HG1      VAL  37   5.426   1.865  -7.817
  307   2HG1  VAL  37          2HG1      VAL  37   6.431   3.292  -8.079
  308   3HG1  VAL  37          3HG1      VAL  37   5.038   2.989  -9.119
  309   1HG2  VAL  37          1HG2      VAL  37   5.043   5.369  -8.402
  310   2HG2  VAL  37          2HG2      VAL  37   5.487   5.563  -6.705
  311   3HG2  VAL  37          3HG2      VAL  37   3.799   5.705  -7.197
  312    H    ASN  38           H        ASN  38   3.002   1.212  -8.751
  313    HA   ASN  38           HA       ASN  38   2.461  -0.576  -6.474
  314   1HB   ASN  38          1HB       ASN  38   0.797  -0.580  -8.371
  315   2HB   ASN  38          2HB       ASN  38   2.080  -1.200  -9.412
  316   1HD2  ASN  38          1HD2      ASN  38  -0.411  -1.994  -7.338
  317   2HD2  ASN  38          2HD2      ASN  38  -0.045  -3.673  -7.113
  318    H    VAL  39           H        VAL  39   4.095  -1.814  -5.811
  319    HA   VAL  39           HA       VAL  39   6.319  -2.292  -7.692
  320    HB   VAL  39           HB       VAL  39   7.828  -2.366  -5.732
  321   1HG1  VAL  39          1HG1      VAL  39   6.272   0.126  -6.328
  322   2HG1  VAL  39          2HG1      VAL  39   7.897  -0.324  -6.849
  323   3HG1  VAL  39          3HG1      VAL  39   7.604   0.139  -5.171
  324   1HG2  VAL  39          1HG2      VAL  39   5.557  -2.651  -4.241
  325   2HG2  VAL  39          2HG2      VAL  39   5.979  -0.963  -3.949
  326   3HG2  VAL  39          3HG2      VAL  39   7.149  -2.237  -3.599
  327    H    ASN  40           H        ASN  40   7.636  -4.251  -7.099
  328    HA   ASN  40           HA       ASN  40   5.931  -6.351  -5.958
  329   1HB   ASN  40          1HB       ASN  40   6.558  -7.905  -7.656
  330   2HB   ASN  40          2HB       ASN  40   6.021  -6.448  -8.471
  331   1HD2  ASN  40          1HD2      ASN  40   7.427  -5.329  -9.742
  332   2HD2  ASN  40          2HD2      ASN  40   9.041  -5.866 -10.089
  333    H    PHE  41           H        PHE  41   6.880  -7.750  -4.600
  334    HA   PHE  41           HA       PHE  41   9.767  -7.387  -4.100
  335   1HB   PHE  41          1HB       PHE  41   7.536  -7.980  -2.136
  336   2HB   PHE  41          2HB       PHE  41   9.242  -8.070  -1.729
  337    HD1  PHE  41           HD1      PHE  41   7.147  -6.350  -0.382
  338    HD2  PHE  41           HD2      PHE  41   9.843  -5.586  -3.581
  339    HE1  PHE  41           HE1      PHE  41   7.136  -3.957   0.182
  340    HE2  PHE  41           HE2      PHE  41   9.838  -3.191  -3.022
  341    HZ   PHE  41           HZ       PHE  41   8.412  -2.385  -1.116
  342    H    ASP  42           H        ASP  42  10.856  -9.268  -3.193
  343    HA   ASP  42           HA       ASP  42  10.120 -11.692  -4.560
  344   1HB   ASP  42          1HB       ASP  42  12.400 -11.489  -4.579
  345   2HB   ASP  42          2HB       ASP  42  12.461 -10.699  -3.011
  346    H    GLU  43           H        GLU  43  10.005 -13.777  -3.404
  347    HA   GLU  43           HA       GLU  43   7.881 -13.799  -1.632
  348   1HB   GLU  43          1HB       GLU  43   9.833 -15.805  -2.583
  349   2HB   GLU  43          2HB       GLU  43   8.984 -16.203  -1.095
  350   1HG   GLU  43          1HG       GLU  43   7.275 -15.194  -3.252
  351   2HG   GLU  43          2HG       GLU  43   8.071 -16.733  -3.586
  352    H    GLU  44           H        GLU  44  11.314 -14.385  -0.846
  353    HA   GLU  44           HA       GLU  44  11.026 -14.622   1.937
  354   1HB   GLU  44          1HB       GLU  44  13.145 -14.584   0.107
  355   2HB   GLU  44          2HB       GLU  44  13.463 -13.234   1.191
  356   1HG   GLU  44          1HG       GLU  44  12.809 -15.963   2.244
  357   2HG   GLU  44          2HG       GLU  44  14.450 -15.523   1.773
  358    H    LYS  45           H        LYS  45  11.513 -11.815  -0.133
  359    HA   LYS  45           HA       LYS  45  11.860  -9.919   1.903
  360   1HB   LYS  45          1HB       LYS  45  10.667  -9.435  -0.834
  361   2HB   LYS  45          2HB       LYS  45  11.428  -8.240   0.208
  362   1HG   LYS  45          1HG       LYS  45  13.242 -10.404  -0.232
  363   2HG   LYS  45          2HG       LYS  45  12.628  -9.818  -1.779
  364   1HD   LYS  45          1HD       LYS  45  13.874  -7.973  -1.645
  365   2HD   LYS  45          2HD       LYS  45  13.269  -7.618  -0.026
  366   1HE   LYS  45          1HE       LYS  45  15.529  -7.874   0.360
  367   2HE   LYS  45          2HE       LYS  45  14.918  -9.490   0.710
  368   1HZ   LYS  45          1HZ       LYS  45  15.659  -9.078  -2.048
  369   2HZ   LYS  45          2HZ       LYS  45  16.029 -10.359  -1.004
  370   3HZ   LYS  45          3HZ       LYS  45  16.956  -8.937  -0.961
  371    H    HIS  46           H        HIS  46   8.965 -11.361   0.568
  372    HA   HIS  46           HA       HIS  46   7.287  -9.378   1.873
  373   1HB   HIS  46          1HB       HIS  46   6.820 -10.638  -0.389
  374   2HB   HIS  46          2HB       HIS  46   6.135 -11.857   0.685
  375    HD1  HIS  46           HD1      HIS  46   3.760 -11.515   1.315
  376    HD2  HIS  46           HD2      HIS  46   5.595  -7.966   0.113
  377    HE1  HIS  46           HE1      HIS  46   1.969  -9.753   1.399
  378    HE2  HIS  46           HE2      HIS  46   3.055  -7.648   0.540
  379    H    THR  47           H        THR  47   8.120 -12.805   2.290
  380    HA   THR  47           HA       THR  47   6.345 -13.291   4.438
  381    HB   THR  47           HB       THR  47   9.041 -14.615   4.181
  382    HG1  THR  47           HG1      THR  47   8.013 -16.033   2.669
  383   1HG2  THR  47          1HG2      THR  47   8.180 -15.864   5.829
  384   2HG2  THR  47          2HG2      THR  47   6.995 -16.462   4.670
  385   3HG2  THR  47          3HG2      THR  47   6.613 -15.071   5.683
  386    H    ARG  48           H        ARG  48   9.624 -12.041   4.249
  387    HA   ARG  48           HA       ARG  48  10.029 -11.790   7.065
  388   1HB   ARG  48          1HB       ARG  48  11.715 -11.704   5.021
  389   2HB   ARG  48          2HB       ARG  48  11.385  -9.979   5.129
  390   1HG   ARG  48          1HG       ARG  48  13.335 -10.437   6.407
  391   2HG   ARG  48          2HG       ARG  48  12.023 -10.071   7.530
  392   1HD   ARG  48          1HD       ARG  48  13.100 -11.939   8.442
  393   2HD   ARG  48          2HD       ARG  48  11.654 -12.583   7.664
  394    HE   ARG  48           HE       ARG  48  13.185 -13.146   5.746
  395   1HH1  ARG  48          1HH1      ARG  48  14.296 -13.017   9.068
  396   2HH1  ARG  48          2HH1      ARG  48  15.732 -13.947   8.745
  397   1HH2  ARG  48          1HH2      ARG  48  15.037 -14.376   5.326
  398   2HH2  ARG  48          2HH2      ARG  48  16.126 -14.765   6.627
  399    H    PHE  49           H        PHE  49   8.843  -9.690   4.505
  400    HA   PHE  49           HA       PHE  49   8.690  -7.252   5.783
  401   1HB   PHE  49          1HB       PHE  49   7.769  -8.331   3.401
  402   2HB   PHE  49          2HB       PHE  49   6.291  -7.856   4.228
  403    HD1  PHE  49           HD1      PHE  49   5.485  -5.843   3.563
  404    HD2  PHE  49           HD2      PHE  49   9.698  -6.392   3.797
  405    HE1  PHE  49           HE1      PHE  49   5.827  -3.523   2.827
  406    HE2  PHE  49           HE2      PHE  49  10.044  -4.071   3.067
  407    HZ   PHE  49           HZ       PHE  49   8.107  -2.630   2.588
  408    H    LYS  50           H        LYS  50   6.102  -9.690   5.599
  409    HA   LYS  50           HA       LYS  50   4.348  -8.378   7.350
  410   1HB   LYS  50          1HB       LYS  50   4.423 -11.363   6.968
  411   2HB   LYS  50          2HB       LYS  50   3.030 -10.346   7.302
  412   1HG   LYS  50          1HG       LYS  50   4.147  -9.418   4.892
  413   2HG   LYS  50          2HG       LYS  50   4.090 -11.178   4.789
  414   1HD   LYS  50          1HD       LYS  50   1.827  -9.252   5.248
  415   2HD   LYS  50          2HD       LYS  50   2.022 -10.423   3.944
  416   1HE   LYS  50          1HE       LYS  50   1.834 -11.347   6.788
  417   2HE   LYS  50          2HE       LYS  50   0.375 -10.925   5.894
  418   1HZ   LYS  50          1HZ       LYS  50   0.759 -12.618   4.342
  419   2HZ   LYS  50          2HZ       LYS  50   1.074 -13.330   5.849
  420   3HZ   LYS  50          3HZ       LYS  50   2.362 -12.861   4.850
  421    H    ALA  51           H        ALA  51   6.728 -10.937   7.945
  422    HA   ALA  51           HA       ALA  51   6.015 -11.427  10.619
  423   1HB   ALA  51          1HB       ALA  51   7.776 -12.884  10.677
  424   2HB   ALA  51          2HB       ALA  51   8.828 -11.828   9.734
  425   3HB   ALA  51          3HB       ALA  51   7.547 -12.741   8.933
  426    H    ALA  52           H        ALA  52   8.720  -9.517   9.307
  427    HA   ALA  52           HA       ALA  52   9.700  -8.658  11.798
  428   1HB   ALA  52          1HB       ALA  52  10.820  -8.625   9.493
  429   2HB   ALA  52          2HB       ALA  52  11.164  -7.305  10.613
  430   3HB   ALA  52          3HB       ALA  52  10.026  -7.064   9.287
  431    H    CYS  53           H        CYS  53   7.478  -7.097   9.490
  432    HA   CYS  53           HA       CYS  53   7.207  -4.703  10.956
  433   1HB   CYS  53          1HB       CYS  53   5.838  -4.044   9.287
  434   2HB   CYS  53          2HB       CYS  53   6.444  -5.487   8.484
  435    HG   CYS  53           HG       CYS  53   3.375  -4.696   9.257
  436    H    ALA  54           H        ALA  54   5.648  -7.817  11.236
  437    HA   ALA  54           HA       ALA  54   3.493  -6.917  12.895
  438   1HB   ALA  54          1HB       ALA  54   3.278  -8.990  11.663
  439   2HB   ALA  54          2HB       ALA  54   3.167  -9.310  13.395
  440   3HB   ALA  54          3HB       ALA  54   4.656  -9.674  12.524
  441    H    ARG  55           H        ARG  55   6.776  -8.001  13.404
  442    HA   ARG  55           HA       ARG  55   6.584  -8.361  16.222
  443   1HB   ARG  55          1HB       ARG  55   8.674  -8.406  14.181
  444   2HB   ARG  55          2HB       ARG  55   9.231  -7.721  15.703
  445   1HG   ARG  55          1HG       ARG  55   7.680 -10.196  15.952
  446   2HG   ARG  55          2HG       ARG  55   9.219 -10.360  15.106
  447   1HD   ARG  55          1HD       ARG  55   8.834  -9.139  17.841
  448   2HD   ARG  55          2HD       ARG  55   9.438 -10.762  17.522
  449    HE   ARG  55           HE       ARG  55  10.846  -8.246  16.930
  450   1HH1  ARG  55          1HH1      ARG  55  10.859 -11.733  17.288
  451   2HH1  ARG  55          2HH1      ARG  55  12.596 -11.854  17.272
  452   1HH2  ARG  55          1HH2      ARG  55  13.132  -8.405  16.872
  453   2HH2  ARG  55          2HH2      ARG  55  13.883  -9.972  17.021
  454    H    LYS  56           H        LYS  56   7.012  -5.610  14.161
  455    HA   LYS  56           HA       LYS  56   7.861  -3.965  16.423
  456   1HB   LYS  56          1HB       LYS  56   7.847  -3.363  13.465
  457   2HB   LYS  56          2HB       LYS  56   8.457  -2.288  14.717
  458   1HG   LYS  56          1HG       LYS  56  10.175  -3.882  15.304
  459   2HG   LYS  56          2HG       LYS  56   9.532  -5.040  14.137
  460   1HD   LYS  56          1HD       LYS  56   9.973  -2.585  12.783
  461   2HD   LYS  56          2HD       LYS  56  11.423  -2.960  13.719
  462   1HE   LYS  56          1HE       LYS  56  10.108  -5.084  12.083
  463   2HE   LYS  56          2HE       LYS  56  11.149  -3.895  11.302
  464   1HZ   LYS  56          1HZ       LYS  56  12.535  -5.681  11.826
  465   2HZ   LYS  56          2HZ       LYS  56  11.871  -5.887  13.370
  466   3HZ   LYS  56          3HZ       LYS  56  12.855  -4.543  13.040
  467    H    GLY  57           H        GLY  57   5.167  -4.451  14.297
  468   1HA   GLY  57          1HA       GLY  57   2.978  -3.682  14.763
  469   2HA   GLY  57          2HA       GLY  57   3.662  -2.423  15.782
  470    H    THR  58           H        THR  58   4.597  -3.271  12.500
  471    HA   THR  58           HA       THR  58   4.004  -0.512  11.692
  472    HB   THR  58           HB       THR  58   5.682  -2.335  10.029
  473    HG1  THR  58           HG1      THR  58   6.645  -1.001  12.372
  474   1HG2  THR  58          1HG2      THR  58   5.010   0.258   9.768
  475   2HG2  THR  58          2HG2      THR  58   6.517  -0.424   9.153
  476   3HG2  THR  58          3HG2      THR  58   6.497   0.421  10.700
  477    H    SER  59           H        SER  59   2.882  -0.059   9.825
  478    HA   SER  59           HA       SER  59   1.142  -2.143   8.791
  479   1HB   SER  59          1HB       SER  59   1.246   0.547   7.519
  480   2HB   SER  59          2HB       SER  59  -0.150  -0.437   7.959
  481    HG   SER  59           HG       SER  59   1.020   0.205  10.218
  482    H    ILE  60           H        ILE  60   1.332  -3.130   6.840
  483    HA   ILE  60           HA       ILE  60   3.746  -3.577   5.678
  484    HB   ILE  60           HB       ILE  60   1.017  -3.686   4.405
  485   1HG1  ILE  60          1HG1      ILE  60   1.375  -5.243   6.245
  486   2HG1  ILE  60          2HG1      ILE  60   1.304  -6.116   4.718
  487   1HG2  ILE  60          1HG2      ILE  60   3.568  -4.824   3.274
  488   2HG2  ILE  60          2HG2      ILE  60   2.730  -3.398   2.658
  489   3HG2  ILE  60          3HG2      ILE  60   1.949  -4.979   2.592
  490   1HD1  ILE  60          1HD1      ILE  60   3.649  -5.601   6.493
  491   2HD1  ILE  60          2HD1      ILE  60   3.878  -5.967   4.782
  492   3HD1  ILE  60          3HD1      ILE  60   3.059  -7.127   5.829
  493    H    THR  61           H        THR  61   1.348  -1.236   4.482
  494    HA   THR  61           HA       THR  61   2.840  -0.280   2.319
  495    HB   THR  61           HB       THR  61   1.098   1.669   3.694
  496    HG1  THR  61           HG1      THR  61  -0.523   0.349   3.974
  497   1HG2  THR  61          1HG2      THR  61   1.291   0.520   0.912
  498   2HG2  THR  61          2HG2      THR  61   1.769   2.131   1.452
  499   3HG2  THR  61          3HG2      THR  61   0.062   1.688   1.400
  500    H    ASP  62           H        ASP  62   2.689   0.769   5.680
  501    HA   ASP  62           HA       ASP  62   4.200   3.124   5.455
  502   1HB   ASP  62          1HB       ASP  62   2.798   2.016   7.458
  503   2HB   ASP  62          2HB       ASP  62   4.419   1.551   7.966
  504    H    VAL  63           H        VAL  63   5.163  -0.231   6.022
  505    HA   VAL  63           HA       VAL  63   7.853   0.212   6.659
  506    HB   VAL  63           HB       VAL  63   6.953  -2.150   5.015
  507   1HG1  VAL  63          1HG1      VAL  63   8.640  -3.129   6.842
  508   2HG1  VAL  63          2HG1      VAL  63   9.257  -1.481   6.740
  509   3HG1  VAL  63          3HG1      VAL  63   9.172  -2.483   5.292
  510   1HG2  VAL  63          1HG2      VAL  63   6.178  -3.271   6.947
  511   2HG2  VAL  63          2HG2      VAL  63   5.390  -1.695   6.944
  512   3HG2  VAL  63          3HG2      VAL  63   6.762  -1.993   8.013
  513    H    VAL  64           H        VAL  64   6.345  -0.397   3.490
  514    HA   VAL  64           HA       VAL  64   8.650  -0.271   1.923
  515    HB   VAL  64           HB       VAL  64   6.099   0.902   0.882
  516   1HG1  VAL  64          1HG1      VAL  64   6.836  -0.634  -1.057
  517   2HG1  VAL  64          2HG1      VAL  64   8.381  -0.703  -0.205
  518   3HG1  VAL  64          3HG1      VAL  64   7.745   0.849  -0.756
  519   1HG2  VAL  64          1HG2      VAL  64   5.485  -1.072   2.266
  520   2HG2  VAL  64          2HG2      VAL  64   6.540  -2.056   1.252
  521   3HG2  VAL  64          3HG2      VAL  64   5.129  -1.267   0.550
  522    H    ASN  65           H        ASN  65   6.385   2.339   2.764
  523    HA   ASN  65           HA       ASN  65   7.674   4.413   1.415
  524   1HB   ASN  65          1HB       ASN  65   5.448   4.177   3.055
  525   2HB   ASN  65          2HB       ASN  65   6.499   5.276   3.935
  526   1HD2  ASN  65          1HD2      ASN  65   3.977   5.315   2.032
  527   2HD2  ASN  65          2HD2      ASN  65   4.276   6.734   1.082
  528    H    GLN  66           H        GLN  66   8.175   3.140   4.657
  529    HA   GLN  66           HA       GLN  66  10.001   5.093   5.546
  530   1HB   GLN  66          1HB       GLN  66   9.299   2.312   6.378
  531   2HB   GLN  66          2HB       GLN  66  10.725   3.074   7.067
  532   1HG   GLN  66          1HG       GLN  66   9.298   4.958   7.804
  533   2HG   GLN  66          2HG       GLN  66   7.890   4.067   7.223
  534   1HE2  GLN  66          1HE2      GLN  66   6.826   3.361   8.920
  535   2HE2  GLN  66          2HE2      GLN  66   7.522   2.567  10.296
  536    H    LEU  67           H        LEU  67  10.484   1.918   4.026
  537    HA   LEU  67           HA       LEU  67  13.319   2.050   4.171
  538   1HB   LEU  67          1HB       LEU  67  11.788   0.354   2.217
  539   2HB   LEU  67          2HB       LEU  67  13.356   0.033   2.938
  540    HG   LEU  67           HG       LEU  67  10.687  -0.036   4.327
  541   1HD1  LEU  67          1HD1      LEU  67  12.498  -2.353   4.330
  542   2HD1  LEU  67          2HD1      LEU  67  11.766  -1.949   2.778
  543   3HD1  LEU  67          3HD1      LEU  67  10.742  -2.278   4.177
  544   1HD2  LEU  67          1HD2      LEU  67  12.803   0.845   5.592
  545   2HD2  LEU  67          2HD2      LEU  67  13.220  -0.867   5.648
  546   3HD2  LEU  67          3HD2      LEU  67  11.705  -0.304   6.354
  547    H    VAL  68           H        VAL  68  10.961   2.932   1.719
  548    HA   VAL  68           HA       VAL  68  12.762   3.529  -0.387
  549    HB   VAL  68           HB       VAL  68  10.047   4.670   0.306
  550   1HG1  VAL  68          1HG1      VAL  68  11.487   5.130  -2.291
  551   2HG1  VAL  68          2HG1      VAL  68  11.548   6.283  -0.957
  552   3HG1  VAL  68          3HG1      VAL  68  10.003   5.887  -1.712
  553   1HG2  VAL  68          1HG2      VAL  68   9.884   2.411  -0.411
  554   2HG2  VAL  68          2HG2      VAL  68  11.017   2.683  -1.737
  555   3HG2  VAL  68          3HG2      VAL  68   9.414   3.416  -1.784
  556    H    ASP  69           H        ASP  69  11.516   5.343   2.347
  557    HA   ASP  69           HA       ASP  69  12.759   7.816   1.829
  558   1HB   ASP  69          1HB       ASP  69  11.269   6.596   3.956
  559   2HB   ASP  69          2HB       ASP  69  12.673   7.415   4.628
  560    H    ASN  70           H        ASN  70  13.772   5.065   3.847
  561    HA   ASN  70           HA       ASN  70  16.167   6.213   4.742
  562   1HB   ASN  70          1HB       ASN  70  14.816   3.763   5.092
  563   2HB   ASN  70          2HB       ASN  70  16.445   3.362   4.552
  564   1HD2  ASN  70          1HD2      ASN  70  14.767   3.532   7.222
  565   2HD2  ASN  70          2HD2      ASN  70  15.946   4.142   8.330
  566    H    TRP  71           H        TRP  71  15.587   3.994   2.025
  567    HA   TRP  71           HA       TRP  71  18.265   3.801   1.167
  568   1HB   TRP  71          1HB       TRP  71  16.359   2.348   0.414
  569   2HB   TRP  71          2HB       TRP  71  15.796   3.692  -0.575
  570    HD1  TRP  71           HD1      TRP  71  18.787   1.266  -0.297
  571    HE1  TRP  71           HE1      TRP  71  19.887   1.089  -2.617
  572    HE3  TRP  71           HE3      TRP  71  16.000   4.746  -2.813
  573    HZ2  TRP  71           HZ2      TRP  71  19.610   2.232  -5.162
  574    HZ3  TRP  71           HZ3      TRP  71  16.476   5.127  -5.200
  575    HH2  TRP  71           HH2      TRP  71  18.246   3.891  -6.354
  576    H    LEU  72           H        LEU  72  15.639   5.973   0.190
  577    HA   LEU  72           HA       LEU  72  17.050   7.359  -1.780
  578   1HB   LEU  72          1HB       LEU  72  14.561   7.696  -0.294
  579   2HB   LEU  72          2HB       LEU  72  15.291   9.216  -0.773
  580    HG   LEU  72           HG       LEU  72  14.476   6.957  -2.601
  581   1HD1  LEU  72          1HD1      LEU  72  12.507   8.011  -2.273
  582   2HD1  LEU  72          2HD1      LEU  72  13.166   9.110  -3.485
  583   3HD1  LEU  72          3HD1      LEU  72  13.269   9.521  -1.773
  584   1HD2  LEU  72          1HD2      LEU  72  15.785   7.777  -4.191
  585   2HD2  LEU  72          2HD2      LEU  72  16.529   8.823  -2.982
  586   3HD2  LEU  72          3HD2      LEU  72  15.161   9.406  -3.931
  587    H    LYS  73           H        LYS  73  16.783   7.947   1.696
  588    HA   LYS  73           HA       LYS  73  18.131  10.458   1.529
  589   1HB   LYS  73          1HB       LYS  73  17.077   8.742   3.723
  590   2HB   LYS  73          2HB       LYS  73  18.269   9.969   4.137
  591   1HG   LYS  73          1HG       LYS  73  16.845  11.684   3.752
  592   2HG   LYS  73          2HG       LYS  73  16.013  10.842   2.442
  593   1HD   LYS  73          1HD       LYS  73  14.694   9.595   3.941
  594   2HD   LYS  73          2HD       LYS  73  15.723  10.009   5.316
  595   1HE   LYS  73          1HE       LYS  73  14.805  12.089   5.554
  596   2HE   LYS  73          2HE       LYS  73  14.401  12.223   3.842
  597   1HZ   LYS  73          1HZ       LYS  73  12.611  10.609   4.195
  598   2HZ   LYS  73          2HZ       LYS  73  12.407  11.995   5.151
  599   3HZ   LYS  73          3HZ       LYS  73  12.975  10.560   5.853
  600    H    GLU  74           H        GLU  74  19.120   7.181   2.418
  601    HA   GLU  74           HA       GLU  74  21.714   8.081   3.262
  602   1HB   GLU  74          1HB       GLU  74  20.508   5.337   2.959
  603   2HB   GLU  74          2HB       GLU  74  22.163   5.598   3.488
  604   1HG   GLU  74          1HG       GLU  74  19.654   6.520   4.871
  605   2HG   GLU  74          2HG       GLU  74  20.757   5.250   5.400
  606    H    ASN  75           H        ASN  75  20.428   6.509   0.373
  607    HA   ASN  75           HA       ASN  75  23.105   6.093  -0.660
  608   1HB   ASN  75          1HB       ASN  75  22.179   4.512  -1.934
  609   2HB   ASN  75          2HB       ASN  75  20.689   4.797  -1.052
  610   1HD2  ASN  75          1HD2      ASN  75  19.041   5.925  -2.015
  611   2HD2  ASN  75          2HD2      ASN  75  19.000   6.215  -3.718
  612    H    GLU  76           H        GLU  76  21.055   8.672  -0.529
  613    HA   GLU  76           HA       GLU  76  21.765   9.860  -3.078
  614   1HB   GLU  76          1HB       GLU  76  19.951  10.487  -0.898
  615   2HB   GLU  76          2HB       GLU  76  20.901  11.890  -1.365
  616   1HG   GLU  76          1HG       GLU  76  20.193  11.224  -3.779
  617   2HG   GLU  76          2HG       GLU  76  18.915  10.334  -2.951
  618   1H    MET   1          1H        MET   1  42.924 -76.136  15.230
  619   2H    MET   1          2H        MET   1  42.591 -77.562  14.375
  620   3H    MET   1          3H        MET   1  41.643 -76.183  14.118
  621    HA   MET   1           HA       MET   1  43.233 -76.572  12.319
  622   1HB   MET   1          1HB       MET   1  42.722 -74.197  13.814
  623   2HB   MET   1          2HB       MET   1  44.397 -74.140  13.282
  624   1HG   MET   1          1HG       MET   1  43.629 -74.552  10.966
  625   2HG   MET   1          2HG       MET   1  41.964 -74.479  11.543
  626   1HE   MET   1          1HE       MET   1  41.796 -72.206  13.583
  627   2HE   MET   1          2HE       MET   1  40.703 -72.335  12.207
  628   3HE   MET   1          3HE       MET   1  41.488 -70.796  12.570
  629    H    SER   2           H        SER   2  45.460 -76.523  11.651
  630    HA   SER   2           HA       SER   2  47.364 -77.027  13.840
  631   1HB   SER   2          1HB       SER   2  47.566 -78.321  11.125
  632   2HB   SER   2          2HB       SER   2  48.390 -78.774  12.615
  633    HG   SER   2           HG       SER   2  46.279 -79.315  13.465
  634    H    LEU   3           H        LEU   3  49.475 -76.307  13.527
  635    HA   LEU   3           HA       LEU   3  51.153 -74.964  12.812
  636   1HB   LEU   3          1HB       LEU   3  49.835 -75.630  10.368
  637   2HB   LEU   3          2HB       LEU   3  50.278 -73.934  10.322
  638    HG   LEU   3           HG       LEU   3  52.343 -75.914  11.162
  639   1HD1  LEU   3          1HD1      LEU   3  52.621 -75.542   8.390
  640   2HD1  LEU   3          2HD1      LEU   3  50.950 -76.044   8.663
  641   3HD1  LEU   3          3HD1      LEU   3  52.280 -77.044   9.252
  642   1HD2  LEU   3          1HD2      LEU   3  52.850 -73.682   9.289
  643   2HD2  LEU   3          2HD2      LEU   3  53.810 -74.265  10.649
  644   3HD2  LEU   3          3HD2      LEU   3  52.397 -73.248  10.940
  645    H    GLU   4           H        GLU   4  48.357 -73.452  11.215
  646    HA   GLU   4           HA       GLU   4  47.488 -71.355  11.330
  647   1HB   GLU   4          1HB       GLU   4  48.171 -71.561  14.266
  648   2HB   GLU   4          2HB       GLU   4  46.947 -70.529  13.540
  649   1HG   GLU   4          1HG       GLU   4  45.539 -72.337  13.067
  650   2HG   GLU   4          2HG       GLU   4  46.829 -73.515  13.301
  651    H    LYS   5           H        LYS   5  49.962 -71.253  10.353
  652    HA   LYS   5           HA       LYS   5  51.124 -68.863  11.609
  653   1HB   LYS   5          1HB       LYS   5  52.448 -71.459  10.937
  654   2HB   LYS   5          2HB       LYS   5  53.378 -69.971  10.818
  655   1HG   LYS   5          1HG       LYS   5  52.881 -69.474  13.155
  656   2HG   LYS   5          2HG       LYS   5  51.956 -70.973  13.275
  657   1HD   LYS   5          1HD       LYS   5  53.830 -72.291  13.233
  658   2HD   LYS   5          2HD       LYS   5  54.767 -71.116  12.307
  659   1HE   LYS   5          1HE       LYS   5  55.509 -70.075  14.155
  660   2HE   LYS   5          2HE       LYS   5  53.944 -70.182  14.956
  661   1HZ   LYS   5          1HZ       LYS   5  55.925 -72.387  14.734
  662   2HZ   LYS   5          2HZ       LYS   5  54.421 -72.484  15.514
  663   3HZ   LYS   5          3HZ       LYS   5  55.626 -71.457  16.120
  664    H    ALA   6           H        ALA   6  49.722 -70.042   8.927
  665    HA   ALA   6           HA       ALA   6  51.433 -68.466   7.118
  666   1HB   ALA   6          1HB       ALA   6  49.745 -69.961   5.519
  667   2HB   ALA   6          2HB       ALA   6  50.143 -71.052   6.846
  668   3HB   ALA   6          3HB       ALA   6  51.431 -70.325   5.885
  669    H    HIS   7           H        HIS   7  49.150 -67.645   8.940
  670    HA   HIS   7           HA       HIS   7  47.628 -66.233   6.858
  671   1HB   HIS   7          1HB       HIS   7  46.602 -67.834   9.151
  672   2HB   HIS   7          2HB       HIS   7  45.752 -66.342   8.759
  673    HD1  HIS   7           HD1      HIS   7  45.107 -69.623   8.260
  674    HD2  HIS   7           HD2      HIS   7  45.691 -66.539   5.525
  675    HE1  HIS   7           HE1      HIS   7  44.009 -70.379   6.127
  676    HE2  HIS   7           HE2      HIS   7  44.321 -68.483   4.502
  677    H    THR   8           H        THR   8  49.969 -65.551   8.471
  678    HA   THR   8           HA       THR   8  49.072 -63.627  10.426
  679    HB   THR   8           HB       THR   8  51.866 -63.428   9.675
  680    HG1  THR   8           HG1      THR   8  52.198 -65.706  10.563
  681   1HG2  THR   8          1HG2      THR   8  51.158 -62.700  11.827
  682   2HG2  THR   8          2HG2      THR   8  52.130 -64.153  12.080
  683   3HG2  THR   8          3HG2      THR   8  50.369 -64.243  12.163
  684    H    SER   9           H        SER   9  47.842 -62.674   8.374
  685    HA   SER   9           HA       SER   9  47.556 -60.996   6.869
  686   1HB   SER   9          1HB       SER   9  49.861 -59.458   7.993
  687   2HB   SER   9          2HB       SER   9  48.239 -58.902   7.565
  688    HG   SER   9           HG       SER   9  47.618 -60.354   9.454
  689    H    VAL  10           H        VAL  10  49.000 -63.076   5.912
  690    HA   VAL  10           HA       VAL  10  51.168 -61.830   4.363
  691    HB   VAL  10           HB       VAL  10  51.786 -63.614   6.087
  692   1HG1  VAL  10          1HG1      VAL  10  49.849 -65.086   4.627
  693   2HG1  VAL  10          2HG1      VAL  10  50.789 -65.590   6.034
  694   3HG1  VAL  10          3HG1      VAL  10  51.418 -65.866   4.407
  695   1HG2  VAL  10          1HG2      VAL  10  52.763 -63.109   3.474
  696   2HG2  VAL  10          2HG2      VAL  10  52.938 -64.832   3.807
  697   3HG2  VAL  10          3HG2      VAL  10  53.649 -63.646   4.901
  698    H    LYS  11           H        LYS  11  51.445 -62.465   2.215
  699    HA   LYS  11           HA       LYS  11  50.895 -63.119   0.128
  700   1HB   LYS  11          1HB       LYS  11  49.462 -65.076   1.743
  701   2HB   LYS  11          2HB       LYS  11  48.676 -64.758   0.202
  702   1HG   LYS  11          1HG       LYS  11  50.067 -66.411  -0.464
  703   2HG   LYS  11          2HG       LYS  11  51.167 -65.050  -0.682
  704   1HD   LYS  11          1HD       LYS  11  51.758 -65.554   1.835
  705   2HD   LYS  11          2HD       LYS  11  51.139 -67.156   1.425
  706   1HE   LYS  11          1HE       LYS  11  53.227 -65.749  -0.223
  707   2HE   LYS  11          2HE       LYS  11  53.636 -66.786   1.143
  708   1HZ   LYS  11          1HZ       LYS  11  51.936 -68.328  -0.285
  709   2HZ   LYS  11          2HZ       LYS  11  53.627 -68.411  -0.366
  710   3HZ   LYS  11          3HZ       LYS  11  52.769 -67.501  -1.509
  711    H    LYS  12           H        LYS  12  47.917 -62.674   2.021
  712    HA   LYS  12           HA       LYS  12  47.196 -60.455   0.384
  713   1HB   LYS  12          1HB       LYS  12  46.339 -62.786  -0.631
  714   2HB   LYS  12          2HB       LYS  12  45.031 -62.480   0.503
  715   1HG   LYS  12          1HG       LYS  12  44.358 -61.593  -1.580
  716   2HG   LYS  12          2HG       LYS  12  44.774 -60.218  -0.557
  717   1HD   LYS  12          1HD       LYS  12  47.153 -60.898  -1.827
  718   2HD   LYS  12          2HD       LYS  12  45.919 -61.063  -3.077
  719   1HE   LYS  12          1HE       LYS  12  45.531 -58.853  -3.165
  720   2HE   LYS  12          2HE       LYS  12  45.660 -58.661  -1.418
  721   1HZ   LYS  12          1HZ       LYS  12  47.582 -57.654  -1.879
  722   2HZ   LYS  12          2HZ       LYS  12  47.645 -58.268  -3.459
  723   3HZ   LYS  12          3HZ       LYS  12  48.206 -59.205  -2.168
  724    H    MET  13           H        MET  13  45.728 -59.108   1.341
  725    HA   MET  13           HA       MET  13  44.811 -59.896   4.030
  726   1HB   MET  13          1HB       MET  13  46.662 -58.026   3.647
  727   2HB   MET  13          2HB       MET  13  45.254 -57.027   3.313
  728   1HG   MET  13          1HG       MET  13  44.612 -58.347   5.666
  729   2HG   MET  13          2HG       MET  13  46.319 -57.946   5.838
  730   1HE   MET  13          1HE       MET  13  44.933 -56.602   8.025
  731   2HE   MET  13          2HE       MET  13  43.373 -56.892   7.253
  732   3HE   MET  13          3HE       MET  13  43.848 -55.251   7.693
  733    H    THR  14           H        THR  14  43.132 -57.783   4.548
  734    HA   THR  14           HA       THR  14  40.893 -58.341   2.836
  735    HB   THR  14           HB       THR  14  40.189 -56.220   4.451
  736    HG1  THR  14           HG1      THR  14  41.615 -58.006   6.126
  737   1HG2  THR  14          1HG2      THR  14  39.983 -59.156   5.102
  738   2HG2  THR  14          2HG2      THR  14  38.904 -58.283   4.014
  739   3HG2  THR  14          3HG2      THR  14  38.956 -57.868   5.728
  740    H    PHE  15           H        PHE  15  40.404 -57.263   1.045
  741    HA   PHE  15           HA       PHE  15  42.031 -55.045   0.228
  742   1HB   PHE  15          1HB       PHE  15  41.151 -55.362  -1.898
  743   2HB   PHE  15          2HB       PHE  15  41.000 -56.970  -1.206
  744    HD1  PHE  15           HD1      PHE  15  39.365 -54.594  -3.101
  745    HD2  PHE  15           HD2      PHE  15  38.659 -57.293   0.112
  746    HE1  PHE  15           HE1      PHE  15  36.964 -54.584  -3.625
  747    HE2  PHE  15           HE2      PHE  15  36.255 -57.291  -0.410
  748    HZ   PHE  15           HZ       PHE  15  35.406 -55.935  -2.282
  749    H    GLY  16           H        GLY  16  39.332 -55.209   2.117
  750   1HA   GLY  16          1HA       GLY  16  38.477 -53.081   3.020
  751   2HA   GLY  16          2HA       GLY  16  38.477 -52.489   1.362
  752    H    GLU  17           H        GLU  17  37.178 -55.118   3.350
  753    HA   GLU  17           HA       GLU  17  35.062 -55.672   1.504
  754   1HB   GLU  17          1HB       GLU  17  36.196 -56.879   3.855
  755   2HB   GLU  17          2HB       GLU  17  34.445 -56.817   4.006
  756   1HG   GLU  17          1HG       GLU  17  34.151 -58.424   2.495
  757   2HG   GLU  17          2HG       GLU  17  35.314 -57.707   1.381
  758    H    ASN  18           H        ASN  18  35.389 -53.015   3.134
  759    HA   ASN  18           HA       ASN  18  32.928 -52.757   4.558
  760   1HB   ASN  18          1HB       ASN  18  33.480 -50.210   4.135
  761   2HB   ASN  18          2HB       ASN  18  34.416 -51.153   5.289
  762   1HD2  ASN  18          1HD2      ASN  18  36.518 -50.856   5.149
  763   2HD2  ASN  18          2HD2      ASN  18  37.401 -50.447   3.710
  764    H    ARG  19           H        ARG  19  34.041 -51.354   1.495
  765    HA   ARG  19           HA       ARG  19  32.979 -50.786  -0.422
  766   1HB   ARG  19          1HB       ARG  19  31.800 -53.266   0.428
  767   2HB   ARG  19          2HB       ARG  19  30.576 -52.274  -0.353
  768   1HG   ARG  19          1HG       ARG  19  31.646 -53.731  -1.955
  769   2HG   ARG  19          2HG       ARG  19  32.024 -52.045  -2.314
  770   1HD   ARG  19          1HD       ARG  19  34.062 -52.799  -0.626
  771   2HD   ARG  19          2HD       ARG  19  33.786 -54.252  -1.591
  772    HE   ARG  19           HE       ARG  19  33.960 -52.605  -3.554
  773   1HH1  ARG  19          1HH1      ARG  19  35.828 -52.439  -0.588
  774   2HH1  ARG  19          2HH1      ARG  19  37.102 -51.494  -1.298
  775   1HH2  ARG  19          1HH2      ARG  19  35.640 -51.417  -4.496
  776   2HH2  ARG  19          2HH2      ARG  19  37.011 -50.938  -3.532
  777    H    ASP  20           H        ASP  20  32.626 -48.692   0.518
  778    HA   ASP  20           HA       ASP  20  30.044 -48.116   1.689
  779   1HB   ASP  20          1HB       ASP  20  31.908 -46.836   2.522
  780   2HB   ASP  20          2HB       ASP  20  32.347 -46.324   0.894
  781    H    LEU  21           H        LEU  21  28.344 -48.137   0.401
  782    HA   LEU  21           HA       LEU  21  28.550 -46.777  -2.209
  783   1HB   LEU  21          1HB       LEU  21  27.397 -49.422  -1.467
  784   2HB   LEU  21          2HB       LEU  21  26.550 -48.479  -2.679
  785    HG   LEU  21           HG       LEU  21  29.138 -48.374  -3.588
  786   1HD1  LEU  21          1HD1      LEU  21  30.093 -49.919  -2.125
  787   2HD1  LEU  21          2HD1      LEU  21  29.749 -50.859  -3.576
  788   3HD1  LEU  21          3HD1      LEU  21  28.687 -50.980  -2.176
  789   1HD2  LEU  21          1HD2      LEU  21  28.382 -49.980  -5.273
  790   2HD2  LEU  21          2HD2      LEU  21  27.144 -48.772  -4.927
  791   3HD2  LEU  21          3HD2      LEU  21  27.004 -50.397  -4.257
  792    H    GLU  22           H        GLU  22  27.585 -46.132   0.641
  793    HA   GLU  22           HA       GLU  22  24.831 -45.889   0.748
  794   1HB   GLU  22          1HB       GLU  22  26.948 -44.096   1.936
  795   2HB   GLU  22          2HB       GLU  22  25.246 -44.040   2.368
  796   1HG   GLU  22          1HG       GLU  22  27.089 -46.388   2.739
  797   2HG   GLU  22          2HG       GLU  22  26.528 -45.293   4.002
  798    H    ARG  23           H        ARG  23  23.355 -44.476   0.034
  799    HA   ARG  23           HA       ARG  23  24.273 -42.191  -1.581
  800   1HB   ARG  23          1HB       ARG  23  22.825 -44.552  -2.459
  801   2HB   ARG  23          2HB       ARG  23  21.914 -43.083  -2.782
  802   1HG   ARG  23          1HG       ARG  23  24.617 -42.644  -3.535
  803   2HG   ARG  23          2HG       ARG  23  24.075 -44.171  -4.235
  804   1HD   ARG  23          1HD       ARG  23  22.822 -41.452  -4.547
  805   2HD   ARG  23          2HD       ARG  23  23.572 -42.445  -5.796
  806    HE   ARG  23           HE       ARG  23  21.659 -44.064  -5.225
  807   1HH1  ARG  23          1HH1      ARG  23  21.396 -40.567  -5.094
  808   2HH1  ARG  23          2HH1      ARG  23  19.701 -40.564  -5.494
  809   1HH2  ARG  23          1HH2      ARG  23  19.456 -44.061  -5.718
  810   2HH2  ARG  23          2HH2      ARG  23  18.589 -42.554  -5.829
  811    H    VAL  24           H        VAL  24  23.199 -40.340  -1.202
  812    HA   VAL  24           HA       VAL  24  20.736 -40.490   0.419
  813    HB   VAL  24           HB       VAL  24  22.712 -38.209   0.525
  814   1HG1  VAL  24          1HG1      VAL  24  20.804 -38.891   2.703
  815   2HG1  VAL  24          2HG1      VAL  24  20.178 -38.113   1.249
  816   3HG1  VAL  24          3HG1      VAL  24  21.434 -37.321   2.203
  817   1HG2  VAL  24          1HG2      VAL  24  22.684 -40.778   2.019
  818   2HG2  VAL  24          2HG2      VAL  24  23.106 -39.308   2.897
  819   3HG2  VAL  24          3HG2      VAL  24  24.048 -39.793   1.485
  820    H    VAL  25           H        VAL  25  18.998 -39.497  -0.421
  821    HA   VAL  25           HA       VAL  25  19.322 -38.061  -2.939
  822    HB   VAL  25           HB       VAL  25  16.706 -38.656  -1.560
  823   1HG1  VAL  25          1HG1      VAL  25  17.361 -37.272  -3.888
  824   2HG1  VAL  25          2HG1      VAL  25  15.763 -37.827  -3.395
  825   3HG1  VAL  25          3HG1      VAL  25  16.762 -38.836  -4.437
  826   1HG2  VAL  25          1HG2      VAL  25  16.942 -40.836  -1.906
  827   2HG2  VAL  25          2HG2      VAL  25  18.580 -40.568  -2.500
  828   3HG2  VAL  25          3HG2      VAL  25  17.220 -40.542  -3.622
  829    H    THR  26           H        THR  26  19.566 -35.908  -2.911
  830    HA   THR  26           HA       THR  26  18.112 -34.362  -0.879
  831    HB   THR  26           HB       THR  26  20.753 -33.256  -1.459
  832    HG1  THR  26           HG1      THR  26  20.493 -35.878  -0.440
  833   1HG2  THR  26          1HG2      THR  26  19.116 -32.556   0.336
  834   2HG2  THR  26          2HG2      THR  26  20.769 -32.832   0.883
  835   3HG2  THR  26          3HG2      THR  26  19.529 -34.051   1.180
  836    H    ALA  27           H        ALA  27  16.675 -33.640  -2.437
  837    HA   ALA  27           HA       ALA  27  17.802 -31.952  -4.573
  838   1HB   ALA  27          1HB       ALA  27  15.369 -32.065  -5.428
  839   2HB   ALA  27          2HB       ALA  27  15.202 -33.424  -4.317
  840   3HB   ALA  27          3HB       ALA  27  16.393 -33.489  -5.617
  841    HA   PRO  28           HA       PRO  28  16.417 -28.785  -1.697
  842   1HB   PRO  28          1HB       PRO  28  17.813 -26.746  -2.789
  843   2HB   PRO  28          2HB       PRO  28  18.574 -27.982  -1.781
  844   1HG   PRO  28          1HG       PRO  28  18.498 -27.749  -4.763
  845   2HG   PRO  28          2HG       PRO  28  19.858 -28.179  -3.710
  846   1HD   PRO  28          1HD       PRO  28  18.389 -30.026  -5.060
  847   2HD   PRO  28          2HD       PRO  28  19.174 -30.363  -3.506
  848    H    VAL  29           H        VAL  29  15.003 -27.054  -1.754
  849    HA   VAL  29           HA       VAL  29  14.002 -26.170  -4.362
  850    HB   VAL  29           HB       VAL  29  11.658 -26.159  -3.116
  851   1HG1  VAL  29          1HG1      VAL  29  11.252 -28.457  -4.129
  852   2HG1  VAL  29          2HG1      VAL  29  12.959 -28.439  -4.574
  853   3HG1  VAL  29          3HG1      VAL  29  11.867 -27.206  -5.209
  854   1HG2  VAL  29          1HG2      VAL  29  12.470 -27.086  -1.022
  855   2HG2  VAL  29          2HG2      VAL  29  13.084 -28.506  -1.869
  856   3HG2  VAL  29          3HG2      VAL  29  11.348 -28.210  -1.794
  857    H    SER  30           H        SER  30  13.265 -24.051  -4.398
  858    HA   SER  30           HA       SER  30  13.576 -22.541  -1.889
  859   1HB   SER  30          1HB       SER  30  14.396 -20.865  -4.011
  860   2HB   SER  30          2HB       SER  30  15.403 -21.556  -2.738
  861    HG   SER  30           HG       SER  30  16.017 -23.165  -4.053
  862    H    SER  31           H        SER  31  12.500 -20.471  -1.840
  863    HA   SER  31           HA       SER  31   9.889 -20.537  -2.960
  864   1HB   SER  31          1HB       SER  31  10.400 -17.930  -2.033
  865   2HB   SER  31          2HB       SER  31   9.615 -19.236  -1.142
  866    HG   SER  31           HG       SER  31  12.207 -18.242  -0.952
  867    H    GLY  32           H        GLY  32   9.093 -19.579  -4.783
  868   1HA   GLY  32          1HA       GLY  32  10.786 -17.630  -6.182
  869   2HA   GLY  32          2HA       GLY  32  10.383 -19.122  -7.015
  870    H    LYS  33           H        LYS  33   9.140 -16.122  -5.731
  871    HA   LYS  33           HA       LYS  33   7.262 -15.885  -7.834
  872   1HB   LYS  33          1HB       LYS  33   6.198 -17.423  -5.903
  873   2HB   LYS  33          2HB       LYS  33   5.813 -15.840  -5.239
  874   1HG   LYS  33          1HG       LYS  33   3.942 -16.567  -6.519
  875   2HG   LYS  33          2HG       LYS  33   4.739 -15.276  -7.421
  876   1HD   LYS  33          1HD       LYS  33   5.974 -17.128  -8.661
  877   2HD   LYS  33          2HD       LYS  33   4.799 -18.234  -7.947
  878   1HE   LYS  33          1HE       LYS  33   2.993 -16.809  -8.938
  879   2HE   LYS  33          2HE       LYS  33   4.247 -15.912  -9.791
  880   1HZ   LYS  33          1HZ       LYS  33   4.654 -17.631 -11.201
  881   2HZ   LYS  33          2HZ       LYS  33   3.021 -17.958 -10.872
  882   3HZ   LYS  33          3HZ       LYS  33   4.235 -18.823 -10.066
  883    H    ILE  34           H        ILE  34   6.142 -13.797  -7.760
  884    HA   ILE  34           HA       ILE  34   7.576 -11.893  -6.031
  885    HB   ILE  34           HB       ILE  34   6.701 -10.214  -7.852
  886   1HG1  ILE  34          1HG1      ILE  34   7.240 -12.368  -9.799
  887   2HG1  ILE  34          2HG1      ILE  34   5.692 -12.491  -8.966
  888   1HG2  ILE  34          1HG2      ILE  34   9.112 -11.739  -7.485
  889   2HG2  ILE  34          2HG2      ILE  34   8.909 -10.049  -7.946
  890   3HG2  ILE  34          3HG2      ILE  34   8.892 -11.309  -9.182
  891   1HD1  ILE  34          1HD1      ILE  34   6.685 -10.158 -10.584
  892   2HD1  ILE  34          2HD1      ILE  34   5.171 -10.188  -9.679
  893   3HD1  ILE  34          3HD1      ILE  34   5.413 -11.295 -11.030
  894    H    LYS  35           H        LYS  35   6.471 -10.373  -4.928
  895    HA   LYS  35           HA       LYS  35   3.562 -10.801  -4.741
  896   1HB   LYS  35          1HB       LYS  35   5.101  -9.471  -2.562
  897   2HB   LYS  35          2HB       LYS  35   3.708 -10.538  -2.456
  898   1HG   LYS  35          1HG       LYS  35   6.465 -11.480  -3.209
  899   2HG   LYS  35          2HG       LYS  35   5.849 -11.471  -1.554
  900   1HD   LYS  35          1HD       LYS  35   4.232 -12.796  -3.682
  901   2HD   LYS  35          2HD       LYS  35   5.667 -13.622  -3.066
  902   1HE   LYS  35          1HE       LYS  35   4.691 -13.123  -0.738
  903   2HE   LYS  35          2HE       LYS  35   3.183 -12.807  -1.598
  904   1HZ   LYS  35          1HZ       LYS  35   4.680 -15.343  -1.371
  905   2HZ   LYS  35          2HZ       LYS  35   3.570 -15.094  -2.630
  906   3HZ   LYS  35          3HZ       LYS  35   3.049 -15.034  -1.019
  907    H    ARG  36           H        ARG  36   2.180  -8.994  -4.489
  908    HA   ARG  36           HA       ARG  36   3.313  -6.580  -5.713
  909   1HB   ARG  36          1HB       ARG  36   0.853  -8.067  -6.020
  910   2HB   ARG  36          2HB       ARG  36   0.526  -6.369  -5.704
  911   1HG   ARG  36          1HG       ARG  36   0.693  -6.973  -8.112
  912   2HG   ARG  36          2HG       ARG  36   1.786  -5.688  -7.594
  913   1HD   ARG  36          1HD       ARG  36   3.340  -6.899  -8.675
  914   2HD   ARG  36          2HD       ARG  36   3.343  -7.867  -7.202
  915    HE   ARG  36           HE       ARG  36   1.856  -9.428  -8.311
  916   1HH1  ARG  36          1HH1      ARG  36   3.357  -7.020 -10.357
  917   2HH1  ARG  36          2HH1      ARG  36   3.282  -7.992 -11.799
  918   1HH2  ARG  36          1HH2      ARG  36   1.750 -10.731 -10.200
  919   2HH2  ARG  36          2HH2      ARG  36   2.373 -10.113 -11.705
  920    H    VAL  37           H        VAL  37   3.462  -4.723  -4.687
  921    HA   VAL  37           HA       VAL  37   1.775  -4.262  -2.312
  922    HB   VAL  37           HB       VAL  37   4.633  -3.307  -2.523
  923   1HG1  VAL  37          1HG1      VAL  37   3.877  -1.952  -0.906
  924   2HG1  VAL  37          2HG1      VAL  37   3.947  -3.386   0.119
  925   3HG1  VAL  37          3HG1      VAL  37   2.426  -2.921  -0.643
  926   1HG2  VAL  37          1HG2      VAL  37   5.375  -5.299  -1.879
  927   2HG2  VAL  37          2HG2      VAL  37   3.736  -5.939  -1.977
  928   3HG2  VAL  37          3HG2      VAL  37   4.319  -5.245  -0.468
  929    H    ASN  38           H        ASN  38   0.693  -2.389  -2.383
  930    HA   ASN  38           HA       ASN  38   1.416  -0.466  -4.489
  931   1HB   ASN  38          1HB       ASN  38  -0.780  -0.919  -4.977
  932   2HB   ASN  38          2HB       ASN  38  -1.169  -1.354  -3.318
  933   1HD2  ASN  38          1HD2      ASN  38  -0.585   1.362  -5.480
  934   2HD2  ASN  38          2HD2      ASN  38  -1.509   2.510  -4.571
  935    H    VAL  39           H        VAL  39   2.361   1.342  -3.857
  936    HA   VAL  39           HA       VAL  39   1.884   2.287  -1.105
  937    HB   VAL  39           HB       VAL  39   4.467   3.069  -2.226
  938   1HG1  VAL  39          1HG1      VAL  39   3.381   2.022   0.351
  939   2HG1  VAL  39          2HG1      VAL  39   4.232   3.529   0.015
  940   3HG1  VAL  39          3HG1      VAL  39   5.122   2.007   0.069
  941   1HG2  VAL  39          1HG2      VAL  39   5.291   0.625  -1.479
  942   2HG2  VAL  39          2HG2      VAL  39   4.940   1.059  -3.153
  943   3HG2  VAL  39          3HG2      VAL  39   3.731   0.204  -2.190
  944    H    ASN  40           H        ASN  40   2.410   4.608  -0.818
  945    HA   ASN  40           HA       ASN  40   2.002   6.161  -3.273
  946   1HB   ASN  40          1HB       ASN  40   0.562   7.731  -1.918
  947   2HB   ASN  40          2HB       ASN  40  -0.154   6.158  -2.244
  948   1HD2  ASN  40          1HD2      ASN  40  -0.288   4.635  -0.549
  949   2HD2  ASN  40          2HD2      ASN  40  -0.230   5.139   1.113
  950    H    PHE  41           H        PHE  41   3.574   7.533  -3.579
  951    HA   PHE  41           HA       PHE  41   5.049   8.549  -1.237
  952   1HB   PHE  41          1HB       PHE  41   6.250   8.326  -3.988
  953   2HB   PHE  41          2HB       PHE  41   7.073   8.500  -2.444
  954    HD1  PHE  41           HD1      PHE  41   6.069   6.245  -4.969
  955    HD2  PHE  41           HD2      PHE  41   6.827   6.526  -0.792
  956    HE1  PHE  41           HE1      PHE  41   6.361   3.804  -4.861
  957    HE2  PHE  41           HE2      PHE  41   7.120   4.086  -0.676
  958    HZ   PHE  41           HZ       PHE  41   6.962   2.730  -2.749
  959    H    ASP  42           H        ASP  42   5.517  10.711  -1.166
  960    HA   ASP  42           HA       ASP  42   3.886  12.531  -2.580
  961   1HB   ASP  42          1HB       ASP  42   4.887  13.023  -0.380
  962   2HB   ASP  42          2HB       ASP  42   6.481  13.043  -1.118
  963    H    GLU  43           H        GLU  43   4.476  14.088  -4.154
  964    HA   GLU  43           HA       GLU  43   5.837  13.030  -6.336
  965   1HB   GLU  43          1HB       GLU  43   4.385  15.429  -5.728
  966   2HB   GLU  43          2HB       GLU  43   5.820  15.828  -6.665
  967   1HG   GLU  43          1HG       GLU  43   3.869  13.689  -7.465
  968   2HG   GLU  43          2HG       GLU  43   3.752  15.365  -7.998
  969    H    GLU  44           H        GLU  44   7.015  14.962  -3.697
  970    HA   GLU  44           HA       GLU  44   9.516  15.742  -4.807
  971   1HB   GLU  44          1HB       GLU  44   8.236  16.248  -2.473
  972   2HB   GLU  44          2HB       GLU  44   9.385  15.029  -1.938
  973   1HG   GLU  44          1HG       GLU  44  10.524  17.160  -3.602
  974   2HG   GLU  44          2HG       GLU  44   9.896  17.682  -2.039
  975    H    LYS  45           H        LYS  45   8.586  13.070  -2.689
  976    HA   LYS  45           HA       LYS  45  10.997  11.652  -2.712
  977   1HB   LYS  45          1HB       LYS  45   8.904  11.381  -1.230
  978   2HB   LYS  45          2HB       LYS  45   8.277  10.368  -2.522
  979   1HG   LYS  45          1HG       LYS  45  10.330   8.952  -2.280
  980   2HG   LYS  45          2HG       LYS  45  10.724   9.896  -0.840
  981   1HD   LYS  45          1HD       LYS  45   8.052   9.169  -0.518
  982   2HD   LYS  45          2HD       LYS  45   8.838   7.730  -1.166
  983   1HE   LYS  45          1HE       LYS  45   9.793   7.311   0.792
  984   2HE   LYS  45          2HE       LYS  45  10.494   8.928   0.843
  985   1HZ   LYS  45          1HZ       LYS  45   8.273   9.702   1.669
  986   2HZ   LYS  45          2HZ       LYS  45   9.137   8.710   2.741
  987   3HZ   LYS  45          3HZ       LYS  45   7.841   8.069   1.850
  988    H    HIS  46           H        HIS  46   8.272  11.683  -4.899
  989    HA   HIS  46           HA       HIS  46   9.014   9.398  -6.418
  990   1HB   HIS  46          1HB       HIS  46   6.723  10.299  -6.411
  991   2HB   HIS  46          2HB       HIS  46   7.293  11.760  -7.208
  992    HD1  HIS  46           HD1      HIS  46   6.421  11.687  -9.512
  993    HD2  HIS  46           HD2      HIS  46   7.865   7.979  -8.281
  994    HE1  HIS  46           HE1      HIS  46   6.300  10.199 -11.540
  995    HE2  HIS  46           HE2      HIS  46   7.030   7.918 -10.736
  996    H    THR  47           H        THR  47   9.571  12.877  -6.859
  997    HA   THR  47           HA       THR  47  10.973  12.684  -9.311
  998    HB   THR  47           HB       THR  47  11.380  14.807  -7.193
  999    HG1  THR  47           HG1      THR  47   9.195  14.811  -7.545
 1000   1HG2  THR  47          1HG2      THR  47  11.863  14.643 -10.150
 1001   2HG2  THR  47          2HG2      THR  47  12.964  15.163  -8.871
 1002   3HG2  THR  47          3HG2      THR  47  11.615  16.197  -9.356
 1003    H    ARG  48           H        ARG  48  11.963  12.560  -5.940
 1004    HA   ARG  48           HA       ARG  48  14.762  12.448  -6.356
 1005   1HB   ARG  48          1HB       ARG  48  12.943  12.277  -4.165
 1006   2HB   ARG  48          2HB       ARG  48  14.038  10.904  -4.077
 1007   1HG   ARG  48          1HG       ARG  48  15.949  12.402  -4.140
 1008   2HG   ARG  48          2HG       ARG  48  14.864  13.791  -4.269
 1009   1HD   ARG  48          1HD       ARG  48  14.159  12.088  -2.041
 1010   2HD   ARG  48          2HD       ARG  48  15.832  12.634  -1.932
 1011    HE   ARG  48           HE       ARG  48  13.448  14.373  -2.041
 1012   1HH1  ARG  48          1HH1      ARG  48  16.869  13.899  -1.390
 1013   2HH1  ARG  48          2HH1      ARG  48  17.052  15.436  -0.596
 1014   1HH2  ARG  48          1HH2      ARG  48  13.687  16.382  -0.991
 1015   2HH2  ARG  48          2HH2      ARG  48  15.245  16.851  -0.362
 1016    H    PHE  49           H        PHE  49  12.267   9.962  -6.036
 1017    HA   PHE  49           HA       PHE  49  13.947   7.726  -6.183
 1018   1HB   PHE  49          1HB       PHE  49  11.218   8.165  -5.910
 1019   2HB   PHE  49          2HB       PHE  49  11.359   7.305  -7.441
 1020    HD1  PHE  49           HD1      PHE  49   9.996   5.568  -6.201
 1021    HD2  PHE  49           HD2      PHE  49  13.993   6.569  -5.143
 1022    HE1  PHE  49           HE1      PHE  49  10.197   3.447  -4.975
 1023    HE2  PHE  49           HE2      PHE  49  14.208   4.442  -3.925
 1024    HZ   PHE  49           HZ       PHE  49  12.305   2.881  -3.837
 1025    H    LYS  50           H        LYS  50  12.370   9.626  -8.702
 1026    HA   LYS  50           HA       LYS  50  13.013   7.967 -10.881
 1027   1HB   LYS  50          1HB       LYS  50  12.353  10.880 -10.599
 1028   2HB   LYS  50          2HB       LYS  50  12.856  10.237 -12.156
 1029   1HG   LYS  50          1HG       LYS  50  10.614   8.996 -10.604
 1030   2HG   LYS  50          2HG       LYS  50  10.352  10.381 -11.667
 1031   1HD   LYS  50          1HD       LYS  50  11.742   8.813 -13.331
 1032   2HD   LYS  50          2HD       LYS  50  10.998   7.569 -12.325
 1033   1HE   LYS  50          1HE       LYS  50   8.929   7.979 -13.123
 1034   2HE   LYS  50          2HE       LYS  50   9.196   9.720 -13.212
 1035   1HZ   LYS  50          1HZ       LYS  50   8.920   8.404 -15.375
 1036   2HZ   LYS  50          2HZ       LYS  50  10.512   7.891 -15.113
 1037   3HZ   LYS  50          3HZ       LYS  50  10.174   9.543 -15.290
 1038    H    ALA  51           H        ALA  51  14.755  10.605  -9.314
 1039    HA   ALA  51           HA       ALA  51  16.953  10.594 -11.137
 1040   1HB   ALA  51          1HB       ALA  51  17.414  12.475 -10.046
 1041   2HB   ALA  51          2HB       ALA  51  17.783  11.547  -8.594
 1042   3HB   ALA  51          3HB       ALA  51  16.141  12.119  -8.881
 1043    H    ALA  52           H        ALA  52  16.235   9.019  -8.069
 1044    HA   ALA  52           HA       ALA  52  18.769   7.948  -7.567
 1045   1HB   ALA  52          1HB       ALA  52  16.843   8.093  -5.962
 1046   2HB   ALA  52          2HB       ALA  52  17.728   6.567  -5.945
 1047   3HB   ALA  52          3HB       ALA  52  16.167   6.673  -6.759
 1048    H    CYS  53           H        CYS  53  15.953   6.396  -9.152
 1049    HA   CYS  53           HA       CYS  53  17.314   3.967  -9.674
 1050   1HB   CYS  53          1HB       CYS  53  15.475   3.608 -11.386
 1051   2HB   CYS  53          2HB       CYS  53  14.953   3.864  -9.726
 1052    HG   CYS  53           HG       CYS  53  13.962   6.356 -10.061
 1053    H    ALA  54           H        ALA  54  17.001   6.976 -11.473
 1054    HA   ALA  54           HA       ALA  54  18.171   6.040 -13.892
 1055   1HB   ALA  54          1HB       ALA  54  18.760   8.720 -13.808
 1056   2HB   ALA  54          2HB       ALA  54  17.335   8.602 -12.773
 1057   3HB   ALA  54          3HB       ALA  54  17.268   8.017 -14.435
 1058    H    ARG  55           H        ARG  55  19.456   7.543 -10.963
 1059    HA   ARG  55           HA       ARG  55  22.133   7.809 -11.847
 1060   1HB   ARG  55          1HB       ARG  55  20.635   8.302  -9.468
 1061   2HB   ARG  55          2HB       ARG  55  22.065   7.375  -9.031
 1062   1HG   ARG  55          1HG       ARG  55  23.017   9.400  -8.920
 1063   2HG   ARG  55          2HG       ARG  55  23.161   9.212 -10.669
 1064   1HD   ARG  55          1HD       ARG  55  21.943  11.052 -10.917
 1065   2HD   ARG  55          2HD       ARG  55  20.577  10.192 -10.208
 1066    HE   ARG  55           HE       ARG  55  21.399  11.019  -8.012
 1067   1HH1  ARG  55          1HH1      ARG  55  22.298  12.684 -10.963
 1068   2HH1  ARG  55          2HH1      ARG  55  22.530  14.223 -10.180
 1069   1HH2  ARG  55          1HH2      ARG  55  21.695  13.038  -6.980
 1070   2HH2  ARG  55          2HH2      ARG  55  22.183  14.426  -7.915
 1071    H    LYS  56           H        LYS  56  20.406   5.287 -10.082
 1072    HA   LYS  56           HA       LYS  56  22.702   3.627  -9.742
 1073   1HB   LYS  56          1HB       LYS  56  19.985   3.647  -8.877
 1074   2HB   LYS  56          2HB       LYS  56  20.298   2.090  -9.624
 1075   1HG   LYS  56          1HG       LYS  56  20.742   1.894  -7.294
 1076   2HG   LYS  56          2HG       LYS  56  22.290   1.853  -8.143
 1077   1HD   LYS  56          1HD       LYS  56  22.749   4.129  -7.549
 1078   2HD   LYS  56          2HD       LYS  56  21.120   4.343  -6.904
 1079   1HE   LYS  56          1HE       LYS  56  21.684   3.475  -4.926
 1080   2HE   LYS  56          2HE       LYS  56  22.511   2.110  -5.673
 1081   1HZ   LYS  56          1HZ       LYS  56  23.908   3.675  -4.284
 1082   2HZ   LYS  56          2HZ       LYS  56  23.734   4.801  -5.540
 1083   3HZ   LYS  56          3HZ       LYS  56  24.493   3.317  -5.837
 1084    H    GLY  57           H        GLY  57  20.484   4.185 -12.288
 1085   1HA   GLY  57          1HA       GLY  57  20.544   3.459 -14.470
 1086   2HA   GLY  57          2HA       GLY  57  21.979   2.526 -14.067
 1087    H    THR  58           H        THR  58  18.648   2.402 -12.828
 1088    HA   THR  58           HA       THR  58  18.234  -0.191 -14.035
 1089    HB   THR  58           HB       THR  58  19.573  -0.569 -11.905
 1090    HG1  THR  58           HG1      THR  58  18.519  -2.337 -12.659
 1091   1HG2  THR  58          1HG2      THR  58  18.684  -0.205  -9.816
 1092   2HG2  THR  58          2HG2      THR  58  17.023  -0.198 -10.406
 1093   3HG2  THR  58          3HG2      THR  58  18.062   1.198 -10.687
 1094    H    SER  59           H        SER  59  16.054  -1.105 -13.227
 1095    HA   SER  59           HA       SER  59  14.044   0.817 -13.740
 1096   1HB   SER  59          1HB       SER  59  13.077  -1.624 -12.499
 1097   2HB   SER  59          2HB       SER  59  12.825  -1.028 -14.143
 1098    HG   SER  59           HG       SER  59  14.346  -3.041 -13.380
 1099    H    ILE  60           H        ILE  60  12.407   1.616 -12.375
 1100    HA   ILE  60           HA       ILE  60  13.322   2.393  -9.836
 1101    HB   ILE  60           HB       ILE  60  11.693   3.663 -11.267
 1102   1HG1  ILE  60          1HG1      ILE  60  10.639   3.282  -8.469
 1103   2HG1  ILE  60          2HG1      ILE  60  12.203   4.031  -8.775
 1104   1HG2  ILE  60          1HG2      ILE  60   9.236   2.905 -10.350
 1105   2HG2  ILE  60          2HG2      ILE  60  10.026   1.353 -10.620
 1106   3HG2  ILE  60          3HG2      ILE  60   9.895   2.516 -11.939
 1107   1HD1  ILE  60          1HD1      ILE  60  10.228   5.260 -10.434
 1108   2HD1  ILE  60          2HD1      ILE  60  11.231   5.976  -9.172
 1109   3HD1  ILE  60          3HD1      ILE  60   9.678   5.249  -8.759
 1110    H    THR  61           H        THR  61  11.263  -0.266 -10.840
 1111    HA   THR  61           HA       THR  61  10.252  -0.906  -8.287
 1112    HB   THR  61           HB       THR  61  10.553  -3.271  -9.872
 1113    HG1  THR  61           HG1      THR  61  10.495  -2.467 -11.831
 1114   1HG2  THR  61          1HG2      THR  61   8.166  -3.259  -9.854
 1115   2HG2  THR  61          2HG2      THR  61   8.112  -1.525  -9.555
 1116   3HG2  THR  61          3HG2      THR  61   8.694  -2.617  -8.300
 1117    H    ASP  62           H        ASP  62  13.232  -1.654  -9.940
 1118    HA   ASP  62           HA       ASP  62  14.066  -3.778  -8.261
 1119   1HB   ASP  62          1HB       ASP  62  14.943  -2.867 -10.623
 1120   2HB   ASP  62          2HB       ASP  62  16.121  -2.086  -9.571
 1121    H    VAL  63           H        VAL  63  14.624  -0.276  -8.187
 1122    HA   VAL  63           HA       VAL  63  16.479  -0.409  -6.038
 1123    HB   VAL  63           HB       VAL  63  16.334   1.960  -5.831
 1124   1HG1  VAL  63          1HG1      VAL  63  17.194   2.534  -7.855
 1125   2HG1  VAL  63          2HG1      VAL  63  15.930   1.703  -8.762
 1126   3HG1  VAL  63          3HG1      VAL  63  17.232   0.779  -8.009
 1127   1HG2  VAL  63          1HG2      VAL  63  13.847   1.824  -7.526
 1128   2HG2  VAL  63          2HG2      VAL  63  14.682   3.307  -7.063
 1129   3HG2  VAL  63          3HG2      VAL  63  13.946   2.286  -5.825
 1130    H    VAL  64           H        VAL  64  12.997  -0.341  -6.206
 1131    HA   VAL  64           HA       VAL  64  12.525   0.290  -3.464
 1132    HB   VAL  64           HB       VAL  64  10.759  -1.415  -5.223
 1133   1HG1  VAL  64          1HG1      VAL  64  10.219   0.289  -2.797
 1134   2HG1  VAL  64          2HG1      VAL  64  10.125  -1.468  -2.904
 1135   3HG1  VAL  64          3HG1      VAL  64   8.970  -0.467  -3.784
 1136   1HG2  VAL  64          1HG2      VAL  64   9.596   0.636  -5.845
 1137   2HG2  VAL  64          2HG2      VAL  64  11.275   0.671  -6.380
 1138   3HG2  VAL  64          3HG2      VAL  64  10.784   1.588  -4.955
 1139    H    ASN  65           H        ASN  65  12.989  -2.693  -5.295
 1140    HA   ASN  65           HA       ASN  65  12.667  -4.457  -3.094
 1141   1HB   ASN  65          1HB       ASN  65  12.549  -5.168  -5.477
 1142   2HB   ASN  65          2HB       ASN  65  14.281  -4.887  -5.618
 1143   1HD2  ASN  65          1HD2      ASN  65  15.573  -6.522  -5.245
 1144   2HD2  ASN  65          2HD2      ASN  65  15.156  -7.983  -4.406
 1145    H    GLN  66           H        GLN  66  15.280  -2.454  -4.198
 1146    HA   GLN  66           HA       GLN  66  17.350  -3.836  -2.786
 1147   1HB   GLN  66          1HB       GLN  66  17.441  -2.110  -4.808
 1148   2HB   GLN  66          2HB       GLN  66  17.680  -0.969  -3.488
 1149   1HG   GLN  66          1HG       GLN  66  19.481  -2.680  -2.705
 1150   2HG   GLN  66          2HG       GLN  66  19.414  -3.226  -4.379
 1151   1HE2  GLN  66          1HE2      GLN  66  19.959  -1.755  -6.039
 1152   2HE2  GLN  66          2HE2      GLN  66  21.025  -0.425  -5.711
 1153    H    LEU  67           H        LEU  67  15.369  -0.953  -2.079
 1154    HA   LEU  67           HA       LEU  67  16.747  -0.308   0.316
 1155   1HB   LEU  67          1HB       LEU  67  14.370   0.705   0.908
 1156   2HB   LEU  67          2HB       LEU  67  15.459   1.482  -0.217
 1157    HG   LEU  67           HG       LEU  67  13.918  -0.216  -1.799
 1158   1HD1  LEU  67          1HD1      LEU  67  11.666   0.142  -1.227
 1159   2HD1  LEU  67          2HD1      LEU  67  12.080   1.337   0.001
 1160   3HD1  LEU  67          3HD1      LEU  67  12.445  -0.368   0.270
 1161   1HD2  LEU  67          1HD2      LEU  67  12.782   2.208  -2.145
 1162   2HD2  LEU  67          2HD2      LEU  67  14.339   1.742  -2.826
 1163   3HD2  LEU  67          3HD2      LEU  67  14.273   2.665  -1.325
 1164    H    VAL  68           H        VAL  68  13.929  -2.290  -0.394
 1165    HA   VAL  68           HA       VAL  68  13.366  -3.056   2.278
 1166    HB   VAL  68           HB       VAL  68  12.785  -4.541  -0.292
 1167   1HG1  VAL  68          1HG1      VAL  68  10.842  -5.348   1.309
 1168   2HG1  VAL  68          2HG1      VAL  68  12.047  -5.004   2.551
 1169   3HG1  VAL  68          3HG1      VAL  68  12.406  -6.168   1.271
 1170   1HG2  VAL  68          1HG2      VAL  68  11.395  -2.343   1.162
 1171   2HG2  VAL  68          2HG2      VAL  68  10.433  -3.552   0.311
 1172   3HG2  VAL  68          3HG2      VAL  68  11.616  -2.587  -0.572
 1173    H    ASP  69           H        ASP  69  15.500  -4.277  -0.229
 1174    HA   ASP  69           HA       ASP  69  16.233  -6.733   0.841
 1175   1HB   ASP  69          1HB       ASP  69  16.923  -5.923  -1.401
 1176   2HB   ASP  69          2HB       ASP  69  18.029  -4.783  -0.625
 1177    H    ASN  70           H        ASN  70  17.828  -3.600   1.296
 1178    HA   ASN  70           HA       ASN  70  19.802  -4.509   3.059
 1179   1HB   ASN  70          1HB       ASN  70  18.624  -1.816   2.474
 1180   2HB   ASN  70          2HB       ASN  70  19.767  -2.003   3.800
 1181   1HD2  ASN  70          1HD2      ASN  70  19.326  -2.554   0.353
 1182   2HD2  ASN  70          2HD2      ASN  70  20.997  -2.398  -0.068
 1183    H    TRP  71           H        TRP  71  16.673  -2.994   3.709
 1184    HA   TRP  71           HA       TRP  71  16.798  -3.007   6.512
 1185   1HB   TRP  71          1HB       TRP  71  15.082  -1.751   5.389
 1186   2HB   TRP  71          2HB       TRP  71  14.461  -3.199   4.605
 1187    HD1  TRP  71           HD1      TRP  71  14.501  -1.415   7.989
 1188    HE1  TRP  71           HE1      TRP  71  12.577  -2.326   9.440
 1189    HE3  TRP  71           HE3      TRP  71  12.987  -5.261   4.975
 1190    HZ2  TRP  71           HZ2      TRP  71  10.682  -4.403   9.314
 1191    HZ3  TRP  71           HZ3      TRP  71  11.106  -6.669   5.721
 1192    HH2  TRP  71           HH2      TRP  71   9.978  -6.242   7.845
 1193    H    LEU  72           H        LEU  72  15.387  -5.341   4.262
 1194    HA   LEU  72           HA       LEU  72  14.349  -7.153   6.034
 1195   1HB   LEU  72          1HB       LEU  72  14.517  -6.963   3.357
 1196   2HB   LEU  72          2HB       LEU  72  15.645  -8.281   3.635
 1197    HG   LEU  72           HG       LEU  72  13.419  -8.960   5.156
 1198   1HD1  LEU  72          1HD1      LEU  72  11.631  -8.875   3.375
 1199   2HD1  LEU  72          2HD1      LEU  72  12.628  -7.671   2.563
 1200   3HD1  LEU  72          3HD1      LEU  72  12.003  -7.352   4.179
 1201   1HD2  LEU  72          1HD2      LEU  72  15.005 -10.303   3.650
 1202   2HD2  LEU  72          2HD2      LEU  72  13.875  -9.918   2.353
 1203   3HD2  LEU  72          3HD2      LEU  72  13.324 -10.824   3.760
 1204    H    LYS  73           H        LYS  73  17.598  -7.233   4.597
 1205    HA   LYS  73           HA       LYS  73  18.210  -9.617   6.076
 1206   1HB   LYS  73          1HB       LYS  73  20.123  -7.983   4.422
 1207   2HB   LYS  73          2HB       LYS  73  20.212  -9.699   4.801
 1208   1HG   LYS  73          1HG       LYS  73  18.214 -10.112   3.451
 1209   2HG   LYS  73          2HG       LYS  73  18.095  -8.388   3.095
 1210   1HD   LYS  73          1HD       LYS  73  19.755 -10.448   1.866
 1211   2HD   LYS  73          2HD       LYS  73  19.265  -8.873   1.247
 1212   1HE   LYS  73          1HE       LYS  73  21.311  -8.881   3.382
 1213   2HE   LYS  73          2HE       LYS  73  21.807  -9.517   1.816
 1214   1HZ   LYS  73          1HZ       LYS  73  20.536  -7.252   1.116
 1215   2HZ   LYS  73          2HZ       LYS  73  22.212  -7.381   1.357
 1216   3HZ   LYS  73          3HZ       LYS  73  21.223  -6.802   2.605
 1217    H    GLU  74           H        GLU  74  18.472  -6.308   6.773
 1218    HA   GLU  74           HA       GLU  74  20.651  -6.731   8.688
 1219   1HB   GLU  74          1HB       GLU  74  20.109  -4.590   7.116
 1220   2HB   GLU  74          2HB       GLU  74  19.293  -4.107   8.598
 1221   1HG   GLU  74          1HG       GLU  74  22.051  -5.144   8.861
 1222   2HG   GLU  74          2HG       GLU  74  21.854  -3.567   8.101
 1223    H    ASN  75           H        ASN  75  17.209  -6.016   8.573
 1224    HA   ASN  75           HA       ASN  75  17.047  -5.604  11.414
 1225   1HB   ASN  75          1HB       ASN  75  15.028  -4.673  11.004
 1226   2HB   ASN  75          2HB       ASN  75  15.574  -4.682   9.333
 1227   1HD2  ASN  75          1HD2      ASN  75  14.803  -6.311   7.933
 1228   2HD2  ASN  75          2HD2      ASN  75  13.343  -7.174   8.282
 1229    H    GLU  76           H        GLU  76  16.594  -8.285   9.268
 1230    HA   GLU  76           HA       GLU  76  15.647  -9.890  11.543
 1231   1HB   GLU  76          1HB       GLU  76  14.325  -9.367   9.033
 1232   2HB   GLU  76          2HB       GLU  76  14.664 -11.085   9.196
 1233   1HG   GLU  76          1HG       GLU  76  13.395  -9.572  11.440
 1234   2HG   GLU  76          2HG       GLU  76  12.432 -10.145  10.078
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1 -73.310  56.878 -25.409
    2   2H    MET   1          2H        MET   1 -71.649  56.706 -25.704
    3   3H    MET   1          3H        MET   1 -72.400  58.205 -25.940
    4    HA   MET   1           HA       MET   1 -71.036  57.599 -23.767
    5   1HB   MET   1          1HB       MET   1 -71.902  59.800 -24.388
    6   2HB   MET   1          2HB       MET   1 -73.532  59.304 -23.951
    7   1HG   MET   1          1HG       MET   1 -71.896  58.838 -21.703
    8   2HG   MET   1          2HG       MET   1 -71.500  60.443 -22.316
    9   1HE   MET   1          1HE       MET   1 -73.811  59.437 -19.335
   10   2HE   MET   1          2HE       MET   1 -73.502  58.183 -20.536
   11   3HE   MET   1          3HE       MET   1 -75.132  58.820 -20.328
   12    H    SER   2           H        SER   2 -74.602  57.222 -23.881
   13    HA   SER   2           HA       SER   2 -74.815  56.119 -21.287
   14   1HB   SER   2          1HB       SER   2 -76.791  55.331 -23.369
   15   2HB   SER   2          2HB       SER   2 -77.061  55.946 -21.738
   16    HG   SER   2           HG       SER   2 -76.798  57.989 -22.431
   17    H    LEU   3           H        LEU   3 -74.242  54.735 -24.449
   18    HA   LEU   3           HA       LEU   3 -74.129  52.033 -23.316
   19   1HB   LEU   3          1HB       LEU   3 -74.814  53.061 -25.870
   20   2HB   LEU   3          2HB       LEU   3 -73.322  52.157 -26.062
   21    HG   LEU   3           HG       LEU   3 -75.373  50.758 -24.501
   22   1HD1  LEU   3          1HD1      LEU   3 -75.848  51.530 -27.364
   23   2HD1  LEU   3          2HD1      LEU   3 -76.932  51.720 -25.986
   24   3HD1  LEU   3          3HD1      LEU   3 -76.585  50.112 -26.621
   25   1HD2  LEU   3          1HD2      LEU   3 -73.185  49.840 -25.320
   26   2HD2  LEU   3          2HD2      LEU   3 -73.842  49.925 -26.953
   27   3HD2  LEU   3          3HD2      LEU   3 -74.603  48.883 -25.749
   28    H    GLU   4           H        GLU   4 -72.239  51.078 -22.874
   29    HA   GLU   4           HA       GLU   4 -69.780  52.356 -23.871
   30   1HB   GLU   4          1HB       GLU   4 -70.636  52.140 -21.177
   31   2HB   GLU   4          2HB       GLU   4 -69.309  51.006 -21.384
   32   1HG   GLU   4          1HG       GLU   4 -68.911  53.698 -22.509
   33   2HG   GLU   4          2HG       GLU   4 -68.973  53.577 -20.751
   34    H    LYS   5           H        LYS   5 -67.879  50.699 -23.280
   35    HA   LYS   5           HA       LYS   5 -68.766  48.047 -24.215
   36   1HB   LYS   5          1HB       LYS   5 -66.580  49.814 -25.143
   37   2HB   LYS   5          2HB       LYS   5 -66.146  48.121 -24.948
   38   1HG   LYS   5          1HG       LYS   5 -68.103  47.539 -26.393
   39   2HG   LYS   5          2HG       LYS   5 -68.307  49.265 -26.703
   40   1HD   LYS   5          1HD       LYS   5 -65.591  48.703 -27.149
   41   2HD   LYS   5          2HD       LYS   5 -66.494  47.398 -27.922
   42   1HE   LYS   5          1HE       LYS   5 -67.942  49.236 -28.937
   43   2HE   LYS   5          2HE       LYS   5 -66.686  50.357 -28.414
   44   1HZ   LYS   5          1HZ       LYS   5 -66.184  49.793 -30.625
   45   2HZ   LYS   5          2HZ       LYS   5 -66.455  48.139 -30.366
   46   3HZ   LYS   5          3HZ       LYS   5 -65.096  48.890 -29.686
   47    H    ALA   6           H        ALA   6 -66.900  46.390 -23.672
   48    HA   ALA   6           HA       ALA   6 -66.637  46.367 -20.827
   49   1HB   ALA   6          1HB       ALA   6 -66.595  44.197 -21.351
   50   2HB   ALA   6          2HB       ALA   6 -64.903  44.436 -21.785
   51   3HB   ALA   6          3HB       ALA   6 -66.151  44.532 -23.026
   52    H    HIS   7           H        HIS   7 -65.438  48.086 -20.132
   53    HA   HIS   7           HA       HIS   7 -62.783  48.481 -21.293
   54   1HB   HIS   7          1HB       HIS   7 -64.809  50.212 -20.128
   55   2HB   HIS   7          2HB       HIS   7 -63.221  50.502 -19.425
   56    HD1  HIS   7           HD1      HIS   7 -65.257  51.645 -22.096
   57    HD2  HIS   7           HD2      HIS   7 -61.210  50.753 -21.700
   58    HE1  HIS   7           HE1      HIS   7 -64.105  52.831 -23.987
   59    HE2  HIS   7           HE2      HIS   7 -61.691  52.145 -23.824
   60    H    THR   8           H        THR   8 -63.226  46.249 -19.595
   61    HA   THR   8           HA       THR   8 -61.722  46.964 -17.181
   62    HB   THR   8           HB       THR   8 -62.388  44.179 -17.286
   63    HG1  THR   8           HG1      THR   8 -64.634  44.325 -17.469
   64   1HG2  THR   8          1HG2      THR   8 -62.020  45.431 -15.237
   65   2HG2  THR   8          2HG2      THR   8 -63.646  44.749 -15.238
   66   3HG2  THR   8          3HG2      THR   8 -63.408  46.461 -15.588
   67    H    SER   9           H        SER   9 -59.617  46.499 -17.044
   68    HA   SER   9           HA       SER   9 -58.245  45.493 -19.317
   69   1HB   SER   9          1HB       SER   9 -56.581  45.583 -16.967
   70   2HB   SER   9          2HB       SER   9 -56.566  46.640 -18.381
   71    HG   SER   9           HG       SER   9 -57.626  48.103 -17.295
   72    H    VAL  10           H        VAL  10 -58.114  43.421 -19.840
   73    HA   VAL  10           HA       VAL  10 -58.368  41.350 -17.814
   74    HB   VAL  10           HB       VAL  10 -57.897  40.974 -20.775
   75   1HG1  VAL  10          1HG1      VAL  10 -59.314  39.110 -18.902
   76   2HG1  VAL  10          2HG1      VAL  10 -57.562  39.070 -19.096
   77   3HG1  VAL  10          3HG1      VAL  10 -58.610  38.769 -20.482
   78   1HG2  VAL  10          1HG2      VAL  10 -59.925  42.386 -20.187
   79   2HG2  VAL  10          2HG2      VAL  10 -60.584  40.937 -19.426
   80   3HG2  VAL  10          3HG2      VAL  10 -60.223  40.939 -21.151
   81    H    LYS  11           H        LYS  11 -56.385  41.813 -16.695
   82    HA   LYS  11           HA       LYS  11 -54.076  40.557 -17.974
   83   1HB   LYS  11          1HB       LYS  11 -54.167  43.178 -18.153
   84   2HB   LYS  11          2HB       LYS  11 -53.651  43.110 -16.473
   85   1HG   LYS  11          1HG       LYS  11 -51.773  43.360 -18.040
   86   2HG   LYS  11          2HG       LYS  11 -51.669  41.882 -17.082
   87   1HD   LYS  11          1HD       LYS  11 -52.849  40.768 -19.087
   88   2HD   LYS  11          2HD       LYS  11 -52.360  42.209 -19.978
   89   1HE   LYS  11          1HE       LYS  11 -50.730  40.425 -20.262
   90   2HE   LYS  11          2HE       LYS  11 -50.025  41.783 -19.387
   91   1HZ   LYS  11          1HZ       LYS  11 -49.460  39.585 -18.450
   92   2HZ   LYS  11          2HZ       LYS  11 -51.095  39.340 -18.078
   93   3HZ   LYS  11          3HZ       LYS  11 -50.234  40.603 -17.338
   94    H    LYS  12           H        LYS  12 -53.232  39.112 -16.670
   95    HA   LYS  12           HA       LYS  12 -53.320  39.570 -13.761
   96   1HB   LYS  12          1HB       LYS  12 -54.944  37.793 -14.541
   97   2HB   LYS  12          2HB       LYS  12 -53.556  36.860 -15.086
   98   1HG   LYS  12          1HG       LYS  12 -52.999  36.222 -13.004
   99   2HG   LYS  12          2HG       LYS  12 -53.424  37.782 -12.299
  100   1HD   LYS  12          1HD       LYS  12 -55.788  37.202 -12.410
  101   2HD   LYS  12          2HD       LYS  12 -55.384  35.659 -13.165
  102   1HE   LYS  12          1HE       LYS  12 -53.850  35.831 -10.809
  103   2HE   LYS  12          2HE       LYS  12 -55.482  36.342 -10.383
  104   1HZ   LYS  12          1HZ       LYS  12 -56.367  34.309 -10.965
  105   2HZ   LYS  12          2HZ       LYS  12 -54.882  33.856 -10.288
  106   3HZ   LYS  12          3HZ       LYS  12 -55.064  33.895 -11.971
  107    H    MET  13           H        MET  13 -51.423  39.183 -12.690
  108    HA   MET  13           HA       MET  13 -49.172  38.202 -14.324
  109   1HB   MET  13          1HB       MET  13 -49.209  40.701 -13.922
  110   2HB   MET  13          2HB       MET  13 -48.981  40.352 -12.216
  111   1HG   MET  13          1HG       MET  13 -46.949  40.914 -13.752
  112   2HG   MET  13          2HG       MET  13 -46.815  39.690 -12.493
  113   1HE   MET  13          1HE       MET  13 -45.483  40.416 -15.713
  114   2HE   MET  13          2HE       MET  13 -47.148  40.425 -16.294
  115   3HE   MET  13          3HE       MET  13 -46.021  39.197 -16.870
  116    H    THR  14           H        THR  14 -47.968  36.643 -13.453
  117    HA   THR  14           HA       THR  14 -48.586  35.772 -10.732
  118    HB   THR  14           HB       THR  14 -46.753  34.011 -12.001
  119    HG1  THR  14           HG1      THR  14 -49.027  34.674 -13.604
  120   1HG2  THR  14          1HG2      THR  14 -48.357  33.272 -10.377
  121   2HG2  THR  14          2HG2      THR  14 -48.708  32.459 -11.899
  122   3HG2  THR  14          3HG2      THR  14 -49.698  33.822 -11.384
  123    H    PHE  15           H        PHE  15 -46.650  34.865  -9.494
  124    HA   PHE  15           HA       PHE  15 -44.711  36.981  -9.258
  125   1HB   PHE  15          1HB       PHE  15 -44.934  34.361  -7.756
  126   2HB   PHE  15          2HB       PHE  15 -43.887  35.707  -7.318
  127    HD1  PHE  15           HD1      PHE  15 -45.391  38.043  -7.380
  128    HD2  PHE  15           HD2      PHE  15 -46.715  34.134  -6.349
  129    HE1  PHE  15           HE1      PHE  15 -47.205  39.018  -6.040
  130    HE2  PHE  15           HE2      PHE  15 -48.529  35.103  -4.995
  131    HZ   PHE  15           HZ       PHE  15 -48.774  37.540  -4.830
  132    H    GLY  16           H        GLY  16 -44.783  33.675 -10.408
  133   1HA   GLY  16          1HA       GLY  16 -43.310  32.526 -11.749
  134   2HA   GLY  16          2HA       GLY  16 -42.478  34.048 -12.032
  135    H    GLU  17           H        GLU  17 -42.984  31.867  -9.255
  136    HA   GLU  17           HA       GLU  17 -40.292  32.389  -8.331
  137   1HB   GLU  17          1HB       GLU  17 -42.021  30.263  -7.136
  138   2HB   GLU  17          2HB       GLU  17 -40.908  31.371  -6.347
  139   1HG   GLU  17          1HG       GLU  17 -42.673  32.563  -5.738
  140   2HG   GLU  17          2HG       GLU  17 -42.862  33.013  -7.432
  141    H    ASN  18           H        ASN  18 -38.608  31.331  -9.122
  142    HA   ASN  18           HA       ASN  18 -38.965  28.958 -10.693
  143   1HB   ASN  18          1HB       ASN  18 -37.346  30.638 -11.382
  144   2HB   ASN  18          2HB       ASN  18 -36.455  30.444  -9.877
  145   1HD2  ASN  18          1HD2      ASN  18 -37.423  28.839 -12.844
  146   2HD2  ASN  18          2HD2      ASN  18 -36.113  27.702 -12.876
  147    H    ARG  19           H        ARG  19 -36.533  29.464  -8.160
  148    HA   ARG  19           HA       ARG  19 -35.645  28.088  -6.594
  149   1HB   ARG  19          1HB       ARG  19 -38.560  27.801  -6.357
  150   2HB   ARG  19          2HB       ARG  19 -37.646  26.473  -5.654
  151   1HG   ARG  19          1HG       ARG  19 -36.781  29.234  -4.999
  152   2HG   ARG  19          2HG       ARG  19 -38.275  28.641  -4.272
  153   1HD   ARG  19          1HD       ARG  19 -36.685  28.023  -2.708
  154   2HD   ARG  19          2HD       ARG  19 -36.862  26.556  -3.669
  155    HE   ARG  19           HE       ARG  19 -34.749  28.374  -4.506
  156   1HH1  ARG  19          1HH1      ARG  19 -35.611  25.553  -2.603
  157   2HH1  ARG  19          2HH1      ARG  19 -33.997  24.908  -2.595
  158   1HH2  ARG  19          1HH2      ARG  19 -32.624  27.546  -4.471
  159   2HH2  ARG  19          2HH2      ARG  19 -32.292  26.040  -3.651
  160    H    ASP  20           H        ASP  20 -35.392  27.185  -9.248
  161    HA   ASP  20           HA       ASP  20 -35.334  24.271  -8.816
  162   1HB   ASP  20          1HB       ASP  20 -37.177  24.774 -10.326
  163   2HB   ASP  20          2HB       ASP  20 -36.108  25.718 -11.359
  164    H    LEU  21           H        LEU  21 -33.805  27.119 -10.062
  165    HA   LEU  21           HA       LEU  21 -31.683  25.724 -11.414
  166   1HB   LEU  21          1HB       LEU  21 -32.586  28.465 -11.083
  167   2HB   LEU  21          2HB       LEU  21 -30.843  28.336 -10.960
  168    HG   LEU  21           HG       LEU  21 -31.367  26.839 -13.200
  169   1HD1  LEU  21          1HD1      LEU  21 -33.657  27.409 -13.373
  170   2HD1  LEU  21          2HD1      LEU  21 -32.807  28.370 -14.582
  171   3HD1  LEU  21          3HD1      LEU  21 -33.329  29.115 -13.072
  172   1HD2  LEU  21          1HD2      LEU  21 -30.242  28.529 -14.360
  173   2HD2  LEU  21          2HD2      LEU  21 -29.665  28.679 -12.701
  174   3HD2  LEU  21          3HD2      LEU  21 -30.883  29.797 -13.316
  175    H    GLU  22           H        GLU  22 -31.704  24.617  -8.992
  176    HA   GLU  22           HA       GLU  22 -29.683  25.974  -7.362
  177   1HB   GLU  22          1HB       GLU  22 -31.642  25.220  -6.146
  178   2HB   GLU  22          2HB       GLU  22 -31.447  23.588  -6.771
  179   1HG   GLU  22          1HG       GLU  22 -29.611  23.155  -5.426
  180   2HG   GLU  22          2HG       GLU  22 -29.277  24.865  -5.163
  181    H    ARG  23           H        ARG  23 -27.662  25.270  -7.203
  182    HA   ARG  23           HA       ARG  23 -26.995  22.608  -8.269
  183   1HB   ARG  23          1HB       ARG  23 -26.354  24.924  -9.588
  184   2HB   ARG  23          2HB       ARG  23 -24.923  24.676  -8.599
  185   1HG   ARG  23          1HG       ARG  23 -24.408  23.597 -10.576
  186   2HG   ARG  23          2HG       ARG  23 -24.951  22.281  -9.533
  187   1HD   ARG  23          1HD       ARG  23 -25.903  22.098 -11.775
  188   2HD   ARG  23          2HD       ARG  23 -27.154  22.356 -10.562
  189    HE   ARG  23           HE       ARG  23 -26.158  24.702 -11.994
  190   1HH1  ARG  23          1HH1      ARG  23 -28.686  22.326 -11.521
  191   2HH1  ARG  23          2HH1      ARG  23 -29.884  23.230 -12.402
  192   1HH2  ARG  23          1HH2      ARG  23 -27.717  25.882 -13.199
  193   2HH2  ARG  23          2HH2      ARG  23 -29.317  25.223 -13.412
  194    H    VAL  24           H        VAL  24 -25.984  21.426  -6.782
  195    HA   VAL  24           HA       VAL  24 -24.891  22.793  -4.430
  196    HB   VAL  24           HB       VAL  24 -25.180  19.812  -4.646
  197   1HG1  VAL  24          1HG1      VAL  24 -24.622  19.876  -2.500
  198   2HG1  VAL  24          2HG1      VAL  24 -25.945  20.986  -2.150
  199   3HG1  VAL  24          3HG1      VAL  24 -24.372  21.616  -2.647
  200   1HG2  VAL  24          1HG2      VAL  24 -27.441  21.279  -3.457
  201   2HG2  VAL  24          2HG2      VAL  24 -27.421  19.789  -4.400
  202   3HG2  VAL  24          3HG2      VAL  24 -27.321  21.349  -5.215
  203    H    VAL  25           H        VAL  25 -22.783  22.727  -3.894
  204    HA   VAL  25           HA       VAL  25 -20.993  21.223  -5.693
  205    HB   VAL  25           HB       VAL  25 -20.060  23.576  -4.081
  206   1HG1  VAL  25          1HG1      VAL  25 -18.264  22.450  -5.041
  207   2HG1  VAL  25          2HG1      VAL  25 -18.584  23.752  -6.187
  208   3HG1  VAL  25          3HG1      VAL  25 -19.144  22.115  -6.533
  209   1HG2  VAL  25          1HG2      VAL  25 -22.135  24.110  -5.532
  210   2HG2  VAL  25          2HG2      VAL  25 -21.028  23.931  -6.896
  211   3HG2  VAL  25          3HG2      VAL  25 -20.715  25.150  -5.657
  212    H    THR  26           H        THR  26 -20.617  19.375  -4.620
  213    HA   THR  26           HA       THR  26 -19.611  19.587  -1.857
  214    HB   THR  26           HB       THR  26 -20.724  17.003  -2.863
  215    HG1  THR  26           HG1      THR  26 -22.608  18.658  -1.676
  216   1HG2  THR  26          1HG2      THR  26 -19.673  17.449  -0.562
  217   2HG2  THR  26          2HG2      THR  26 -21.216  16.598  -0.609
  218   3HG2  THR  26          3HG2      THR  26 -21.166  18.312  -0.195
  219    H    ALA  27           H        ALA  27 -17.583  20.013  -3.202
  220    HA   ALA  27           HA       ALA  27 -16.422  17.503  -4.205
  221   1HB   ALA  27          1HB       ALA  27 -14.790  19.085  -5.350
  222   2HB   ALA  27          2HB       ALA  27 -15.897  20.379  -4.889
  223   3HB   ALA  27          3HB       ALA  27 -16.451  19.078  -5.946
  224    HA   PRO  28           HA       PRO  28 -14.017  17.900  -0.363
  225   1HB   PRO  28          1HB       PRO  28 -13.195  15.176  -1.122
  226   2HB   PRO  28          2HB       PRO  28 -13.968  15.740   0.362
  227   1HG   PRO  28          1HG       PRO  28 -15.288  14.257  -1.447
  228   2HG   PRO  28          2HG       PRO  28 -16.095  15.531  -0.510
  229   1HD   PRO  28          1HD       PRO  28 -15.104  15.591  -3.337
  230   2HD   PRO  28          2HD       PRO  28 -16.615  16.236  -2.660
  231    H    VAL  29           H        VAL  29 -12.216  19.071  -0.611
  232    HA   VAL  29           HA       VAL  29 -10.554  18.985  -2.866
  233    HB   VAL  29           HB       VAL  29 -10.575  20.994  -1.608
  234   1HG1  VAL  29          1HG1      VAL  29 -10.573  21.171   0.616
  235   2HG1  VAL  29          2HG1      VAL  29  -9.188  20.091   0.795
  236   3HG1  VAL  29          3HG1      VAL  29 -10.812  19.424   0.617
  237   1HG2  VAL  29          1HG2      VAL  29  -8.417  21.488  -1.882
  238   2HG2  VAL  29          2HG2      VAL  29  -8.244  19.809  -2.389
  239   3HG2  VAL  29          3HG2      VAL  29  -7.889  20.268  -0.726
  240    H    SER  30           H        SER  30  -9.383  17.328  -3.465
  241    HA   SER  30           HA       SER  30  -8.182  15.587  -1.437
  242   1HB   SER  30          1HB       SER  30  -8.045  14.809  -4.286
  243   2HB   SER  30          2HB       SER  30  -8.518  13.858  -2.879
  244    HG   SER  30           HG       SER  30 -10.407  15.625  -3.113
  245    H    SER  31           H        SER  31  -6.159  15.976  -0.928
  246    HA   SER  31           HA       SER  31  -4.487  17.717  -2.378
  247   1HB   SER  31          1HB       SER  31  -3.262  15.843  -0.426
  248   2HB   SER  31          2HB       SER  31  -3.100  17.592  -0.563
  249    HG   SER  31           HG       SER  31  -5.123  17.834   0.396
  250    H    GLY  32           H        GLY  32  -3.551  17.256  -4.261
  251   1HA   GLY  32          1HA       GLY  32  -2.881  14.512  -4.961
  252   2HA   GLY  32          2HA       GLY  32  -2.742  15.920  -6.005
  253    H    LYS  33           H        LYS  33  -1.373  14.973  -2.857
  254    HA   LYS  33           HA       LYS  33   1.281  15.689  -3.924
  255   1HB   LYS  33          1HB       LYS  33  -0.098  16.496  -1.520
  256   2HB   LYS  33          2HB       LYS  33   1.400  15.672  -1.111
  257   1HG   LYS  33          1HG       LYS  33   2.077  17.401  -3.185
  258   2HG   LYS  33          2HG       LYS  33   0.990  18.325  -2.145
  259   1HD   LYS  33          1HD       LYS  33   2.376  17.852  -0.220
  260   2HD   LYS  33          2HD       LYS  33   3.417  16.807  -1.192
  261   1HE   LYS  33          1HE       LYS  33   3.899  18.817  -2.628
  262   2HE   LYS  33          2HE       LYS  33   3.065  19.789  -1.415
  263   1HZ   LYS  33          1HZ       LYS  33   4.770  18.490   0.136
  264   2HZ   LYS  33          2HZ       LYS  33   5.156  19.963  -0.615
  265   3HZ   LYS  33          3HZ       LYS  33   5.674  18.496  -1.298
  266    H    ILE  34           H        ILE  34  -0.328  13.104  -3.771
  267    HA   ILE  34           HA       ILE  34   1.762  11.500  -2.460
  268    HB   ILE  34           HB       ILE  34  -0.457   9.827  -2.775
  269   1HG1  ILE  34          1HG1      ILE  34  -1.327  12.361  -1.374
  270   2HG1  ILE  34          2HG1      ILE  34  -1.774  11.989  -3.037
  271   1HG2  ILE  34          1HG2      ILE  34  -0.329   9.620  -0.410
  272   2HG2  ILE  34          2HG2      ILE  34   0.379  11.227  -0.247
  273   3HG2  ILE  34          3HG2      ILE  34   1.307   9.926  -0.990
  274   1HD1  ILE  34          1HD1      ILE  34  -2.580   9.730  -1.877
  275   2HD1  ILE  34          2HD1      ILE  34  -3.600  11.163  -2.002
  276   3HD1  ILE  34          3HD1      ILE  34  -2.737  10.824  -0.502
  277    H    LYS  35           H        LYS  35   2.643   9.862  -3.587
  278    HA   LYS  35           HA       LYS  35   1.826   9.602  -6.405
  279   1HB   LYS  35          1HB       LYS  35   4.633   9.163  -5.373
  280   2HB   LYS  35          2HB       LYS  35   4.100   9.420  -7.034
  281   1HG   LYS  35          1HG       LYS  35   3.409  11.637  -5.297
  282   2HG   LYS  35          2HG       LYS  35   5.143  11.317  -5.335
  283   1HD   LYS  35          1HD       LYS  35   4.840  12.797  -7.099
  284   2HD   LYS  35          2HD       LYS  35   4.847  11.222  -7.892
  285   1HE   LYS  35          1HE       LYS  35   2.586  11.269  -8.315
  286   2HE   LYS  35          2HE       LYS  35   2.253  12.382  -6.989
  287   1HZ   LYS  35          1HZ       LYS  35   2.506  14.129  -8.319
  288   2HZ   LYS  35          2HZ       LYS  35   2.441  13.047  -9.621
  289   3HZ   LYS  35          3HZ       LYS  35   3.940  13.534  -8.996
  290    H    ARG  36           H        ARG  36   1.251   7.607  -7.042
  291    HA   ARG  36           HA       ARG  36   1.630   5.450  -5.088
  292   1HB   ARG  36          1HB       ARG  36  -0.178   5.067  -7.410
  293   2HB   ARG  36          2HB       ARG  36  -0.378   4.579  -5.734
  294   1HG   ARG  36          1HG       ARG  36  -1.544   6.404  -5.230
  295   2HG   ARG  36          2HG       ARG  36  -0.429   7.467  -6.093
  296   1HD   ARG  36          1HD       ARG  36  -2.364   7.708  -7.326
  297   2HD   ARG  36          2HD       ARG  36  -1.522   6.441  -8.217
  298    HE   ARG  36           HE       ARG  36  -2.984   4.824  -7.152
  299   1HH1  ARG  36          1HH1      ARG  36  -3.935   8.195  -6.973
  300   2HH1  ARG  36          2HH1      ARG  36  -5.613   7.834  -6.661
  301   1HH2  ARG  36          1HH2      ARG  36  -5.165   4.350  -6.715
  302   2HH2  ARG  36          2HH2      ARG  36  -6.312   5.639  -6.511
  303    H    VAL  37           H        VAL  37   2.809   3.730  -5.472
  304    HA   VAL  37           HA       VAL  37   3.658   3.162  -8.233
  305    HB   VAL  37           HB       VAL  37   5.373   3.569  -5.811
  306   1HG1  VAL  37          1HG1      VAL  37   6.255   1.938  -8.188
  307   2HG1  VAL  37          2HG1      VAL  37   5.833   1.266  -6.613
  308   3HG1  VAL  37          3HG1      VAL  37   7.211   2.359  -6.765
  309   1HG2  VAL  37          1HG2      VAL  37   6.518   5.072  -7.098
  310   2HG2  VAL  37          2HG2      VAL  37   4.927   5.190  -7.843
  311   3HG2  VAL  37          3HG2      VAL  37   6.182   4.212  -8.601
  312    H    ASN  38           H        ASN  38   3.286   1.141  -8.797
  313    HA   ASN  38           HA       ASN  38   2.664  -0.827  -6.704
  314   1HB   ASN  38          1HB       ASN  38   1.019  -0.240  -8.588
  315   2HB   ASN  38          2HB       ASN  38   2.113  -1.099  -9.663
  316   1HD2  ASN  38          1HD2      ASN  38   2.457  -3.357  -9.303
  317   2HD2  ASN  38          2HD2      ASN  38   1.221  -4.302  -8.540
  318    H    VAL  39           H        VAL  39   4.064  -2.413  -6.293
  319    HA   VAL  39           HA       VAL  39   5.965  -3.189  -8.397
  320    HB   VAL  39           HB       VAL  39   7.494  -3.492  -6.169
  321   1HG1  VAL  39          1HG1      VAL  39   7.901  -2.412  -8.470
  322   2HG1  VAL  39          2HG1      VAL  39   8.867  -1.868  -7.097
  323   3HG1  VAL  39          3HG1      VAL  39   7.505  -0.897  -7.658
  324   1HG2  VAL  39          1HG2      VAL  39   5.596  -1.257  -5.673
  325   2HG2  VAL  39          2HG2      VAL  39   7.286  -1.032  -5.213
  326   3HG2  VAL  39          3HG2      VAL  39   6.356  -2.370  -4.536
  327    H    ASN  40           H        ASN  40   7.013  -5.236  -8.021
  328    HA   ASN  40           HA       ASN  40   5.273  -7.103  -6.566
  329   1HB   ASN  40          1HB       ASN  40   7.285  -8.149  -8.480
  330   2HB   ASN  40          2HB       ASN  40   5.633  -8.680  -8.188
  331   1HD2  ASN  40          1HD2      ASN  40   7.658  -6.390  -9.869
  332   2HD2  ASN  40          2HD2      ASN  40   6.472  -5.907 -11.045
  333    H    PHE  41           H        PHE  41   6.048  -8.068  -4.823
  334    HA   PHE  41           HA       PHE  41   8.952  -7.909  -4.322
  335   1HB   PHE  41          1HB       PHE  41   6.619  -7.894  -2.402
  336   2HB   PHE  41          2HB       PHE  41   8.288  -8.108  -1.888
  337    HD1  PHE  41           HD1      PHE  41   9.273  -6.139  -4.160
  338    HD2  PHE  41           HD2      PHE  41   6.413  -5.901  -1.020
  339    HE1  PHE  41           HE1      PHE  41   9.556  -3.700  -4.094
  340    HE2  PHE  41           HE2      PHE  41   6.703  -3.461  -0.942
  341    HZ   PHE  41           HZ       PHE  41   8.275  -2.362  -2.480
  342    H    ASP  42           H        ASP  42  10.012  -9.705  -3.511
  343    HA   ASP  42           HA       ASP  42   9.007 -12.209  -4.404
  344   1HB   ASP  42          1HB       ASP  42  11.421 -11.564  -4.336
  345   2HB   ASP  42          2HB       ASP  42  11.361 -11.702  -2.581
  346    H    GLU  43           H        GLU  43   8.452 -14.051  -3.205
  347    HA   GLU  43           HA       GLU  43   6.803 -13.576  -0.983
  348   1HB   GLU  43          1HB       GLU  43   7.216 -15.675  -2.727
  349   2HB   GLU  43          2HB       GLU  43   7.746 -16.327  -1.183
  350   1HG   GLU  43          1HG       GLU  43   5.143 -14.898  -1.314
  351   2HG   GLU  43          2HG       GLU  43   5.256 -16.530  -1.968
  352    H    GLU  44           H        GLU  44  10.167 -14.564  -1.193
  353    HA   GLU  44           HA       GLU  44  10.476 -15.348   1.538
  354   1HB   GLU  44          1HB       GLU  44  12.044 -15.769  -0.480
  355   2HB   GLU  44          2HB       GLU  44  12.639 -14.143  -0.166
  356   1HG   GLU  44          1HG       GLU  44  12.757 -15.278   2.311
  357   2HG   GLU  44          2HG       GLU  44  13.138 -16.640   1.259
  358    H    LYS  45           H        LYS  45  11.087 -12.373  -0.267
  359    HA   LYS  45           HA       LYS  45  11.886 -10.794   1.934
  360   1HB   LYS  45          1HB       LYS  45  10.608  -9.956  -0.679
  361   2HB   LYS  45          2HB       LYS  45  11.391  -8.870   0.462
  362   1HG   LYS  45          1HG       LYS  45  13.157 -11.028  -0.222
  363   2HG   LYS  45          2HG       LYS  45  12.557 -10.234  -1.680
  364   1HD   LYS  45          1HD       LYS  45  13.886  -8.488  -1.335
  365   2HD   LYS  45          2HD       LYS  45  13.235  -8.262   0.288
  366   1HE   LYS  45          1HE       LYS  45  15.456  -8.625   0.741
  367   2HE   LYS  45          2HE       LYS  45  14.805 -10.256   0.886
  368   1HZ   LYS  45          1HZ       LYS  45  16.127 -10.940  -0.734
  369   2HZ   LYS  45          2HZ       LYS  45  16.861  -9.408  -0.765
  370   3HZ   LYS  45          3HZ       LYS  45  15.553  -9.743  -1.795
  371    H    HIS  46           H        HIS  46   8.796 -11.701   0.605
  372    HA   HIS  46           HA       HIS  46   7.245  -9.792   2.064
  373   1HB   HIS  46          1HB       HIS  46   6.594 -11.215  -0.037
  374   2HB   HIS  46          2HB       HIS  46   6.094 -12.405   1.163
  375    HD1  HIS  46           HD1      HIS  46   3.836 -12.074   2.212
  376    HD2  HIS  46           HD2      HIS  46   5.207  -8.670   0.247
  377    HE1  HIS  46           HE1      HIS  46   1.921 -10.450   2.255
  378    HE2  HIS  46           HE2      HIS  46   2.796  -8.364   1.138
  379    H    THR  47           H        THR  47   8.439 -13.012   2.692
  380    HA   THR  47           HA       THR  47   6.848 -13.598   4.956
  381    HB   THR  47           HB       THR  47   9.659 -14.597   4.435
  382    HG1  THR  47           HG1      THR  47   8.113 -14.889   2.644
  383   1HG2  THR  47          1HG2      THR  47   8.135 -14.982   6.630
  384   2HG2  THR  47          2HG2      THR  47   9.295 -16.160   6.024
  385   3HG2  THR  47          3HG2      THR  47   7.587 -16.321   5.625
  386    H    ARG  48           H        ARG  48  10.106 -12.238   4.612
  387    HA   ARG  48           HA       ARG  48  10.470 -11.707   7.385
  388   1HB   ARG  48          1HB       ARG  48  12.348 -11.841   5.771
  389   2HB   ARG  48          2HB       ARG  48  11.777 -10.361   5.011
  390   1HG   ARG  48          1HG       ARG  48  12.952  -9.161   6.445
  391   2HG   ARG  48          2HG       ARG  48  12.047  -9.860   7.788
  392   1HD   ARG  48          1HD       ARG  48  14.737 -10.506   6.763
  393   2HD   ARG  48          2HD       ARG  48  14.105 -10.566   8.408
  394    HE   ARG  48           HE       ARG  48  13.939 -12.678   6.379
  395   1HH1  ARG  48          1HH1      ARG  48  13.289 -11.562   9.635
  396   2HH1  ARG  48          2HH1      ARG  48  12.919 -13.149  10.244
  397   1HH2  ARG  48          1HH2      ARG  48  13.431 -14.762   7.162
  398   2HH2  ARG  48          2HH2      ARG  48  13.001 -14.971   8.835
  399    H    PHE  49           H        PHE  49   9.199  -9.894   4.663
  400    HA   PHE  49           HA       PHE  49   8.974  -7.346   5.711
  401   1HB   PHE  49          1HB       PHE  49   7.826  -8.853   3.549
  402   2HB   PHE  49          2HB       PHE  49   6.585  -7.855   4.290
  403    HD1  PHE  49           HD1      PHE  49  10.134  -6.897   4.163
  404    HD2  PHE  49           HD2      PHE  49   6.278  -6.421   2.431
  405    HE1  PHE  49           HE1      PHE  49  10.945  -4.956   2.891
  406    HE2  PHE  49           HE2      PHE  49   7.085  -4.482   1.155
  407    HZ   PHE  49           HZ       PHE  49   9.422  -3.749   1.381
  408    H    LYS  50           H        LYS  50   6.449  -9.859   5.755
  409    HA   LYS  50           HA       LYS  50   4.680  -8.423   7.392
  410   1HB   LYS  50          1HB       LYS  50   4.921 -11.233   6.461
  411   2HB   LYS  50          2HB       LYS  50   3.886 -10.946   7.854
  412   1HG   LYS  50          1HG       LYS  50   2.928  -9.035   6.305
  413   2HG   LYS  50          2HG       LYS  50   3.562 -10.084   5.035
  414   1HD   LYS  50          1HD       LYS  50   1.342 -10.780   5.331
  415   2HD   LYS  50          2HD       LYS  50   2.309 -11.973   6.203
  416   1HE   LYS  50          1HE       LYS  50   0.642 -11.521   7.727
  417   2HE   LYS  50          2HE       LYS  50   1.907 -10.407   8.244
  418   1HZ   LYS  50          1HZ       LYS  50  -0.174  -9.260   8.193
  419   2HZ   LYS  50          2HZ       LYS  50  -0.479  -9.750   6.599
  420   3HZ   LYS  50          3HZ       LYS  50   0.782  -8.663   6.924
  421    H    ALA  51           H        ALA  51   7.143 -10.826   8.208
  422    HA   ALA  51           HA       ALA  51   6.491 -11.083  10.936
  423   1HB   ALA  51          1HB       ALA  51   7.912 -12.759  10.508
  424   2HB   ALA  51          2HB       ALA  51   9.181 -11.583  10.854
  425   3HB   ALA  51          3HB       ALA  51   8.692 -11.885   9.185
  426    H    ALA  52           H        ALA  52   8.921  -9.076   9.308
  427    HA   ALA  52           HA       ALA  52   9.857  -7.829  11.673
  428   1HB   ALA  52          1HB       ALA  52  11.013  -8.058   9.401
  429   2HB   ALA  52          2HB       ALA  52  11.222  -6.552  10.294
  430   3HB   ALA  52          3HB       ALA  52  10.091  -6.623   8.945
  431    H    CYS  53           H        CYS  53   7.455  -6.924   9.239
  432    HA   CYS  53           HA       CYS  53   7.013  -4.298  10.165
  433   1HB   CYS  53          1HB       CYS  53   5.652  -4.190   8.390
  434   2HB   CYS  53          2HB       CYS  53   6.106  -5.852   8.049
  435    HG   CYS  53           HG       CYS  53   3.229  -4.642   9.352
  436    H    ALA  54           H        ALA  54   5.628  -7.402  11.058
  437    HA   ALA  54           HA       ALA  54   3.611  -6.364  12.776
  438   1HB   ALA  54          1HB       ALA  54   2.990  -8.497  12.927
  439   2HB   ALA  54          2HB       ALA  54   4.571  -8.988  13.533
  440   3HB   ALA  54          3HB       ALA  54   4.292  -8.863  11.797
  441    H    ARG  55           H        ARG  55   6.954  -7.385  13.216
  442    HA   ARG  55           HA       ARG  55   7.007  -7.198  16.042
  443   1HB   ARG  55          1HB       ARG  55   8.719  -8.418  14.761
  444   2HB   ARG  55          2HB       ARG  55   9.276  -6.906  14.060
  445   1HG   ARG  55          1HG       ARG  55   9.362  -6.486  16.809
  446   2HG   ARG  55          2HG       ARG  55   9.961  -8.130  16.578
  447   1HD   ARG  55          1HD       ARG  55  11.461  -7.182  14.773
  448   2HD   ARG  55          2HD       ARG  55  11.002  -5.585  15.359
  449    HE   ARG  55           HE       ARG  55  11.856  -6.830  17.605
  450   1HH1  ARG  55          1HH1      ARG  55  13.279  -6.457  14.428
  451   2HH1  ARG  55          2HH1      ARG  55  14.916  -6.409  15.027
  452   1HH2  ARG  55          1HH2      ARG  55  13.976  -6.797  18.394
  453   2HH2  ARG  55          2HH2      ARG  55  15.317  -6.615  17.294
  454    H    LYS  56           H        LYS  56   7.832  -4.917  13.459
  455    HA   LYS  56           HA       LYS  56   8.639  -2.817  15.193
  456   1HB   LYS  56          1HB       LYS  56   7.842  -2.952  12.302
  457   2HB   LYS  56          2HB       LYS  56   8.123  -1.400  13.079
  458   1HG   LYS  56          1HG       LYS  56  10.297  -3.140  13.691
  459   2HG   LYS  56          2HG       LYS  56  10.015  -3.158  11.948
  460   1HD   LYS  56          1HD       LYS  56   9.887  -0.563  12.239
  461   2HD   LYS  56          2HD       LYS  56  10.773  -0.881  13.731
  462   1HE   LYS  56          1HE       LYS  56  11.858  -2.281  11.407
  463   2HE   LYS  56          2HE       LYS  56  11.888  -0.526  11.246
  464   1HZ   LYS  56          1HZ       LYS  56  12.968  -0.485  13.493
  465   2HZ   LYS  56          2HZ       LYS  56  13.909  -1.161  12.254
  466   3HZ   LYS  56          3HZ       LYS  56  13.134  -2.170  13.376
  467    H    GLY  57           H        GLY  57   5.568  -3.763  13.774
  468   1HA   GLY  57          1HA       GLY  57   3.488  -3.338  14.802
  469   2HA   GLY  57          2HA       GLY  57   4.220  -2.009  15.688
  470    H    THR  58           H        THR  58   4.142  -2.741  12.221
  471    HA   THR  58           HA       THR  58   2.415  -0.461  11.745
  472    HB   THR  58           HB       THR  58   4.841   0.358  11.843
  473    HG1  THR  58           HG1      THR  58   4.453   1.584   9.781
  474   1HG2  THR  58          1HG2      THR  58   6.341  -0.123  10.151
  475   2HG2  THR  58          2HG2      THR  58   5.084  -0.670   9.045
  476   3HG2  THR  58          3HG2      THR  58   5.571  -1.692  10.397
  477    H    SER  59           H        SER  59   1.806  -0.308   9.425
  478    HA   SER  59           HA       SER  59   1.113  -2.882   8.436
  479   1HB   SER  59          1HB       SER  59   0.724  -0.799   6.491
  480   2HB   SER  59          2HB       SER  59  -0.485  -1.670   7.435
  481    HG   SER  59           HG       SER  59  -0.728   0.362   8.126
  482    H    ILE  60           H        ILE  60   1.595  -3.701   6.283
  483    HA   ILE  60           HA       ILE  60   4.370  -3.669   5.740
  484    HB   ILE  60           HB       ILE  60   2.337  -5.359   5.076
  485   1HG1  ILE  60          1HG1      ILE  60   4.914  -5.349   3.529
  486   2HG1  ILE  60          2HG1      ILE  60   4.888  -5.652   5.263
  487   1HG2  ILE  60          1HG2      ILE  60   3.103  -3.903   2.557
  488   2HG2  ILE  60          2HG2      ILE  60   1.490  -4.089   3.249
  489   3HG2  ILE  60          3HG2      ILE  60   2.333  -5.491   2.589
  490   1HD1  ILE  60          1HD1      ILE  60   2.931  -7.298   4.041
  491   2HD1  ILE  60          2HD1      ILE  60   4.405  -7.770   4.887
  492   3HD1  ILE  60          3HD1      ILE  60   4.444  -7.468   3.150
  493    H    THR  61           H        THR  61   1.690  -1.813   4.502
  494    HA   THR  61           HA       THR  61   2.905  -0.785   2.184
  495    HB   THR  61           HB       THR  61   1.176   1.144   3.350
  496    HG1  THR  61           HG1      THR  61  -0.275   0.006   4.381
  497   1HG2  THR  61          1HG2      THR  61   1.119  -0.776   1.073
  498   2HG2  THR  61          2HG2      THR  61   1.022   0.986   1.062
  499   3HG2  THR  61          3HG2      THR  61  -0.385   0.027   1.529
  500    H    ASP  62           H        ASP  62   2.817   0.268   5.557
  501    HA   ASP  62           HA       ASP  62   4.315   2.667   5.163
  502   1HB   ASP  62          1HB       ASP  62   2.847   2.333   7.123
  503   2HB   ASP  62          2HB       ASP  62   3.912   1.050   7.692
  504    H    VAL  63           H        VAL  63   5.064  -0.673   5.789
  505    HA   VAL  63           HA       VAL  63   7.769  -0.355   6.522
  506    HB   VAL  63           HB       VAL  63   6.045  -2.598   5.710
  507   1HG1  VAL  63          1HG1      VAL  63   8.009  -4.125   5.378
  508   2HG1  VAL  63          2HG1      VAL  63   9.006  -2.685   5.172
  509   3HG1  VAL  63          3HG1      VAL  63   7.694  -3.017   4.041
  510   1HG2  VAL  63          1HG2      VAL  63   8.126  -3.293   7.506
  511   2HG2  VAL  63          2HG2      VAL  63   6.409  -3.065   7.842
  512   3HG2  VAL  63          3HG2      VAL  63   7.519  -1.699   7.949
  513    H    VAL  64           H        VAL  64   6.182  -0.841   3.375
  514    HA   VAL  64           HA       VAL  64   8.543  -0.866   1.823
  515    HB   VAL  64           HB       VAL  64   5.899   0.230   0.866
  516   1HG1  VAL  64          1HG1      VAL  64   6.812   0.220  -1.161
  517   2HG1  VAL  64          2HG1      VAL  64   7.414  -1.425  -0.957
  518   3HG1  VAL  64          3HG1      VAL  64   8.367  -0.057  -0.379
  519   1HG2  VAL  64          1HG2      VAL  64   5.632  -1.977   2.015
  520   2HG2  VAL  64          2HG2      VAL  64   6.743  -2.664   0.829
  521   3HG2  VAL  64          3HG2      VAL  64   5.201  -1.989   0.304
  522    H    ASN  65           H        ASN  65   6.490   1.742   2.999
  523    HA   ASN  65           HA       ASN  65   7.809   3.845   1.630
  524   1HB   ASN  65          1HB       ASN  65   5.649   3.600   3.439
  525   2HB   ASN  65          2HB       ASN  65   6.798   4.709   4.182
  526   1HD2  ASN  65          1HD2      ASN  65   4.096   4.926   2.757
  527   2HD2  ASN  65          2HD2      ASN  65   4.332   6.227   1.633
  528    H    GLN  66           H        GLN  66   8.460   2.087   4.569
  529    HA   GLN  66           HA       GLN  66  10.357   3.884   5.673
  530   1HB   GLN  66          1HB       GLN  66   9.121   2.037   6.884
  531   2HB   GLN  66          2HB       GLN  66  10.236   0.906   6.131
  532   1HG   GLN  66          1HG       GLN  66  12.091   1.833   7.274
  533   2HG   GLN  66          2HG       GLN  66  11.145   3.218   7.819
  534   1HE2  GLN  66          1HE2      GLN  66   9.086   2.480   9.038
  535   2HE2  GLN  66          2HE2      GLN  66   9.362   1.306  10.283
  536    H    LEU  67           H        LEU  67  10.691   0.988   3.620
  537    HA   LEU  67           HA       LEU  67  13.525   1.007   3.639
  538   1HB   LEU  67          1HB       LEU  67  12.777  -0.062   1.167
  539   2HB   LEU  67          2HB       LEU  67  13.198  -0.937   2.626
  540    HG   LEU  67           HG       LEU  67  10.416  -0.067   2.598
  541   1HD1  LEU  67          1HD1      LEU  67  10.231  -2.221   0.901
  542   2HD1  LEU  67          2HD1      LEU  67  11.538  -1.266   0.203
  543   3HD1  LEU  67          3HD1      LEU  67   9.959  -0.531   0.472
  544   1HD2  LEU  67          1HD2      LEU  67  12.031  -2.484   3.205
  545   2HD2  LEU  67          2HD2      LEU  67  10.309  -2.688   2.880
  546   3HD2  LEU  67          3HD2      LEU  67  10.839  -1.639   4.193
  547    H    VAL  68           H        VAL  68  11.118   2.458   1.503
  548    HA   VAL  68           HA       VAL  68  12.947   3.553  -0.366
  549    HB   VAL  68           HB       VAL  68  10.165   4.458   0.399
  550   1HG1  VAL  68          1HG1      VAL  68  10.143   5.742  -1.657
  551   2HG1  VAL  68          2HG1      VAL  68  11.794   5.241  -2.016
  552   3HG1  VAL  68          3HG1      VAL  68  11.472   6.282  -0.631
  553   1HG2  VAL  68          1HG2      VAL  68  11.208   2.766  -1.862
  554   2HG2  VAL  68          2HG2      VAL  68   9.547   3.353  -1.732
  555   3HG2  VAL  68          3HG2      VAL  68  10.187   2.237  -0.524
  556    H    ASP  69           H        ASP  69  11.527   4.739   2.630
  557    HA   ASP  69           HA       ASP  69  12.541   7.350   2.657
  558   1HB   ASP  69          1HB       ASP  69  11.215   5.595   4.461
  559   2HB   ASP  69          2HB       ASP  69  12.632   6.224   5.294
  560    H    ASN  70           H        ASN  70  13.833   4.384   4.067
  561    HA   ASN  70           HA       ASN  70  16.276   5.366   5.013
  562   1HB   ASN  70          1HB       ASN  70  15.171   2.696   4.301
  563   2HB   ASN  70          2HB       ASN  70  16.923   2.822   4.440
  564   1HD2  ASN  70          1HD2      ASN  70  13.930   2.711   6.090
  565   2HD2  ASN  70          2HD2      ASN  70  14.567   2.717   7.698
  566    H    TRP  71           H        TRP  71  15.689   3.482   2.068
  567    HA   TRP  71           HA       TRP  71  18.254   3.582   1.045
  568   1HB   TRP  71          1HB       TRP  71  16.177   2.206   0.345
  569   2HB   TRP  71          2HB       TRP  71  15.827   3.559  -0.722
  570    HD1  TRP  71           HD1      TRP  71  18.218   0.633  -0.281
  571    HE1  TRP  71           HE1      TRP  71  19.586   0.340  -2.441
  572    HE3  TRP  71           HE3      TRP  71  16.723   4.851  -2.750
  573    HZ2  TRP  71           HZ2      TRP  71  19.959   1.711  -4.887
  574    HZ3  TRP  71           HZ3      TRP  71  17.623   5.274  -5.005
  575    HH2  TRP  71           HH2      TRP  71  19.206   3.739  -6.045
  576    H    LEU  72           H        LEU  72  15.502   5.602   0.056
  577    HA   LEU  72           HA       LEU  72  16.910   6.998  -1.883
  578   1HB   LEU  72          1HB       LEU  72  14.290   7.006  -0.785
  579   2HB   LEU  72          2HB       LEU  72  14.841   8.667  -0.882
  580    HG   LEU  72           HG       LEU  72  14.818   6.729  -3.194
  581   1HD1  LEU  72          1HD1      LEU  72  12.728   7.350  -3.670
  582   2HD1  LEU  72          2HD1      LEU  72  13.072   9.047  -3.338
  583   3HD1  LEU  72          3HD1      LEU  72  12.649   7.960  -2.018
  584   1HD2  LEU  72          1HD2      LEU  72  15.951   9.387  -2.766
  585   2HD2  LEU  72          2HD2      LEU  72  14.911   9.276  -4.185
  586   3HD2  LEU  72          3HD2      LEU  72  16.292   8.196  -4.020
  587    H    LYS  73           H        LYS  73  16.147   8.022   1.447
  588    HA   LYS  73           HA       LYS  73  17.468  10.527   0.943
  589   1HB   LYS  73          1HB       LYS  73  16.220   9.510   3.495
  590   2HB   LYS  73          2HB       LYS  73  16.674  11.173   3.144
  591   1HG   LYS  73          1HG       LYS  73  14.868  11.537   1.815
  592   2HG   LYS  73          2HG       LYS  73  14.825   9.864   1.242
  593   1HD   LYS  73          1HD       LYS  73  12.907  10.626   2.739
  594   2HD   LYS  73          2HD       LYS  73  13.714   9.119   3.176
  595   1HE   LYS  73          1HE       LYS  73  15.041  11.319   4.442
  596   2HE   LYS  73          2HE       LYS  73  13.312  11.403   4.779
  597   1HZ   LYS  73          1HZ       LYS  73  13.431   9.051   5.484
  598   2HZ   LYS  73          2HZ       LYS  73  14.362  10.085   6.454
  599   3HZ   LYS  73          3HZ       LYS  73  15.121   9.103   5.299
  600    H    GLU  74           H        GLU  74  18.142   7.706   3.000
  601    HA   GLU  74           HA       GLU  74  20.313   8.967   4.324
  602   1HB   GLU  74          1HB       GLU  74  18.854   6.647   4.687
  603   2HB   GLU  74          2HB       GLU  74  20.453   6.055   4.266
  604   1HG   GLU  74          1HG       GLU  74  19.695   6.632   6.765
  605   2HG   GLU  74          2HG       GLU  74  21.363   6.734   6.204
  606    H    ASN  75           H        ASN  75  20.099   7.020   1.409
  607    HA   ASN  75           HA       ASN  75  23.009   6.872   1.258
  608   1HB   ASN  75          1HB       ASN  75  22.607   4.907   0.268
  609   2HB   ASN  75          2HB       ASN  75  20.879   5.210   0.351
  610   1HD2  ASN  75          1HD2      ASN  75  19.788   5.500  -1.477
  611   2HD2  ASN  75          2HD2      ASN  75  20.499   5.658  -3.049
  612    H    GLU  76           H        GLU  76  20.678   9.028   0.429
  613    HA   GLU  76           HA       GLU  76  21.310   9.936  -2.132
  614   1HB   GLU  76          1HB       GLU  76  19.671  10.762  -0.025
  615   2HB   GLU  76          2HB       GLU  76  20.758  12.115  -0.306
  616   1HG   GLU  76          1HG       GLU  76  19.897  11.227  -2.836
  617   2HG   GLU  76          2HG       GLU  76  18.470  11.297  -1.801
  618   1H    MET   1          1H        MET   1 -23.722 -79.203 -55.823
  619   2H    MET   1          2H        MET   1 -24.861 -77.998 -56.169
  620   3H    MET   1          3H        MET   1 -23.235 -77.586 -55.942
  621    HA   MET   1           HA       MET   1 -22.564 -78.621 -57.925
  622   1HB   MET   1          1HB       MET   1 -24.242 -80.524 -57.503
  623   2HB   MET   1          2HB       MET   1 -25.405 -79.525 -58.363
  624   1HG   MET   1          1HG       MET   1 -23.990 -79.539 -60.337
  625   2HG   MET   1          2HG       MET   1 -22.783 -80.499 -59.480
  626   1HE   MET   1          1HE       MET   1 -24.273 -81.713 -62.439
  627   2HE   MET   1          2HE       MET   1 -23.769 -83.255 -61.749
  628   3HE   MET   1          3HE       MET   1 -22.772 -81.818 -61.523
  629    H    SER   2           H        SER   2 -25.875 -78.118 -58.878
  630    HA   SER   2           HA       SER   2 -25.049 -75.827 -60.435
  631   1HB   SER   2          1HB       SER   2 -27.877 -76.742 -60.424
  632   2HB   SER   2          2HB       SER   2 -26.838 -76.305 -61.782
  633    HG   SER   2           HG       SER   2 -25.887 -78.293 -61.710
  634    H    LEU   3           H        LEU   3 -27.024 -76.518 -57.632
  635    HA   LEU   3           HA       LEU   3 -28.163 -73.856 -57.586
  636   1HB   LEU   3          1HB       LEU   3 -29.103 -76.196 -56.687
  637   2HB   LEU   3          2HB       LEU   3 -28.325 -75.640 -55.217
  638    HG   LEU   3           HG       LEU   3 -30.071 -73.667 -56.538
  639   1HD1  LEU   3          1HD1      LEU   3 -31.546 -75.424 -56.939
  640   2HD1  LEU   3          2HD1      LEU   3 -32.065 -74.794 -55.373
  641   3HD1  LEU   3          3HD1      LEU   3 -31.095 -76.265 -55.456
  642   1HD2  LEU   3          1HD2      LEU   3 -29.444 -74.563 -53.748
  643   2HD2  LEU   3          2HD2      LEU   3 -30.838 -73.539 -54.079
  644   3HD2  LEU   3          3HD2      LEU   3 -29.219 -72.978 -54.486
  645    H    GLU   4           H        GLU   4 -26.154 -72.686 -57.510
  646    HA   GLU   4           HA       GLU   4 -24.695 -72.906 -54.973
  647   1HB   GLU   4          1HB       GLU   4 -23.947 -72.290 -57.695
  648   2HB   GLU   4          2HB       GLU   4 -23.444 -71.002 -56.610
  649   1HG   GLU   4          1HG       GLU   4 -22.593 -73.858 -56.680
  650   2HG   GLU   4          2HG       GLU   4 -21.613 -72.392 -56.591
  651    H    LYS   5           H        LYS   5 -23.867 -70.703 -54.161
  652    HA   LYS   5           HA       LYS   5 -25.810 -68.557 -54.536
  653   1HB   LYS   5          1HB       LYS   5 -25.588 -70.237 -52.117
  654   2HB   LYS   5          2HB       LYS   5 -25.620 -68.502 -51.825
  655   1HG   LYS   5          1HG       LYS   5 -27.811 -68.444 -52.133
  656   2HG   LYS   5          2HG       LYS   5 -27.649 -69.198 -53.720
  657   1HD   LYS   5          1HD       LYS   5 -28.000 -71.317 -52.901
  658   2HD   LYS   5          2HD       LYS   5 -27.423 -70.904 -51.285
  659   1HE   LYS   5          1HE       LYS   5 -29.596 -69.303 -51.470
  660   2HE   LYS   5          2HE       LYS   5 -30.111 -70.664 -52.464
  661   1HZ   LYS   5          1HZ       LYS   5 -30.512 -70.655 -49.900
  662   2HZ   LYS   5          2HZ       LYS   5 -28.912 -71.211 -49.841
  663   3HZ   LYS   5          3HZ       LYS   5 -30.080 -72.090 -50.696
  664    H    ALA   6           H        ALA   6 -25.125 -66.601 -53.206
  665    HA   ALA   6           HA       ALA   6 -22.200 -66.375 -53.352
  666   1HB   ALA   6          1HB       ALA   6 -22.455 -64.251 -54.035
  667   2HB   ALA   6          2HB       ALA   6 -23.762 -63.935 -52.894
  668   3HB   ALA   6          3HB       ALA   6 -24.103 -64.753 -54.418
  669    H    HIS   7           H        HIS   7 -22.227 -67.652 -51.311
  670    HA   HIS   7           HA       HIS   7 -23.138 -66.218 -48.950
  671   1HB   HIS   7          1HB       HIS   7 -22.399 -68.991 -49.602
  672   2HB   HIS   7          2HB       HIS   7 -21.886 -68.454 -48.002
  673    HD1  HIS   7           HD1      HIS   7 -24.122 -70.615 -48.512
  674    HD2  HIS   7           HD2      HIS   7 -24.763 -66.590 -47.687
  675    HE1  HIS   7           HE1      HIS   7 -26.464 -70.471 -47.603
  676    HE2  HIS   7           HE2      HIS   7 -26.878 -68.011 -47.253
  677    H    THR   8           H        THR   8 -21.116 -64.906 -50.312
  678    HA   THR   8           HA       THR   8 -18.562 -65.474 -49.127
  679    HB   THR   8           HB       THR   8 -18.972 -62.801 -50.280
  680    HG1  THR   8           HG1      THR   8 -19.418 -65.168 -51.834
  681   1HG2  THR   8          1HG2      THR   8 -16.942 -63.270 -51.404
  682   2HG2  THR   8          2HG2      THR   8 -17.130 -65.011 -51.180
  683   3HG2  THR   8          3HG2      THR   8 -16.772 -63.974 -49.796
  684    H    SER   9           H        SER   9 -17.692 -64.615 -47.328
  685    HA   SER   9           HA       SER   9 -19.391 -63.145 -45.540
  686   1HB   SER   9          1HB       SER   9 -16.526 -63.476 -44.868
  687   2HB   SER   9          2HB       SER   9 -17.961 -63.832 -43.906
  688    HG   SER   9           HG       SER   9 -18.255 -65.649 -45.443
  689    H    VAL  10           H        VAL  10 -19.358 -61.399 -47.398
  690    HA   VAL  10           HA       VAL  10 -17.116 -59.553 -47.076
  691    HB   VAL  10           HB       VAL  10 -19.521 -59.209 -48.869
  692   1HG1  VAL  10          1HG1      VAL  10 -18.003 -57.241 -48.208
  693   2HG1  VAL  10          2HG1      VAL  10 -18.344 -57.491 -49.920
  694   3HG1  VAL  10          3HG1      VAL  10 -16.799 -58.010 -49.242
  695   1HG2  VAL  10          1HG2      VAL  10 -18.273 -61.301 -49.375
  696   2HG2  VAL  10          2HG2      VAL  10 -16.826 -60.325 -49.635
  697   3HG2  VAL  10          3HG2      VAL  10 -18.231 -60.116 -50.682
  698    H    LYS  11           H        LYS  11 -17.204 -58.129 -45.491
  699    HA   LYS  11           HA       LYS  11 -19.672 -56.662 -45.021
  700   1HB   LYS  11          1HB       LYS  11 -18.982 -56.954 -42.444
  701   2HB   LYS  11          2HB       LYS  11 -20.134 -58.011 -43.246
  702   1HG   LYS  11          1HG       LYS  11 -18.725 -59.786 -43.235
  703   2HG   LYS  11          2HG       LYS  11 -17.279 -58.783 -43.366
  704   1HD   LYS  11          1HD       LYS  11 -18.910 -58.657 -40.873
  705   2HD   LYS  11          2HD       LYS  11 -17.847 -60.041 -41.133
  706   1HE   LYS  11          1HE       LYS  11 -16.561 -57.494 -41.712
  707   2HE   LYS  11          2HE       LYS  11 -17.115 -57.622 -40.043
  708   1HZ   LYS  11          1HZ       LYS  11 -14.994 -58.515 -39.986
  709   2HZ   LYS  11          2HZ       LYS  11 -15.163 -59.306 -41.479
  710   3HZ   LYS  11          3HZ       LYS  11 -15.969 -59.898 -40.108
  711    H    LYS  12           H        LYS  12 -18.593 -54.937 -45.946
  712    HA   LYS  12           HA       LYS  12 -16.007 -54.100 -45.128
  713   1HB   LYS  12          1HB       LYS  12 -18.202 -52.726 -46.680
  714   2HB   LYS  12          2HB       LYS  12 -16.641 -51.976 -46.372
  715   1HG   LYS  12          1HG       LYS  12 -15.508 -53.716 -47.591
  716   2HG   LYS  12          2HG       LYS  12 -17.022 -54.600 -47.798
  717   1HD   LYS  12          1HD       LYS  12 -16.879 -51.785 -48.766
  718   2HD   LYS  12          2HD       LYS  12 -16.063 -53.039 -49.705
  719   1HE   LYS  12          1HE       LYS  12 -18.125 -54.274 -49.921
  720   2HE   LYS  12          2HE       LYS  12 -18.959 -53.133 -48.865
  721   1HZ   LYS  12          1HZ       LYS  12 -19.558 -52.265 -50.846
  722   2HZ   LYS  12          2HZ       LYS  12 -18.201 -52.860 -51.667
  723   3HZ   LYS  12          3HZ       LYS  12 -18.068 -51.466 -50.708
  724    H    MET  13           H        MET  13 -15.514 -53.248 -43.244
  725    HA   MET  13           HA       MET  13 -17.195 -51.168 -42.093
  726   1HB   MET  13          1HB       MET  13 -17.804 -53.519 -41.162
  727   2HB   MET  13          2HB       MET  13 -16.270 -53.405 -40.312
  728   1HG   MET  13          1HG       MET  13 -17.098 -51.210 -39.378
  729   2HG   MET  13          2HG       MET  13 -18.679 -51.639 -40.025
  730   1HE   MET  13          1HE       MET  13 -18.979 -52.071 -36.174
  731   2HE   MET  13          2HE       MET  13 -18.762 -50.850 -37.428
  732   3HE   MET  13          3HE       MET  13 -17.368 -51.446 -36.526
  733    H    THR  14           H        THR  14 -16.001 -49.599 -41.194
  734    HA   THR  14           HA       THR  14 -13.130 -49.811 -41.329
  735    HB   THR  14           HB       THR  14 -13.420 -47.426 -40.266
  736    HG1  THR  14           HG1      THR  14 -15.446 -46.850 -40.067
  737   1HG2  THR  14          1HG2      THR  14 -13.568 -48.455 -42.994
  738   2HG2  THR  14          2HG2      THR  14 -12.613 -47.122 -42.340
  739   3HG2  THR  14          3HG2      THR  14 -14.292 -46.854 -42.815
  740    H    PHE  15           H        PHE  15 -11.699 -49.864 -39.632
  741    HA   PHE  15           HA       PHE  15 -12.806 -50.876 -37.170
  742   1HB   PHE  15          1HB       PHE  15 -10.703 -51.747 -36.709
  743   2HB   PHE  15          2HB       PHE  15 -10.746 -51.772 -38.466
  744    HD1  PHE  15           HD1      PHE  15  -8.969 -50.700 -35.586
  745    HD2  PHE  15           HD2      PHE  15  -9.629 -49.824 -39.695
  746    HE1  PHE  15           HE1      PHE  15  -6.870 -49.426 -35.644
  747    HE2  PHE  15           HE2      PHE  15  -7.533 -48.540 -39.760
  748    HZ   PHE  15           HZ       PHE  15  -6.151 -48.336 -37.732
  749    H    GLY  16           H        GLY  16 -11.670 -47.862 -38.299
  750   1HA   GLY  16          1HA       GLY  16 -12.214 -45.942 -36.844
  751   2HA   GLY  16          2HA       GLY  16 -11.556 -46.880 -35.510
  752    H    GLU  17           H        GLU  17 -10.709 -45.364 -38.581
  753    HA   GLU  17           HA       GLU  17  -7.912 -45.231 -37.681
  754   1HB   GLU  17          1HB       GLU  17  -8.842 -46.325 -39.956
  755   2HB   GLU  17          2HB       GLU  17  -8.621 -44.671 -40.507
  756   1HG   GLU  17          1HG       GLU  17  -6.264 -44.879 -39.510
  757   2HG   GLU  17          2HG       GLU  17  -6.576 -46.616 -39.530
  758    H    ASN  18           H        ASN  18 -10.541 -43.375 -37.617
  759    HA   ASN  18           HA       ASN  18  -9.633 -40.984 -38.870
  760   1HB   ASN  18          1HB       ASN  18 -11.792 -40.458 -38.626
  761   2HB   ASN  18          2HB       ASN  18 -12.036 -41.901 -37.658
  762   1HD2  ASN  18          1HD2      ASN  18 -12.565 -41.679 -35.594
  763   2HD2  ASN  18          2HD2      ASN  18 -12.579 -40.180 -34.722
  764    H    ARG  19           H        ARG  19  -9.603 -42.199 -35.560
  765    HA   ARG  19           HA       ARG  19  -8.547 -41.517 -33.664
  766   1HB   ARG  19          1HB       ARG  19  -6.621 -42.095 -35.195
  767   2HB   ARG  19          2HB       ARG  19  -6.472 -40.376 -35.536
  768   1HG   ARG  19          1HG       ARG  19  -6.293 -40.127 -32.965
  769   2HG   ARG  19          2HG       ARG  19  -5.911 -41.851 -33.000
  770   1HD   ARG  19          1HD       ARG  19  -3.973 -41.510 -34.272
  771   2HD   ARG  19          2HD       ARG  19  -4.475 -39.893 -34.764
  772    HE   ARG  19           HE       ARG  19  -3.778 -40.500 -31.962
  773   1HH1  ARG  19          1HH1      ARG  19  -3.391 -38.591 -34.879
  774   2HH1  ARG  19          2HH1      ARG  19  -2.299 -37.448 -34.139
  775   1HH2  ARG  19          1HH2      ARG  19  -2.358 -39.002 -30.990
  776   2HH2  ARG  19          2HH2      ARG  19  -1.722 -37.685 -31.921
  777    H    ASP  20           H        ASP  20 -10.413 -39.939 -33.589
  778    HA   ASP  20           HA       ASP  20  -9.777 -37.176 -34.138
  779   1HB   ASP  20          1HB       ASP  20 -12.078 -37.985 -34.413
  780   2HB   ASP  20          2HB       ASP  20 -12.148 -38.393 -32.701
  781    H    LEU  21           H        LEU  21  -7.882 -37.018 -32.829
  782    HA   LEU  21           HA       LEU  21  -8.522 -36.494 -30.012
  783   1HB   LEU  21          1HB       LEU  21  -6.507 -38.351 -31.134
  784   2HB   LEU  21          2HB       LEU  21  -5.992 -37.372 -29.773
  785    HG   LEU  21           HG       LEU  21  -8.484 -38.404 -29.018
  786   1HD1  LEU  21          1HD1      LEU  21  -8.556 -40.646 -29.518
  787   2HD1  LEU  21          2HD1      LEU  21  -6.833 -40.729 -29.895
  788   3HD1  LEU  21          3HD1      LEU  21  -7.949 -39.973 -31.034
  789   1HD2  LEU  21          1HD2      LEU  21  -7.189 -39.627 -27.363
  790   2HD2  LEU  21          2HD2      LEU  21  -6.545 -37.998 -27.570
  791   3HD2  LEU  21          3HD2      LEU  21  -5.718 -39.374 -28.302
  792    H    GLU  22           H        GLU  22  -8.598 -34.365 -31.398
  793    HA   GLU  22           HA       GLU  22  -5.920 -33.162 -31.513
  794   1HB   GLU  22          1HB       GLU  22  -8.574 -32.156 -32.557
  795   2HB   GLU  22          2HB       GLU  22  -7.050 -31.290 -32.688
  796   1HG   GLU  22          1HG       GLU  22  -7.597 -33.991 -33.899
  797   2HG   GLU  22          2HG       GLU  22  -7.701 -32.456 -34.760
  798    H    ARG  23           H        ARG  23  -5.597 -32.889 -29.299
  799    HA   ARG  23           HA       ARG  23  -7.310 -30.848 -28.047
  800   1HB   ARG  23          1HB       ARG  23  -6.225 -33.363 -26.772
  801   2HB   ARG  23          2HB       ARG  23  -6.941 -32.036 -25.870
  802   1HG   ARG  23          1HG       ARG  23  -9.046 -32.366 -27.105
  803   2HG   ARG  23          2HG       ARG  23  -8.317 -33.749 -27.926
  804   1HD   ARG  23          1HD       ARG  23  -7.874 -34.132 -25.179
  805   2HD   ARG  23          2HD       ARG  23  -9.549 -33.606 -25.338
  806    HE   ARG  23           HE       ARG  23  -9.659 -35.469 -27.095
  807   1HH1  ARG  23          1HH1      ARG  23  -7.545 -35.569 -24.304
  808   2HH1  ARG  23          2HH1      ARG  23  -7.667 -37.292 -24.105
  809   1HH2  ARG  23          1HH2      ARG  23  -9.797 -37.750 -26.856
  810   2HH2  ARG  23          2HH2      ARG  23  -8.931 -38.533 -25.560
  811    H    VAL  24           H        VAL  24  -6.178 -29.110 -27.543
  812    HA   VAL  24           HA       VAL  24  -3.309 -29.118 -27.550
  813    HB   VAL  24           HB       VAL  24  -5.142 -26.887 -26.649
  814   1HG1  VAL  24          1HG1      VAL  24  -2.248 -26.998 -27.463
  815   2HG1  VAL  24          2HG1      VAL  24  -2.934 -26.419 -25.947
  816   3HG1  VAL  24          3HG1      VAL  24  -3.168 -25.496 -27.430
  817   1HG2  VAL  24          1HG2      VAL  24  -5.359 -27.934 -29.063
  818   2HG2  VAL  24          2HG2      VAL  24  -3.928 -26.950 -29.365
  819   3HG2  VAL  24          3HG2      VAL  24  -5.421 -26.189 -28.813
  820    H    VAL  25           H        VAL  25  -2.133 -29.817 -25.908
  821    HA   VAL  25           HA       VAL  25  -3.120 -29.345 -23.166
  822    HB   VAL  25           HB       VAL  25  -1.448 -31.723 -23.981
  823   1HG1  VAL  25          1HG1      VAL  25  -1.938 -32.577 -21.812
  824   2HG1  VAL  25          2HG1      VAL  25  -3.098 -31.288 -21.497
  825   3HG1  VAL  25          3HG1      VAL  25  -1.377 -30.919 -21.607
  826   1HG2  VAL  25          1HG2      VAL  25  -3.887 -31.522 -24.926
  827   2HG2  VAL  25          2HG2      VAL  25  -4.337 -31.973 -23.283
  828   3HG2  VAL  25          3HG2      VAL  25  -3.312 -33.040 -24.240
  829    H    THR  26           H        THR  26  -1.916 -27.584 -22.664
  830    HA   THR  26           HA       THR  26   0.933 -28.060 -22.291
  831    HB   THR  26           HB       THR  26   0.716 -25.359 -23.195
  832    HG1  THR  26           HG1      THR  26  -0.962 -25.831 -24.550
  833   1HG2  THR  26          1HG2      THR  26   2.423 -26.086 -24.804
  834   2HG2  THR  26          2HG2      THR  26   2.082 -27.770 -24.401
  835   3HG2  THR  26          3HG2      THR  26   2.762 -26.690 -23.182
  836    H    ALA  27           H        ALA  27   0.385 -28.117 -20.088
  837    HA   ALA  27           HA       ALA  27  -0.689 -25.634 -18.940
  838   1HB   ALA  27          1HB       ALA  27  -1.087 -28.398 -18.374
  839   2HB   ALA  27          2HB       ALA  27  -1.876 -27.001 -17.644
  840   3HB   ALA  27          3HB       ALA  27  -0.379 -27.630 -16.955
  841    HA   PRO  28           HA       PRO  28   3.646 -24.957 -17.869
  842   1HB   PRO  28          1HB       PRO  28   2.801 -22.244 -17.227
  843   2HB   PRO  28          2HB       PRO  28   3.879 -22.794 -18.509
  844   1HG   PRO  28          1HG       PRO  28   1.415 -21.774 -18.990
  845   2HG   PRO  28          2HG       PRO  28   2.176 -22.988 -20.035
  846   1HD   PRO  28          1HD       PRO  28   0.093 -23.354 -17.909
  847   2HD   PRO  28          2HD       PRO  28   0.201 -24.098 -19.520
  848    H    VAL  29           H        VAL  29   4.775 -24.422 -15.944
  849    HA   VAL  29           HA       VAL  29   3.092 -24.215 -13.538
  850    HB   VAL  29           HB       VAL  29   5.495 -25.493 -12.776
  851   1HG1  VAL  29          1HG1      VAL  29   3.553 -25.826 -11.521
  852   2HG1  VAL  29          2HG1      VAL  29   3.856 -27.388 -12.279
  853   3HG1  VAL  29          3HG1      VAL  29   2.616 -26.319 -12.933
  854   1HG2  VAL  29          1HG2      VAL  29   5.789 -26.220 -15.089
  855   2HG2  VAL  29          2HG2      VAL  29   4.172 -26.916 -15.083
  856   3HG2  VAL  29          3HG2      VAL  29   5.419 -27.586 -14.037
  857    H    SER  30           H        SER  30   3.736 -21.912 -14.317
  858    HA   SER  30           HA       SER  30   6.372 -20.992 -13.816
  859   1HB   SER  30          1HB       SER  30   3.907 -19.272 -13.645
  860   2HB   SER  30          2HB       SER  30   5.517 -18.838 -14.229
  861    HG   SER  30           HG       SER  30   4.852 -20.753 -15.791
  862    H    SER  31           H        SER  31   7.081 -19.635 -12.068
  863    HA   SER  31           HA       SER  31   6.167 -20.642  -9.538
  864   1HB   SER  31          1HB       SER  31   8.070 -18.445  -9.384
  865   2HB   SER  31          2HB       SER  31   8.244 -20.120  -8.853
  866    HG   SER  31           HG       SER  31   8.718 -20.667 -11.052
  867    H    GLY  32           H        GLY  32   5.369 -19.436  -7.811
  868   1HA   GLY  32          1HA       GLY  32   4.253 -16.790  -8.522
  869   2HA   GLY  32          2HA       GLY  32   3.316 -17.994  -7.642
  870    H    LYS  33           H        LYS  33   6.721 -17.255  -7.252
  871    HA   LYS  33           HA       LYS  33   6.333 -16.864  -4.401
  872   1HB   LYS  33          1HB       LYS  33   8.443 -17.776  -6.111
  873   2HB   LYS  33          2HB       LYS  33   9.030 -16.421  -5.159
  874   1HG   LYS  33          1HG       LYS  33   8.126 -17.644  -3.131
  875   2HG   LYS  33          2HG       LYS  33   7.947 -19.044  -4.187
  876   1HD   LYS  33          1HD       LYS  33  10.048 -19.429  -3.358
  877   2HD   LYS  33          2HD       LYS  33  10.450 -18.480  -4.790
  878   1HE   LYS  33          1HE       LYS  33   9.918 -16.741  -2.570
  879   2HE   LYS  33          2HE       LYS  33  11.128 -17.940  -2.118
  880   1HZ   LYS  33          1HZ       LYS  33  12.647 -17.003  -3.433
  881   2HZ   LYS  33          2HZ       LYS  33  11.627 -15.646  -3.453
  882   3HZ   LYS  33          3HZ       LYS  33  11.558 -16.774  -4.718
  883    H    ILE  34           H        ILE  34   5.157 -14.845  -5.919
  884    HA   ILE  34           HA       ILE  34   6.703 -12.547  -5.015
  885    HB   ILE  34           HB       ILE  34   6.342 -13.267  -7.805
  886   1HG1  ILE  34          1HG1      ILE  34   7.771 -10.812  -6.892
  887   2HG1  ILE  34          2HG1      ILE  34   8.356 -12.377  -6.337
  888   1HG2  ILE  34          1HG2      ILE  34   4.719 -11.828  -8.368
  889   2HG2  ILE  34          2HG2      ILE  34   5.978 -10.602  -8.209
  890   3HG2  ILE  34          3HG2      ILE  34   4.870 -10.911  -6.870
  891   1HD1  ILE  34          1HD1      ILE  34   8.671 -13.105  -8.617
  892   2HD1  ILE  34          2HD1      ILE  34   9.517 -11.582  -8.345
  893   3HD1  ILE  34          3HD1      ILE  34   7.987 -11.597  -9.222
  894    H    LYS  35           H        LYS  35   5.492 -10.791  -4.458
  895    HA   LYS  35           HA       LYS  35   2.555 -11.071  -4.576
  896   1HB   LYS  35          1HB       LYS  35   4.312 -10.052  -2.341
  897   2HB   LYS  35          2HB       LYS  35   2.589  -9.703  -2.425
  898   1HG   LYS  35          1HG       LYS  35   3.604 -12.518  -2.506
  899   2HG   LYS  35          2HG       LYS  35   3.379 -11.667  -0.978
  900   1HD   LYS  35          1HD       LYS  35   1.094 -11.603  -1.195
  901   2HD   LYS  35          2HD       LYS  35   1.153 -11.670  -2.957
  902   1HE   LYS  35          1HE       LYS  35   1.273 -13.938  -3.002
  903   2HE   LYS  35          2HE       LYS  35   2.173 -14.031  -1.489
  904   1HZ   LYS  35          1HZ       LYS  35  -0.648 -13.189  -1.471
  905   2HZ   LYS  35          2HZ       LYS  35   0.258 -13.929  -0.242
  906   3HZ   LYS  35          3HZ       LYS  35  -0.264 -14.838  -1.578
  907    H    ARG  36           H        ARG  36   1.459  -8.854  -4.392
  908    HA   ARG  36           HA       ARG  36   3.137  -6.844  -5.751
  909   1HB   ARG  36          1HB       ARG  36   0.626  -6.180  -6.584
  910   2HB   ARG  36          2HB       ARG  36   1.771  -7.133  -7.515
  911   1HG   ARG  36          1HG       ARG  36   0.324  -8.854  -5.747
  912   2HG   ARG  36          2HG       ARG  36  -0.805  -7.855  -6.666
  913   1HD   ARG  36          1HD       ARG  36  -0.441  -9.034  -8.511
  914   2HD   ARG  36          2HD       ARG  36   1.302  -8.810  -8.367
  915    HE   ARG  36           HE       ARG  36   0.019 -10.874  -6.728
  916   1HH1  ARG  36          1HH1      ARG  36   2.066 -10.033  -9.450
  917   2HH1  ARG  36          2HH1      ARG  36   2.734 -11.635  -9.602
  918   1HH2  ARG  36          1HH2      ARG  36   0.882 -12.983  -6.944
  919   2HH2  ARG  36          2HH2      ARG  36   2.043 -13.315  -8.192
  920    H    VAL  37           H        VAL  37   3.340  -5.004  -4.716
  921    HA   VAL  37           HA       VAL  37   1.253  -4.200  -2.784
  922    HB   VAL  37           HB       VAL  37   4.177  -3.512  -2.492
  923   1HG1  VAL  37          1HG1      VAL  37   3.467  -2.196  -0.860
  924   2HG1  VAL  37          2HG1      VAL  37   2.745  -3.584  -0.045
  925   3HG1  VAL  37          3HG1      VAL  37   1.798  -2.652  -1.204
  926   1HG2  VAL  37          1HG2      VAL  37   3.788  -5.987  -2.380
  927   2HG2  VAL  37          2HG2      VAL  37   2.733  -5.695  -0.998
  928   3HG2  VAL  37          3HG2      VAL  37   4.443  -5.273  -0.906
  929    H    ASN  38           H        ASN  38   0.524  -2.147  -2.905
  930    HA   ASN  38           HA       ASN  38   1.786  -0.385  -4.905
  931   1HB   ASN  38          1HB       ASN  38  -0.509  -0.944  -5.542
  932   2HB   ASN  38          2HB       ASN  38  -1.094  -0.445  -3.957
  933   1HD2  ASN  38          1HD2      ASN  38  -2.157   1.386  -4.119
  934   2HD2  ASN  38          2HD2      ASN  38  -1.701   2.747  -5.090
  935    H    VAL  39           H        VAL  39   2.893   1.221  -4.015
  936    HA   VAL  39           HA       VAL  39   2.313   1.890  -1.220
  937    HB   VAL  39           HB       VAL  39   4.765   3.004  -2.384
  938   1HG1  VAL  39          1HG1      VAL  39   3.854   1.687   0.116
  939   2HG1  VAL  39          2HG1      VAL  39   4.736   3.196  -0.114
  940   3HG1  VAL  39          3HG1      VAL  39   5.579   1.651  -0.256
  941   1HG2  VAL  39          1HG2      VAL  39   5.155   1.110  -3.604
  942   2HG2  VAL  39          2HG2      VAL  39   4.198   0.087  -2.533
  943   3HG2  VAL  39          3HG2      VAL  39   5.814   0.604  -2.048
  944    H    ASN  40           H        ASN  40   2.103   3.958  -0.491
  945    HA   ASN  40           HA       ASN  40   1.582   6.002  -2.542
  946   1HB   ASN  40          1HB       ASN  40   0.047   5.173  -0.349
  947   2HB   ASN  40          2HB       ASN  40   0.744   6.714   0.144
  948   1HD2  ASN  40          1HD2      ASN  40  -1.629   7.185   0.113
  949   2HD2  ASN  40          2HD2      ASN  40  -2.284   7.804  -1.366
  950    H    PHE  41           H        PHE  41   3.318   7.208  -2.849
  951    HA   PHE  41           HA       PHE  41   5.141   7.747  -0.609
  952   1HB   PHE  41          1HB       PHE  41   5.489   8.139  -3.592
  953   2HB   PHE  41          2HB       PHE  41   6.718   8.464  -2.382
  954    HD1  PHE  41           HD1      PHE  41   6.615   6.109  -0.671
  955    HD2  PHE  41           HD2      PHE  41   6.224   6.449  -4.895
  956    HE1  PHE  41           HE1      PHE  41   7.464   3.812  -0.934
  957    HE2  PHE  41           HE2      PHE  41   7.066   4.157  -5.164
  958    HZ   PHE  41           HZ       PHE  41   7.692   2.839  -3.191
  959    H    ASP  42           H        ASP  42   6.154   9.943  -0.614
  960    HA   ASP  42           HA       ASP  42   4.191  12.040  -0.777
  961   1HB   ASP  42          1HB       ASP  42   6.284  11.838   0.804
  962   2HB   ASP  42          2HB       ASP  42   7.135  12.559  -0.560
  963    H    GLU  43           H        GLU  43   4.760  14.060  -2.039
  964    HA   GLU  43           HA       GLU  43   4.874  13.515  -4.794
  965   1HB   GLU  43          1HB       GLU  43   3.980  15.588  -3.509
  966   2HB   GLU  43          2HB       GLU  43   5.636  16.169  -3.611
  967   1HG   GLU  43          1HG       GLU  43   4.581  15.233  -6.161
  968   2HG   GLU  43          2HG       GLU  43   3.677  16.580  -5.470
  969    H    GLU  44           H        GLU  44   7.292  14.706  -2.527
  970    HA   GLU  44           HA       GLU  44   9.406  15.042  -4.357
  971   1HB   GLU  44          1HB       GLU  44   9.001  15.312  -1.571
  972   2HB   GLU  44          2HB       GLU  44  10.387  14.250  -1.788
  973   1HG   GLU  44          1HG       GLU  44  11.653  16.019  -2.143
  974   2HG   GLU  44          2HG       GLU  44  10.713  16.386  -3.589
  975    H    LYS  45           H        LYS  45   8.225  12.244  -2.619
  976    HA   LYS  45           HA       LYS  45  10.538  10.691  -2.776
  977   1HB   LYS  45          1HB       LYS  45   7.713  10.218  -2.126
  978   2HB   LYS  45          2HB       LYS  45   8.595   8.804  -2.684
  979   1HG   LYS  45          1HG       LYS  45  10.369   9.558  -0.940
  980   2HG   LYS  45          2HG       LYS  45   9.020  10.455  -0.240
  981   1HD   LYS  45          1HD       LYS  45   7.732   8.418  -0.022
  982   2HD   LYS  45          2HD       LYS  45   8.998   7.498  -0.836
  983   1HE   LYS  45          1HE       LYS  45  10.006   7.160   1.110
  984   2HE   LYS  45          2HE       LYS  45  10.193   8.902   1.315
  985   1HZ   LYS  45          1HZ       LYS  45   7.940   8.942   2.283
  986   2HZ   LYS  45          2HZ       LYS  45   9.031   8.003   3.184
  987   3HZ   LYS  45          3HZ       LYS  45   7.884   7.251   2.183
  988    H    HIS  46           H        HIS  46   8.143  11.330  -5.189
  989    HA   HIS  46           HA       HIS  46   8.930   9.044  -6.802
  990   1HB   HIS  46          1HB       HIS  46   6.613  10.361  -6.736
  991   2HB   HIS  46          2HB       HIS  46   7.400  11.287  -8.011
  992    HD1  HIS  46           HD1      HIS  46   5.957  10.424  -9.924
  993    HD2  HIS  46           HD2      HIS  46   7.825   7.386  -7.765
  994    HE1  HIS  46           HE1      HIS  46   5.611   8.324 -11.262
  995    HE2  HIS  46           HE2      HIS  46   6.905   6.544 -10.040
  996    H    THR  47           H        THR  47   9.332  12.567  -6.898
  997    HA   THR  47           HA       THR  47  10.955  12.613  -9.217
  998    HB   THR  47           HB       THR  47  11.457  14.744  -7.274
  999    HG1  THR  47           HG1      THR  47   9.386  15.352  -6.941
 1000   1HG2  THR  47          1HG2      THR  47  10.568  16.111  -9.186
 1001   2HG2  THR  47          2HG2      THR  47  10.306  14.603 -10.064
 1002   3HG2  THR  47          3HG2      THR  47  11.939  15.081  -9.597
 1003    H    ARG  48           H        ARG  48  11.583  12.219  -5.802
 1004    HA   ARG  48           HA       ARG  48  14.424  12.367  -5.888
 1005   1HB   ARG  48          1HB       ARG  48  12.414  11.906  -3.934
 1006   2HB   ARG  48          2HB       ARG  48  13.512  10.537  -3.875
 1007   1HG   ARG  48          1HG       ARG  48  14.761  11.789  -2.538
 1008   2HG   ARG  48          2HG       ARG  48  15.218  12.685  -3.989
 1009   1HD   ARG  48          1HD       ARG  48  13.860  14.443  -3.502
 1010   2HD   ARG  48          2HD       ARG  48  12.677  13.437  -2.670
 1011    HE   ARG  48           HE       ARG  48  13.784  13.788  -0.699
 1012   1HH1  ARG  48          1HH1      ARG  48  15.809  14.811  -3.373
 1013   2HH1  ARG  48          2HH1      ARG  48  17.036  15.504  -2.352
 1014   1HH2  ARG  48          1HH2      ARG  48  15.376  14.745   0.657
 1015   2HH2  ARG  48          2HH2      ARG  48  16.783  15.484  -0.063
 1016    H    PHE  49           H        PHE  49  12.070   9.751  -6.164
 1017    HA   PHE  49           HA       PHE  49  13.888   7.616  -6.283
 1018   1HB   PHE  49          1HB       PHE  49  11.150   7.847  -6.287
 1019   2HB   PHE  49          2HB       PHE  49  11.481   7.272  -7.920
 1020    HD1  PHE  49           HD1      PHE  49  14.029   6.229  -5.742
 1021    HD2  PHE  49           HD2      PHE  49  10.040   5.335  -6.923
 1022    HE1  PHE  49           HE1      PHE  49  14.296   3.940  -4.891
 1023    HE2  PHE  49           HE2      PHE  49  10.303   3.040  -6.076
 1024    HZ   PHE  49           HZ       PHE  49  12.439   2.341  -5.062
 1025    H    LYS  50           H        LYS  50  12.613   9.746  -8.773
 1026    HA   LYS  50           HA       LYS  50  13.667   8.392 -11.013
 1027   1HB   LYS  50          1HB       LYS  50  12.487  11.004 -10.442
 1028   2HB   LYS  50          2HB       LYS  50  13.714  11.067 -11.702
 1029   1HG   LYS  50          1HG       LYS  50  11.626   8.955 -11.841
 1030   2HG   LYS  50          2HG       LYS  50  11.197  10.610 -12.271
 1031   1HD   LYS  50          1HD       LYS  50  11.952  10.092 -14.312
 1032   2HD   LYS  50          2HD       LYS  50  13.562  10.245 -13.607
 1033   1HE   LYS  50          1HE       LYS  50  13.070   7.727 -12.919
 1034   2HE   LYS  50          2HE       LYS  50  12.023   7.816 -14.335
 1035   1HZ   LYS  50          1HZ       LYS  50  13.770   7.966 -15.729
 1036   2HZ   LYS  50          2HZ       LYS  50  14.595   7.192 -14.466
 1037   3HZ   LYS  50          3HZ       LYS  50  14.718   8.871 -14.650
 1038    H    ALA  51           H        ALA  51  14.967  10.928  -8.926
 1039    HA   ALA  51           HA       ALA  51  17.441  11.252 -10.265
 1040   1HB   ALA  51          1HB       ALA  51  16.224  12.608  -8.301
 1041   2HB   ALA  51          2HB       ALA  51  17.958  12.718  -8.619
 1042   3HB   ALA  51          3HB       ALA  51  17.359  11.660  -7.340
 1043    H    ALA  52           H        ALA  52  16.408   9.205  -7.567
 1044    HA   ALA  52           HA       ALA  52  18.898   8.083  -6.939
 1045   1HB   ALA  52          1HB       ALA  52  17.595   7.326  -5.309
 1046   2HB   ALA  52          2HB       ALA  52  17.001   6.103  -6.433
 1047   3HB   ALA  52          3HB       ALA  52  16.137   7.630  -6.254
 1048    H    CYS  53           H        CYS  53  16.448   7.127  -9.293
 1049    HA   CYS  53           HA       CYS  53  17.657   4.706 -10.104
 1050   1HB   CYS  53          1HB       CYS  53  15.842   6.586 -11.627
 1051   2HB   CYS  53          2HB       CYS  53  16.269   4.960 -12.150
 1052    HG   CYS  53           HG       CYS  53  14.472   5.766  -9.351
 1053    H    ALA  54           H        ALA  54  18.074   8.054 -11.078
 1054    HA   ALA  54           HA       ALA  54  19.838   7.472 -13.261
 1055   1HB   ALA  54          1HB       ALA  54  19.927   9.734 -13.617
 1056   2HB   ALA  54          2HB       ALA  54  19.867  10.118 -11.895
 1057   3HB   ALA  54          3HB       ALA  54  18.403   9.614 -12.739
 1058    H    ARG  55           H        ARG  55  20.170   8.006  -9.844
 1059    HA   ARG  55           HA       ARG  55  22.941   8.595  -9.817
 1060   1HB   ARG  55          1HB       ARG  55  20.949   7.752  -7.742
 1061   2HB   ARG  55          2HB       ARG  55  22.659   7.813  -7.342
 1062   1HG   ARG  55          1HG       ARG  55  21.486  10.197  -8.643
 1063   2HG   ARG  55          2HG       ARG  55  21.027   9.868  -6.970
 1064   1HD   ARG  55          1HD       ARG  55  23.058  10.404  -6.180
 1065   2HD   ARG  55          2HD       ARG  55  23.893   9.601  -7.510
 1066    HE   ARG  55           HE       ARG  55  23.779  11.575  -8.769
 1067   1HH1  ARG  55          1HH1      ARG  55  22.311  11.953  -5.607
 1068   2HH1  ARG  55          2HH1      ARG  55  22.395  13.692  -5.639
 1069   1HH2  ARG  55          1HH2      ARG  55  23.879  13.859  -8.816
 1070   2HH2  ARG  55          2HH2      ARG  55  23.296  14.775  -7.460
 1071    H    LYS  56           H        LYS  56  21.113   5.599  -9.291
 1072    HA   LYS  56           HA       LYS  56  23.628   4.135  -9.031
 1073   1HB   LYS  56          1HB       LYS  56  20.799   3.161  -8.633
 1074   2HB   LYS  56          2HB       LYS  56  22.270   2.303  -8.199
 1075   1HG   LYS  56          1HG       LYS  56  22.044   4.971  -7.022
 1076   2HG   LYS  56          2HG       LYS  56  20.803   3.829  -6.502
 1077   1HD   LYS  56          1HD       LYS  56  22.733   2.200  -6.102
 1078   2HD   LYS  56          2HD       LYS  56  23.787   3.611  -6.233
 1079   1HE   LYS  56          1HE       LYS  56  22.398   4.693  -4.450
 1080   2HE   LYS  56          2HE       LYS  56  21.566   3.154  -4.246
 1081   1HZ   LYS  56          1HZ       LYS  56  23.179   2.966  -2.668
 1082   2HZ   LYS  56          2HZ       LYS  56  24.306   3.898  -3.531
 1083   3HZ   LYS  56          3HZ       LYS  56  24.011   2.291  -3.983
 1084    H    GLY  57           H        GLY  57  21.376   4.851 -11.423
 1085   1HA   GLY  57          1HA       GLY  57  21.220   4.119 -13.612
 1086   2HA   GLY  57          2HA       GLY  57  22.558   3.019 -13.298
 1087    H    THR  58           H        THR  58  19.574   3.217 -11.488
 1088    HA   THR  58           HA       THR  58  19.097   0.388 -12.087
 1089    HB   THR  58           HB       THR  58  17.507   0.967  -9.952
 1090    HG1  THR  58           HG1      THR  58  18.138   2.876  -9.254
 1091   1HG2  THR  58          1HG2      THR  58  20.437   0.328  -9.674
 1092   2HG2  THR  58          2HG2      THR  58  19.242  -0.842 -10.238
 1093   3HG2  THR  58          3HG2      THR  58  19.117  -0.163  -8.614
 1094    H    SER  59           H        SER  59  17.040  -0.383 -12.623
 1095    HA   SER  59           HA       SER  59  15.234   1.430 -13.911
 1096   1HB   SER  59          1HB       SER  59  14.126  -1.185 -13.224
 1097   2HB   SER  59          2HB       SER  59  14.370  -0.453 -14.811
 1098    HG   SER  59           HG       SER  59  16.451  -1.195 -14.842
 1099    H    ILE  60           H        ILE  60  13.005   1.793 -13.264
 1100    HA   ILE  60           HA       ILE  60  12.800   2.671 -10.620
 1101    HB   ILE  60           HB       ILE  60  11.476   3.455 -12.657
 1102   1HG1  ILE  60          1HG1      ILE  60   9.355   3.761 -11.051
 1103   2HG1  ILE  60          2HG1      ILE  60  10.509   3.175  -9.858
 1104   1HG2  ILE  60          1HG2      ILE  60  10.107   0.908 -12.071
 1105   2HG2  ILE  60          2HG2      ILE  60  10.297   1.772 -13.596
 1106   3HG2  ILE  60          3HG2      ILE  60   9.077   2.291 -12.435
 1107   1HD1  ILE  60          1HD1      ILE  60  11.115   5.482 -11.677
 1108   2HD1  ILE  60          2HD1      ILE  60  11.936   5.010 -10.189
 1109   3HD1  ILE  60          3HD1      ILE  60  10.306   5.677 -10.123
 1110    H    THR  61           H        THR  61  12.153  -0.443 -11.950
 1111    HA   THR  61           HA       THR  61  10.572  -1.303  -9.681
 1112    HB   THR  61           HB       THR  61  11.513  -3.481 -11.295
 1113    HG1  THR  61           HG1      THR  61  10.564  -2.692 -13.310
 1114   1HG2  THR  61          1HG2      THR  61   8.765  -2.281 -11.431
 1115   2HG2  THR  61          2HG2      THR  61   9.324  -3.087  -9.964
 1116   3HG2  THR  61          3HG2      THR  61   9.237  -3.980 -11.483
 1117    H    ASP  62           H        ASP  62  13.824  -1.578 -10.938
 1118    HA   ASP  62           HA       ASP  62  14.762  -3.605  -9.209
 1119   1HB   ASP  62          1HB       ASP  62  15.808  -2.724 -11.390
 1120   2HB   ASP  62          2HB       ASP  62  16.509  -1.456 -10.390
 1121    H    VAL  63           H        VAL  63  14.707  -0.068  -8.937
 1122    HA   VAL  63           HA       VAL  63  16.360   0.144  -6.674
 1123    HB   VAL  63           HB       VAL  63  14.711   2.191  -6.187
 1124   1HG1  VAL  63          1HG1      VAL  63  17.201   1.941  -7.098
 1125   2HG1  VAL  63          2HG1      VAL  63  16.358   3.487  -6.991
 1126   3HG1  VAL  63          3HG1      VAL  63  16.442   2.630  -8.534
 1127   1HG2  VAL  63          1HG2      VAL  63  14.421   1.810  -9.159
 1128   2HG2  VAL  63          2HG2      VAL  63  13.741   3.098  -8.164
 1129   3HG2  VAL  63          3HG2      VAL  63  13.154   1.444  -7.987
 1130    H    VAL  64           H        VAL  64  12.839  -0.266  -6.929
 1131    HA   VAL  64           HA       VAL  64  12.315  -0.110  -4.169
 1132    HB   VAL  64           HB       VAL  64  10.651  -1.878  -5.920
 1133   1HG1  VAL  64          1HG1      VAL  64  10.368  -0.978  -3.368
 1134   2HG1  VAL  64          2HG1      VAL  64   9.037  -1.491  -4.406
 1135   3HG1  VAL  64          3HG1      VAL  64   9.440   0.222  -4.267
 1136   1HG2  VAL  64          1HG2      VAL  64  11.350   0.206  -7.196
 1137   2HG2  VAL  64          2HG2      VAL  64  10.423   1.118  -6.004
 1138   3HG2  VAL  64          3HG2      VAL  64   9.617  -0.074  -7.024
 1139    H    ASN  65           H        ASN  65  13.004  -2.873  -6.279
 1140    HA   ASN  65           HA       ASN  65  12.804  -4.879  -4.305
 1141   1HB   ASN  65          1HB       ASN  65  12.933  -5.840  -6.383
 1142   2HB   ASN  65          2HB       ASN  65  14.042  -4.620  -6.996
 1143   1HD2  ASN  65          1HD2      ASN  65  16.102  -5.151  -7.223
 1144   2HD2  ASN  65          2HD2      ASN  65  16.860  -6.562  -6.554
 1145    H    GLN  66           H        GLN  66  15.344  -2.650  -5.195
 1146    HA   GLN  66           HA       GLN  66  17.455  -3.821  -3.729
 1147   1HB   GLN  66          1HB       GLN  66  17.191  -1.704  -5.481
 1148   2HB   GLN  66          2HB       GLN  66  17.585  -0.919  -3.959
 1149   1HG   GLN  66          1HG       GLN  66  19.702  -1.543  -4.079
 1150   2HG   GLN  66          2HG       GLN  66  19.265  -3.219  -4.427
 1151   1HE2  GLN  66          1HE2      GLN  66  17.750  -2.510  -6.814
 1152   2HE2  GLN  66          2HE2      GLN  66  18.936  -2.162  -8.023
 1153    H    LEU  67           H        LEU  67  15.290  -1.071  -2.929
 1154    HA   LEU  67           HA       LEU  67  16.424  -0.676  -0.385
 1155   1HB   LEU  67          1HB       LEU  67  13.933   0.285   0.018
 1156   2HB   LEU  67          2HB       LEU  67  15.244   1.181  -0.719
 1157    HG   LEU  67           HG       LEU  67  14.042  -0.165  -2.842
 1158   1HD1  LEU  67          1HD1      LEU  67  12.043   0.764  -0.813
 1159   2HD1  LEU  67          2HD1      LEU  67  12.088  -0.752  -1.712
 1160   3HD1  LEU  67          3HD1      LEU  67  11.671   0.751  -2.537
 1161   1HD2  LEU  67          1HD2      LEU  67  14.361   2.575  -1.841
 1162   2HD2  LEU  67          2HD2      LEU  67  13.020   2.346  -2.966
 1163   3HD2  LEU  67          3HD2      LEU  67  14.659   1.910  -3.447
 1164    H    VAL  68           H        VAL  68  13.867  -2.802  -1.495
 1165    HA   VAL  68           HA       VAL  68  12.869  -3.555   1.050
 1166    HB   VAL  68           HB       VAL  68  12.959  -5.133  -1.532
 1167   1HG1  VAL  68          1HG1      VAL  68  11.836  -6.837  -0.568
 1168   2HG1  VAL  68          2HG1      VAL  68  10.959  -5.777   0.530
 1169   3HG1  VAL  68          3HG1      VAL  68  12.617  -6.244   0.898
 1170   1HG2  VAL  68          1HG2      VAL  68  10.379  -4.523  -1.156
 1171   2HG2  VAL  68          2HG2      VAL  68  11.489  -3.510  -2.076
 1172   3HG2  VAL  68          3HG2      VAL  68  11.127  -3.121  -0.396
 1173    H    ASP  69           H        ASP  69  15.456  -4.791  -1.009
 1174    HA   ASP  69           HA       ASP  69  16.233  -6.949   0.650
 1175   1HB   ASP  69          1HB       ASP  69  16.898  -6.600  -1.764
 1176   2HB   ASP  69          2HB       ASP  69  18.021  -5.362  -1.199
 1177    H    ASN  70           H        ASN  70  17.362  -3.617   0.339
 1178    HA   ASN  70           HA       ASN  70  19.413  -3.637   2.220
 1179   1HB   ASN  70          1HB       ASN  70  19.368  -1.676   1.000
 1180   2HB   ASN  70          2HB       ASN  70  17.614  -1.543   1.076
 1181   1HD2  ASN  70          1HD2      ASN  70  20.531  -1.291   3.062
 1182   2HD2  ASN  70          2HD2      ASN  70  19.916  -0.054   4.108
 1183    H    TRP  71           H        TRP  71  16.020  -2.692   2.675
 1184    HA   TRP  71           HA       TRP  71  16.129  -2.260   5.434
 1185   1HB   TRP  71          1HB       TRP  71  14.294  -1.535   3.938
 1186   2HB   TRP  71          2HB       TRP  71  13.781  -3.210   3.786
 1187    HD1  TRP  71           HD1      TRP  71  13.929  -0.363   6.346
 1188    HE1  TRP  71           HE1      TRP  71  12.199  -0.835   8.195
 1189    HE3  TRP  71           HE3      TRP  71  12.475  -5.038   4.893
 1190    HZ2  TRP  71           HZ2      TRP  71  10.439  -2.924   8.931
 1191    HZ3  TRP  71           HZ3      TRP  71  10.748  -6.202   6.208
 1192    HH2  TRP  71           HH2      TRP  71   9.748  -5.164   8.189
 1193    H    LEU  72           H        LEU  72  15.375  -5.178   3.586
 1194    HA   LEU  72           HA       LEU  72  14.560  -6.785   5.710
 1195   1HB   LEU  72          1HB       LEU  72  14.902  -7.077   2.984
 1196   2HB   LEU  72          2HB       LEU  72  16.033  -8.234   3.662
 1197    HG   LEU  72           HG       LEU  72  13.799  -8.752   5.133
 1198   1HD1  LEU  72          1HD1      LEU  72  12.488  -8.785   2.557
 1199   2HD1  LEU  72          2HD1      LEU  72  12.858  -7.143   3.084
 1200   3HD1  LEU  72          3HD1      LEU  72  11.903  -8.205   4.116
 1201   1HD2  LEU  72          1HD2      LEU  72  15.328  -9.979   3.049
 1202   2HD2  LEU  72          2HD2      LEU  72  13.621 -10.368   2.837
 1203   3HD2  LEU  72          3HD2      LEU  72  14.426 -10.736   4.364
 1204    H    LYS  73           H        LYS  73  17.786  -5.998   4.587
 1205    HA   LYS  73           HA       LYS  73  18.952  -7.982   6.371
 1206   1HB   LYS  73          1HB       LYS  73  20.314  -6.040   4.500
 1207   2HB   LYS  73          2HB       LYS  73  21.074  -7.396   5.328
 1208   1HG   LYS  73          1HG       LYS  73  19.703  -8.962   4.077
 1209   2HG   LYS  73          2HG       LYS  73  18.866  -7.625   3.289
 1210   1HD   LYS  73          1HD       LYS  73  20.620  -7.163   1.904
 1211   2HD   LYS  73          2HD       LYS  73  21.826  -7.684   3.082
 1212   1HE   LYS  73          1HE       LYS  73  21.785  -9.207   1.192
 1213   2HE   LYS  73          2HE       LYS  73  21.220 -10.025   2.648
 1214   1HZ   LYS  73          1HZ       LYS  73  18.955  -9.765   1.910
 1215   2HZ   LYS  73          2HZ       LYS  73  19.852 -10.521   0.688
 1216   3HZ   LYS  73          3HZ       LYS  73  19.450  -8.881   0.550
 1217    H    GLU  74           H        GLU  74  18.336  -4.580   6.261
 1218    HA   GLU  74           HA       GLU  74  20.251  -3.935   8.322
 1219   1HB   GLU  74          1HB       GLU  74  18.158  -2.396   6.822
 1220   2HB   GLU  74          2HB       GLU  74  18.904  -1.706   8.258
 1221   1HG   GLU  74          1HG       GLU  74  20.481  -2.730   5.920
 1222   2HG   GLU  74          2HG       GLU  74  19.930  -1.062   6.058
 1223    H    ASN  75           H        ASN  75  16.738  -4.242   8.075
 1224    HA   ASN  75           HA       ASN  75  16.314  -3.582  10.826
 1225   1HB   ASN  75          1HB       ASN  75  14.162  -3.350  10.221
 1226   2HB   ASN  75          2HB       ASN  75  14.741  -3.578   8.574
 1227   1HD2  ASN  75          1HD2      ASN  75  14.469  -5.589   7.576
 1228   2HD2  ASN  75          2HD2      ASN  75  13.332  -6.749   8.174
 1229    H    GLU  76           H        GLU  76  17.119  -6.470   9.194
 1230    HA   GLU  76           HA       GLU  76  15.843  -8.331  10.917
 1231   1HB   GLU  76          1HB       GLU  76  17.150  -8.541   8.544
 1232   2HB   GLU  76          2HB       GLU  76  18.375  -9.159   9.644
 1233   1HG   GLU  76          1HG       GLU  76  15.763 -10.276  10.194
 1234   2HG   GLU  76          2HG       GLU  76  16.281 -10.574   8.536