*HEADER    TRANSFERASE                             24-APR-07   2PNG              
*TITLE     TYPE I RAT FATTY ACID SYNTHASE ACYL CARRIER PROTEIN (ACP)             
*TITLE    2 DOMAIN                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FATTY ACID SYNTHASE (EC 2.3.1.85);                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 2114-2202, ACYL CARRIER PROTEIN;                  
*COMPND   5 EC: 2.3.1.85;                                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
*SOURCE   3 ORGANISM_COMMON: RAT;                                                
*SOURCE   4 GENE: FASN;                                                          
*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: PET15B                                    
*KEYWDS    ACYL CARRIER PROTEIN, HELICAL BUNDLE, FATTY ACID SYNTHASE             
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    E.A.PLOSKON, C.J.ARTHUR, S.E.EVANS, C.WILLIAMS, J.CROSBY,             
*AUTHOR   2 M.P.CRUMP                                                            
*REVDAT   1   05-JUN-07 2PNG    0                                                


 ASSI {   62}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 54   and name HN  ))
      2.700     2.700     3.300 peak    62 spectrum    1 weight  0.10000E+01 volume  0.81127E-03 ppm1      0.797 ppm2      7.637 CV     1
 OR {   62}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 53   and name HN  ))
 ASSI {  135}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HG1 ))
      2.400     0.700     0.700 peak   135 spectrum    1 weight  0.10000E+01 volume  0.48179E-02 ppm1      3.179 ppm2      1.607 CV     1
 OR {  135}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HG1 ))
 OR {  135}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {  135}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HG2 ))
 OR {  135}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HG1 ))
 OR {  135}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HG1 ))
 ASSI {  365}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      4.200     2.300     1.800 peak   365 spectrum    1 weight  0.10000E+01 volume  0.72018E-03 ppm1      4.482 ppm2      3.877 CV     1
 OR {  365}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 29   and name HB1 ))
 ASSI {  455}
   (  segid "    " and resid 32   and name HB% )
   (  segid "    " and resid 36   and name HD2%)
      3.500     1.600     1.600 peak   455 spectrum    1 weight  0.10000E+01 volume  0.15196E-02 ppm1      1.380 ppm2      0.745 CV     1
 OR {  455}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 25   and name HD1%)
 OR {  455}
   (  segid "    " and resid 23   and name HB% )
   (  segid "    " and resid 22   and name HD2%)
 ASSI {  537}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 66   and name HB2 ))
      4.000     2.000     2.000 peak   537 spectrum    1 weight  0.10000E+01 volume  0.54334E-03 ppm1      0.770 ppm2      1.287 CV     1
 OR {  537}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 66   and name HB2 ))
 OR {  537}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 25   and name HG12))
 OR {  537}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 25   and name HG12))
 ASSI {  544}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 14   and name HA  ))
      4.000     2.000     2.000 peak   544 spectrum    1 weight  0.10000E+01 volume  0.55890E-03 ppm1      0.771 ppm2      3.871 CV     1
 OR {  544}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 14   and name HA  ))
 OR {  544}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
 OR {  544}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 70   and name HA  ))
 OR {  544}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
 OR {  544}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
 ASSI {  582}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 64   and name HD2%)
      4.000     2.000     2.000 peak   582 spectrum    1 weight  0.10000E+01 volume  0.28869E-03 ppm1      1.888 ppm2      0.791 CV     1
 OR {  582}
   (( segid "    " and resid 72   and name HB2 ))
   (  segid "    " and resid 69   and name HD1%)
 OR {  582}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 17   and name HD1%)
 OR {  582}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 13   and name HG1%)
 OR {  582}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 17   and name HD2%)
 ASSI {  677}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 7    and name HN  ))
      3.100     3.100     2.900 peak   677 spectrum    1 weight  0.10000E+01 volume  0.81583E-03 ppm1      0.902 ppm2      8.414 CV     1
 OR {  677}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 45   and name HN  ))
 OR {  677}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 44   and name HN  ))
 OR {  677}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  680}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 43   and name HN  ))
      3.900     1.900     1.900 peak   680 spectrum    1 weight  0.10000E+01 volume  0.56817E-03 ppm1      0.902 ppm2      7.360 CV     1
 OR {  680}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 42   and name HN  ))
 OR {  680}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 50   and name HE  ))
 ASSI {  766}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HG11))
      2.900     1.100     1.100 peak   766 spectrum    1 weight  0.10000E+01 volume  0.53221E-02 ppm1      0.700 ppm2      1.433 CV     1
 OR {  766}
   (  segid "    " and resid 19   and name HG2%)
   (  segid "    " and resid 14   and name HB% )
 ASSI {  779}
   (( segid "    " and resid 41   and name HA1 ))
   (  segid "    " and resid 61   and name HG1%)
      4.100     2.100     1.900 peak   779 spectrum    1 weight  0.10000E+01 volume  0.59949E-03 ppm1      3.782 ppm2      0.792 CV     1
 OR {  779}
   (( segid "    " and resid 41   and name HA1 ))
   (  segid "    " and resid 58   and name HD1%)
 OR {  779}
   (( segid "    " and resid 41   and name HA1 ))
   (  segid "    " and resid 64   and name HD1%)
 ASSI {  780}
   (( segid "    " and resid 41   and name HA2 ))
   (  segid "    " and resid 61   and name HG1%)
      3.400     1.400     1.400 peak   780 spectrum    1 weight  0.10000E+01 volume  0.60776E-03 ppm1      3.491 ppm2      0.793 CV     1
 OR {  780}
   (( segid "    " and resid 41   and name HA2 ))
   (  segid "    " and resid 58   and name HD1%)
 OR {  780}
   (( segid "    " and resid 41   and name HA2 ))
   (  segid "    " and resid 64   and name HD1%)
 ASSI {  799}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HB1 ))
      2.900     1.100     1.100 peak   799 spectrum    1 weight  0.10000E+01 volume  0.18228E-02 ppm1      3.149 ppm2      1.854 CV     1
 OR {  799}
   (( segid "    " and resid 7    and name HD1 ))
   (( segid "    " and resid 7    and name HB1 ))
 OR {  799}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HB2 ))
 OR {  799}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HB1 ))
 OR {  799}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HB2 ))
 OR {  799}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 1015}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 44   and name HN  ))
      2.500     2.500     3.500 peak  1015 spectrum    1 weight  0.10000E+01 volume  0.13422E-02 ppm1      0.773 ppm2      8.414 CV     1
 OR { 1015}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 45   and name HN  ))
 ASSI { 1019}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 46   and name HB2 ))
      2.200     2.200     3.800 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.25283E-02 ppm1      0.769 ppm2      2.109 CV     1
 OR { 1019}
   (  segid "    " and resid 16   and name HD1%)
   (( segid "    " and resid 43   and name HB2 ))
 OR { 1019}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 43   and name HB2 ))
 ASSI { 1062}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      2.900     1.100     1.100 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.13661E-02 ppm1      4.070 ppm2      1.311 CV     1
 OR { 1062}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HG11))
 OR { 1062}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HG12))
 ASSI { 1139}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 9    and name HD2%)
      3.400     1.400     1.400 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.49790E-03 ppm1      2.009 ppm2      0.705 CV     1
 OR { 1139}
   (( segid "    " and resid 72   and name HB1 ))
   (  segid "    " and resid 48   and name HD1%)
 ASSI { 1173}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      3.600     1.600     1.600 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.11229E-02 ppm1      4.037 ppm2      7.908 CV     1
 OR { 1173}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 1204}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 19   and name HD1%)
      3.800     1.800     1.800 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.10890E-02 ppm1      1.296 ppm2      0.842 CV     1
 OR { 1204}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 69   and name HD2%)
 OR { 1204}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 27   and name HD2%)
 ASSI { 1209}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 19   and name HD1%)
      3.700     1.700     1.700 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.44286E-03 ppm1      1.952 ppm2      0.842 CV     1
 OR { 1209}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 69   and name HD2%)
 OR { 1209}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 27   and name HD2%)
 ASSI { 1222}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      2.700     0.900     0.900 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.32249E-02 ppm1      4.036 ppm2      7.983 CV     1
 OR { 1222}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
 OR { 1222}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 1290}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      4.700     2.700     1.300 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.54004E-03 ppm1      4.050 ppm2      6.393 CV     1
 OR { 1290}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 1532}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.400     1.500     1.500 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.64373E-03 ppm1      4.305 ppm2      7.712 CV     1
 OR { 1532}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
 ASSI { 1579}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 48   and name HA  ))
      3.900     1.900     1.900 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.62309E-03 ppm1      3.417 ppm2      3.967 CV     1
 OR { 1579}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 1580}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 48   and name HA  ))
      3.300     1.400     1.400 peak  1580 spectrum    1 weight  0.10000E+01 volume  0.88722E-03 ppm1      3.041 ppm2      3.966 CV     1
 OR { 1580}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 74   and name HB1 ))
 ASSI { 1609}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 34   and name HD2%)
      4.600     2.600     1.400 peak  1609 spectrum    1 weight  0.10000E+01 volume  0.46331E-03 ppm1      4.371 ppm2      0.867 CV     1
 OR { 1609}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
 OR { 1609}
   (( segid "    " and resid 51   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 1785}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 31   and name HB2 ))
      3.500     1.500     1.500 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.14291E-02 ppm1      0.846 ppm2      1.297 CV     1
 OR { 1785}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1785}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 25   and name HG11))
 ASSI { 1804}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 66   and name HB2 ))
      4.200     2.200     1.800 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.79840E-03 ppm1      0.938 ppm2      1.303 CV     1
 OR { 1804}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 66   and name HB2 ))
 OR { 1804}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 31   and name HB2 ))
 OR { 1804}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 27   and name HB2 ))
 ASSI { 1805}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 69   and name HB2 ))
      2.700     0.900     0.900 peak  1805 spectrum    1 weight  0.10000E+01 volume  0.18868E-02 ppm1      0.938 ppm2      1.150 CV     1
 OR { 1805}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 69   and name HB2 ))
 ASSI { 1987}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 19   and name HD1%)
      5.000     3.200     1.000 peak  1987 spectrum    1 weight  0.10000E+01 volume  0.35492E-03 ppm1      3.979 ppm2      0.863 CV     1
 OR { 1987}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 27   and name HD2%)
 ASSI { 2003}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 67   and name HA  ))
      4.200     2.200     1.800 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.67618E-03 ppm1      0.866 ppm2      3.804 CV     1
 OR { 2003}
   (  segid "    " and resid 31   and name HD2%)
   (( segid "    " and resid 41   and name HA1 ))
 ASSI { 2005}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 70   and name HE21))
      4.500     2.500     1.500 peak  2005 spectrum    1 weight  0.10000E+01 volume  0.45911E-03 ppm1      0.706 ppm2      6.604 CV     1
 OR { 2005}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 70   and name HE21))
 ASSI { 2077}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 42   and name HN  ))
      5.000     3.100     1.000 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.24755E-03 ppm1      0.717 ppm2      7.371 CV     1
 OR { 2077}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 43   and name HN  ))
 ASSI { 2092}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 32   and name HA  ))
      3.000     3.000     3.000 peak  2092 spectrum    1 weight  0.10000E+01 volume  0.43032E-03 ppm1      0.858 ppm2      4.060 CV     1
 OR { 2092}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 27   and name HA  ))
 OR { 2092}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 66   and name HA  ))
 ASSI { 2207}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      4.300     2.300     1.700 peak  2207 spectrum    1 weight  0.10000E+01 volume  0.23430E-03 ppm1      4.172 ppm2      8.362 CV     1
 OR { 2207}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
 ASSI { 2245}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      4.000     2.000     2.000 peak  2245 spectrum    1 weight  0.10000E+01 volume  0.37465E-03 ppm1      3.966 ppm2      7.635 CV     1
 OR { 2245}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 2268}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 54   and name HN  ))
      4.800     2.900     1.200 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.32870E-03 ppm1      0.669 ppm2      7.633 CV     1
 OR { 2268}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 53   and name HN  ))
 ASSI { 2474}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 32   and name HA  ))
      3.700     1.700     1.700 peak  2474 spectrum    1 weight  0.10000E+01 volume  0.10199E-02 ppm1      0.880 ppm2      4.095 CV     1
 OR { 2474}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 2574}
   (( segid "    " and resid 62   and name HB1 ))
   (  segid "    " and resid 36   and name HD2%)
      4.600     2.700     1.400 peak  2574 spectrum    1 weight  0.10000E+01 volume  0.36382E-03 ppm1      1.865 ppm2      0.738 CV     1
 OR { 2574}
   (( segid "    " and resid 20   and name HB1 ))
   (  segid "    " and resid 22   and name HD2%)
 ASSI { 2636}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 72   and name HB2 ))
      3.200     1.200     1.200 peak  2636 spectrum    1 weight  0.10000E+01 volume  0.12200E-02 ppm1      0.788 ppm2      1.927 CV     1
 OR { 2636}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 2636}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 63   and name HB2 ))
 ASSI { 2840}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 16   and name HG11))
      4.100     2.100     1.900 peak  2840 spectrum    1 weight  0.10000E+01 volume  0.44196E-03 ppm1      0.766 ppm2      1.779 CV     1
 OR { 2840}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HG1 ))
 OR { 2840}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 3025}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 47   and name HD1%)
      2.600     0.800     0.800 peak  3025 spectrum    1 weight  0.10000E+01 volume  0.36778E-02 ppm1      3.455 ppm2      0.791 CV     1
 OR { 3025}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 61   and name HG1%)
 ASSI { 3035}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 17   and name HN  ))
      5.000     3.100     1.000 peak  3035 spectrum    1 weight  0.10000E+01 volume  0.24087E-03 ppm1      0.995 ppm2      7.711 CV     1
 OR { 3035}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 73   and name HN  ))
 OR { 3035}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 18   and name HN  ))
 ASSI { 3042}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 66   and name HG  ))
      5.100     3.300     0.900 peak  3042 spectrum    1 weight  0.10000E+01 volume  0.31649E-03 ppm1      0.700 ppm2      1.726 CV     1
 OR { 3042}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 20   and name HB2 ))
 ASSI { 3063}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 11   and name HE2 ))
      3.200     3.200     2.800 peak  3063 spectrum    1 weight  0.10000E+01 volume  0.33779E-03 ppm1      0.746 ppm2      2.941 CV     1
 OR { 3063}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 11   and name HE1 ))
 OR { 3063}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 68   and name HE1 ))
 ASSI { 3066}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 19   and name HA  ))
      3.700     1.800     1.800 peak  3066 spectrum    1 weight  0.10000E+01 volume  0.22505E-03 ppm1      0.746 ppm2      3.884 CV     1
 OR { 3066}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 24   and name HA1 ))
 ASSI { 3070}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 14   and name HN  ))
      4.800     2.900     1.200 peak  3070 spectrum    1 weight  0.10000E+01 volume  0.31583E-03 ppm1      0.750 ppm2      8.820 CV     1
 OR { 3070}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 66   and name HN  ))
 ASSI { 3078}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 45   and name HE  ))
      5.900     4.400     0.100 peak  3078 spectrum    1 weight  0.10000E+01 volume  0.99912E-04 ppm1      0.738 ppm2      7.372 CV     1
 OR { 3078}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 43   and name HN  ))
 OR { 3078}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 42   and name HN  ))
 OR { 3078}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 3095}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 43   and name HG1 ))
      4.900     3.100     1.100 peak  3095 spectrum    1 weight  0.10000E+01 volume  0.45105E-03 ppm1      0.902 ppm2      2.403 CV     1
 OR { 3095}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 43   and name HG1 ))
 ASSI { 3098}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      5.100     3.300     0.900 peak  3098 spectrum    1 weight  0.10000E+01 volume  0.18735E-03 ppm1      0.903 ppm2      4.149 CV     1
 OR { 3098}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 36   and name HA  ))
 ASSI { 3107}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 17   and name HB1 ))
      5.200     3.400     0.800 peak  3107 spectrum    1 weight  0.10000E+01 volume  0.58128E-03 ppm1      1.422 ppm2      1.808 CV     1
 OR { 3107}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 16   and name HG11))
 ASSI { 3114}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 10   and name HA  ))
      4.100     2.100     1.900 peak  3114 spectrum    1 weight  0.10000E+01 volume  0.12156E-02 ppm1      1.468 ppm2      3.328 CV     1
 OR { 3114}
   (( segid "    " and resid 19   and name HG11))
   (( segid "    " and resid 10   and name HA  ))
 ASSI { 3118}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 58   and name HN  ))
      5.000     3.200     1.000 peak  3118 spectrum    1 weight  0.10000E+01 volume  0.56373E-03 ppm1      1.470 ppm2      8.927 CV     1
 OR { 3118}
   (( segid "    " and resid 19   and name HG11))
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 3119}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 67   and name HD1 ))
      3.700     3.700     2.300 peak  3119 spectrum    1 weight  0.10000E+01 volume  0.98296E-03 ppm1      1.600 ppm2      3.323 CV     1
 OR { 3119}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 10   and name HA  ))
 OR { 3119}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI { 3120}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 60   and name HG1 ))
      4.200     2.200     1.800 peak  3120 spectrum    1 weight  0.10000E+01 volume  0.78026E-03 ppm1      1.486 ppm2      2.232 CV     1
 OR { 3120}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 70   and name HB1 ))
 OR { 3120}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 60   and name HG2 ))
 OR { 3120}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 70   and name HB2 ))
 OR { 3120}
   (( segid "    " and resid 56   and name HG  ))
   (( segid "    " and resid 60   and name HG1 ))
 OR { 3120}
   (( segid "    " and resid 56   and name HG  ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 3131}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 49   and name HN  ))
      4.200     2.200     1.800 peak  3131 spectrum    1 weight  0.10000E+01 volume  0.61715E-03 ppm1      1.599 ppm2      7.909 CV     1
 OR { 3131}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 61   and name HN  ))
 OR { 3131}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 10   and name HN  ))
 OR { 3131}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 10   and name HN  ))
 ASSI { 3132}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 10   and name HN  ))
      4.100     2.100     1.900 peak  3132 spectrum    1 weight  0.10000E+01 volume  0.78881E-03 ppm1      1.458 ppm2      7.907 CV     1
 OR { 3132}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 74   and name HN  ))
 OR { 3132}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 61   and name HN  ))
 OR { 3132}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 3147}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 10   and name HB  ))
      4.500     2.500     1.500 peak  3147 spectrum    1 weight  0.10000E+01 volume  0.67675E-03 ppm1      0.705 ppm2      2.147 CV     1
 OR { 3147}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 43   and name HB2 ))
 ASSI { 3149}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 64   and name HB2 ))
      4.800     2.900     1.200 peak  3149 spectrum    1 weight  0.10000E+01 volume  0.32825E-03 ppm1      0.708 ppm2      1.106 CV     1
 OR { 3149}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 3153}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 74   and name HB2 ))
      3.700     3.700     2.300 peak  3153 spectrum    1 weight  0.10000E+01 volume  0.61496E-03 ppm1      0.880 ppm2      3.874 CV     1
 OR { 3153}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 31   and name HA  ))
 ASSI { 3155}
   (( segid "    " and resid 34   and name HG  ))
   (( segid "    " and resid 29   and name HB2 ))
      4.600     2.600     1.400 peak  3155 spectrum    1 weight  0.10000E+01 volume  0.51127E-03 ppm1      1.738 ppm2      3.769 CV     1
 OR { 3155}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 41   and name HA1 ))
 ASSI { 3156}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 32   and name HA  ))
      4.700     2.800     1.300 peak  3156 spectrum    1 weight  0.10000E+01 volume  0.15483E-03 ppm1      1.738 ppm2      4.069 CV     1
 OR { 3156}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 40   and name HA  ))
 ASSI { 3158}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 7    and name HN  ))
      3.500     3.500     2.500 peak  3158 spectrum    1 weight  0.10000E+01 volume  0.17104E-03 ppm1      0.880 ppm2      8.395 CV     1
 OR { 3158}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 45   and name HN  ))
 OR { 3158}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 44   and name HN  ))
 ASSI { 3164}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 6    and name HG1 ))
      4.000     2.000     2.000 peak  3164 spectrum    1 weight  0.10000E+01 volume  0.43368E-03 ppm1      1.473 ppm2      2.324 CV     1
 OR { 3164}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 6    and name HG2 ))
 OR { 3164}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 70   and name HG2 ))
 ASSI { 3165}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 36   and name HB1 ))
      4.200     2.200     1.800 peak  3165 spectrum    1 weight  0.10000E+01 volume  0.28894E-03 ppm1      0.583 ppm2      1.469 CV     1
 OR { 3165}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 62   and name HG2 ))
 ASSI { 3199}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 45   and name HE  ))
      3.000     1.100     1.100 peak  3199 spectrum    1 weight  0.10000E+01 volume  0.10139E-02 ppm1      0.782 ppm2      7.380 CV     1
 OR { 3199}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 63   and name HE22))
 OR { 3199}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 29   and name HN  ))
 OR { 3199}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 3207}
   (  segid "    " and resid 58   and name HD1%)
   (  segid "    " and resid 42   and name HG2%)
      2.300     2.300     3.700 peak  3207 spectrum    1 weight  0.10000E+01 volume  0.28248E-02 ppm1      0.784 ppm2      1.139 CV     1
 OR { 3207}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 3228}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 61   and name HG2%)
      5.300     3.500     0.700 peak  3228 spectrum    1 weight  0.10000E+01 volume  0.28285E-03 ppm1      2.411 ppm2      0.863 CV     1
 OR { 3228}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 58   and name HG2%)
 OR { 3228}
   (( segid "    " and resid 57   and name HB1 ))
   (  segid "    " and resid 56   and name HD2%)
 ASSI { 3233}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 9    and name HN  ))
      3.600     1.600     1.600 peak  3233 spectrum    1 weight  0.10000E+01 volume  0.10915E-02 ppm1      0.701 ppm2      8.473 CV     1
 OR { 3233}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 26   and name HN  ))
 ASSI { 3235}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 72   and name HN  ))
      4.300     2.400     1.700 peak  3235 spectrum    1 weight  0.10000E+01 volume  0.47801E-03 ppm1      0.703 ppm2      7.986 CV     1
 OR { 3235}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 71   and name HN  ))
 ASSI { 3236}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 49   and name HN  ))
      4.400     2.400     1.600 peak  3236 spectrum    1 weight  0.10000E+01 volume  0.77240E-03 ppm1      0.702 ppm2      7.913 CV     1
 OR { 3236}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 10   and name HN  ))
 OR { 3236}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 47   and name HN  ))
 OR { 3236}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
 OR { 3236}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 47   and name HN  ))
 ASSI { 3237}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 6    and name HE21))
      3.500     1.500     1.500 peak  3237 spectrum    1 weight  0.10000E+01 volume  0.11671E-02 ppm1      0.699 ppm2      6.781 CV     1
 OR { 3237}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 6    and name HE21))
 ASSI { 3239}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 69   and name HB1 ))
      3.200     1.300     1.300 peak  3239 spectrum    1 weight  0.10000E+01 volume  0.17257E-02 ppm1      0.573 ppm2      2.023 CV     1
 OR { 3239}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 48   and name HB1 ))
 OR { 3239}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 72   and name HB1 ))
 ASSI { 3240}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 47   and name HB  ))
      3.300     1.400     1.400 peak  3240 spectrum    1 weight  0.10000E+01 volume  0.10541E-02 ppm1      0.573 ppm2      1.912 CV     1
 OR { 3240}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 72   and name HB2 ))
 ASSI { 3241}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 48   and name HG  ))
      3.400     1.500     1.500 peak  3241 spectrum    1 weight  0.10000E+01 volume  0.16673E-02 ppm1      0.572 ppm2      1.822 CV     1
 OR { 3241}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 47   and name HG11))
 OR { 3241}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 3244}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 51   and name HG1 ))
      5.100     3.300     0.900 peak  3244 spectrum    1 weight  0.10000E+01 volume  0.23563E-03 ppm1      0.572 ppm2      2.229 CV     1
 OR { 3244}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 70   and name HB1 ))
 OR { 3244}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 3245}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 51   and name HG1 ))
      4.500     2.500     1.500 peak  3245 spectrum    1 weight  0.10000E+01 volume  0.46136E-03 ppm1      0.700 ppm2      2.225 CV     1
 OR { 3245}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 70   and name HB1 ))
 OR { 3245}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 51   and name HG2 ))
 OR { 3245}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 70   and name HB2 ))
 OR { 3245}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 51   and name HG1 ))
 OR { 3245}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 51   and name HG2 ))
 ASSI { 3248}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 12   and name HN  ))
      5.100     3.300     0.900 peak  3248 spectrum    1 weight  0.10000E+01 volume  0.22048E-03 ppm1      0.572 ppm2      8.144 CV     1
 OR { 3248}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 48   and name HN  ))
 OR { 3248}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 75   and name HN  ))
 ASSI { 3250}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 10   and name HN  ))
      4.800     2.900     1.200 peak  3250 spectrum    1 weight  0.10000E+01 volume  0.41385E-03 ppm1      0.572 ppm2      7.913 CV     1
 OR { 3250}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 74   and name HN  ))
 OR { 3250}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 3255}
   (( segid "    " and resid 19   and name HG11))
   (( segid "    " and resid 18   and name HN  ))
      4.400     2.500     1.600 peak  3255 spectrum    1 weight  0.10000E+01 volume  0.32963E-03 ppm1      1.459 ppm2      7.729 CV     1
 OR { 3255}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI { 3257}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 9    and name HB1 ))
      3.400     3.400     2.600 peak  3257 spectrum    1 weight  0.10000E+01 volume  0.19401E-03 ppm1      4.087 ppm2      1.593 CV     1
 OR { 3257}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 3258}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 9    and name HB1 ))
      3.400     1.500     1.500 peak  3258 spectrum    1 weight  0.10000E+01 volume  0.18198E-03 ppm1      3.963 ppm2      1.595 CV     1
 OR { 3258}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 7    and name HG1 ))
 OR { 3258}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 7    and name HG2 ))
 ASSI { 3259}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 69   and name HD1%)
      3.800     1.800     1.800 peak  3259 spectrum    1 weight  0.10000E+01 volume  0.14733E-03 ppm1      4.082 ppm2      0.842 CV     1
 OR { 3259}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 69   and name HD2%)
 OR { 3259}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI {   12}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      4.000     2.000     2.000 peak    12 spectrum    1 weight  0.10000E+01 volume  0.27680E-03 ppm1      8.555 ppm2      7.402 CV     1
 OR {   12}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 63   and name HE22))
 ASSI {   20}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
      2.400     0.700     0.700 peak    20 spectrum    1 weight  0.10000E+01 volume  0.83521E-02 ppm1      8.221 ppm2      4.068 CV     1
 OR {   20}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
 ASSI {  152}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      4.400     2.400     1.600 peak   152 spectrum    1 weight  0.10000E+01 volume  0.28600E-03 ppm1      8.431 ppm2      7.931 CV     1
 OR {  152}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI {  207}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      2.700     0.900     0.900 peak   207 spectrum    1 weight  0.10000E+01 volume  0.20606E-02 ppm1      7.969 ppm2      7.709 CV     1
 OR {  207}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
 ASSI {  244}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 31   and name HD2%)
      4.000     2.000     2.000 peak   244 spectrum    1 weight  0.10000E+01 volume  0.88803E-03 ppm1      8.484 ppm2      0.841 CV     1
 OR {  244}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 34   and name HD2%)
 ASSI {  245}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 36   and name HD2%)
      3.500     1.500     1.500 peak   245 spectrum    1 weight  0.10000E+01 volume  0.11417E-02 ppm1      8.483 ppm2      0.719 CV     1
 OR {  245}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 34   and name HD1%)
 ASSI {    2}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HA  ))
      3.000     1.200     1.200 peak     2 spectrum    1 weight  0.10000E+01 volume  0.32687E-02 ppm1      3.299 ppm2      4.898 CV     1
 ASSI {    3}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HA  ))
      2.600     0.900     0.900 peak     3 spectrum    1 weight  0.10000E+01 volume  0.31517E-02 ppm1      2.715 ppm2      4.898 CV     1
 ASSI {    4}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HA  ))
      2.900     1.000     1.000 peak     4 spectrum    1 weight  0.10000E+01 volume  0.26983E-02 ppm1      2.956 ppm2      4.953 CV     1
 ASSI {    5}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HA  ))
      3.000     1.100     1.100 peak     5 spectrum    1 weight  0.10000E+01 volume  0.20386E-02 ppm1      2.501 ppm2      4.952 CV     1
 ASSI {   12}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 36   and name HA  ))
      4.900     3.000     1.100 peak    12 spectrum    1 weight  0.10000E+01 volume  0.30555E-03 ppm1      3.293 ppm2      4.152 CV     1
 ASSI {   13}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 37   and name HN  ))
      3.300     1.400     1.400 peak    13 spectrum    1 weight  0.10000E+01 volume  0.81412E-03 ppm1      3.301 ppm2      7.869 CV     1
 ASSI {   14}
   (( segid "    " and resid 37   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
      4.000     2.000     2.000 peak    14 spectrum    1 weight  0.10000E+01 volume  0.26627E-03 ppm1      3.297 ppm2      8.369 CV     1
 ASSI {   45}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 54   and name HB1 ))
      5.100     3.300     0.900 peak    45 spectrum    1 weight  0.10000E+01 volume  0.40252E-03 ppm1      3.046 ppm2      1.361 CV     1
 ASSI {   57}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 55   and name HN  ))
      2.500     0.800     0.800 peak    57 spectrum    1 weight  0.10000E+01 volume  0.39547E-02 ppm1      1.936 ppm2      8.545 CV     1
 ASSI {   58}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HN  ))
      4.000     2.000     2.000 peak    58 spectrum    1 weight  0.10000E+01 volume  0.17291E-02 ppm1      0.748 ppm2      8.543 CV     1
 ASSI {   59}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HN  ))
      3.300     1.400     1.400 peak    59 spectrum    1 weight  0.10000E+01 volume  0.22150E-02 ppm1      0.748 ppm2      8.240 CV     1
 ASSI {   60}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 56   and name HN  ))
      2.400     2.400     3.600 peak    60 spectrum    1 weight  0.10000E+01 volume  0.14599E-02 ppm1      0.798 ppm2      8.240 CV     1
 ASSI {   61}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HN  ))
      2.300     0.700     0.700 peak    61 spectrum    1 weight  0.10000E+01 volume  0.55785E-02 ppm1      0.797 ppm2      8.546 CV     1
 ASSI {   64}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HA  ))
      3.900     1.900     1.900 peak    64 spectrum    1 weight  0.10000E+01 volume  0.69448E-03 ppm1      0.746 ppm2      4.916 CV     1
 ASSI {   65}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 54   and name HA  ))
      5.200     3.300     0.800 peak    65 spectrum    1 weight  0.10000E+01 volume  0.68515E-03 ppm1      0.748 ppm2      4.588 CV     1
 ASSI {   67}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HA  ))
      2.600     0.800     0.800 peak    67 spectrum    1 weight  0.10000E+01 volume  0.35612E-02 ppm1      0.748 ppm2      3.992 CV     1
 ASSI {   68}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HA  ))
      2.400     0.700     0.700 peak    68 spectrum    1 weight  0.10000E+01 volume  0.51295E-02 ppm1      0.797 ppm2      3.992 CV     1
 ASSI {   69}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 57   and name HD1 ))
      2.300     2.300     3.700 peak    69 spectrum    1 weight  0.10000E+01 volume  0.18613E-02 ppm1      0.797 ppm2      3.836 CV     1
 ASSI {   70}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 54   and name HA  ))
      3.700     1.700     1.700 peak    70 spectrum    1 weight  0.10000E+01 volume  0.17219E-02 ppm1      0.796 ppm2      4.589 CV     1
 OR {   70}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 54   and name HA  ))
 ASSI {   71}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 64   and name HN  ))
      4.400     2.400     1.600 peak    71 spectrum    1 weight  0.10000E+01 volume  0.51073E-03 ppm1      0.810 ppm2      7.383 CV     1
 ASSI {   73}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 55   and name HB  ))
      2.100     0.600     0.600 peak    73 spectrum    1 weight  0.10000E+01 volume  0.10410E-01 ppm1      0.797 ppm2      1.941 CV     1
 ASSI {   74}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 49   and name HG1 ))
      2.300     0.700     0.700 peak    74 spectrum    1 weight  0.10000E+01 volume  0.34298E-02 ppm1      0.797 ppm2      2.174 CV     1
 ASSI {   75}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 57   and name HG1 ))
      2.000     2.000     4.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.45285E-02 ppm1      0.797 ppm2      2.083 CV     1
 ASSI {   80}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 49   and name HG1 ))
      4.000     2.000     2.000 peak    80 spectrum    1 weight  0.10000E+01 volume  0.56043E-03 ppm1      0.751 ppm2      2.176 CV     1
 ASSI {   81}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 57   and name HG1 ))
      2.900     1.000     1.000 peak    81 spectrum    1 weight  0.10000E+01 volume  0.12961E-02 ppm1      0.748 ppm2      2.081 CV     1
 ASSI {   82}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 55   and name HB  ))
      2.200     0.600     0.600 peak    82 spectrum    1 weight  0.10000E+01 volume  0.10291E-01 ppm1      0.748 ppm2      1.940 CV     1
 ASSI {   87}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 54   and name HB1 ))
      3.100     3.100     2.900 peak    87 spectrum    1 weight  0.10000E+01 volume  0.36146E-03 ppm1      0.797 ppm2      1.365 CV     1
 ASSI {   89}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.500     1.500     1.500 peak    89 spectrum    1 weight  0.10000E+01 volume  0.80017E-03 ppm1      4.226 ppm2      1.928 CV     1
 ASSI {   90}
   (( segid "    " and resid 4    and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
      2.800     1.000     1.000 peak    90 spectrum    1 weight  0.10000E+01 volume  0.22829E-02 ppm1      4.230 ppm2      2.025 CV     1
 ASSI {  100}
   (( segid "    " and resid 4    and name HB1 ))
   (( segid "    " and resid 5    and name HN  ))
      3.800     1.800     1.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.95452E-03 ppm1      2.022 ppm2      8.290 CV     1
 ASSI {  101}
   (( segid "    " and resid 4    and name HB2 ))
   (( segid "    " and resid 5    and name HN  ))
      3.800     1.800     1.800 peak   101 spectrum    1 weight  0.10000E+01 volume  0.63350E-03 ppm1      1.938 ppm2      8.293 CV     1
 ASSI {  107}
   (( segid "    " and resid 4    and name HG2 ))
   (( segid "    " and resid 4    and name HA  ))
      3.100     1.200     1.200 peak   107 spectrum    1 weight  0.10000E+01 volume  0.21008E-02 ppm1      2.203 ppm2      4.229 CV     1
 OR {  107}
   (( segid "    " and resid 4    and name HG1 ))
   (( segid "    " and resid 4    and name HA  ))
 ASSI {  114}
   (( segid "    " and resid 5    and name HA  ))
   (( segid "    " and resid 5    and name HN  ))
      2.800     1.000     1.000 peak   114 spectrum    1 weight  0.10000E+01 volume  0.26114E-02 ppm1      4.238 ppm2      8.277 CV     1
 ASSI {  116}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 5    and name HN  ))
      3.100     1.200     1.200 peak   116 spectrum    1 weight  0.10000E+01 volume  0.18157E-02 ppm1      1.346 ppm2      8.304 CV     1
 ASSI {  122}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 5    and name HA  ))
      2.400     0.700     0.700 peak   122 spectrum    1 weight  0.10000E+01 volume  0.77261E-02 ppm1      1.346 ppm2      4.238 CV     1
 ASSI {  129}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HB  ))
      3.000     1.100     1.100 peak   129 spectrum    1 weight  0.10000E+01 volume  0.15927E-02 ppm1      3.320 ppm2      2.141 CV     1
 ASSI {  130}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 13   and name HB  ))
      2.800     1.000     1.000 peak   130 spectrum    1 weight  0.10000E+01 volume  0.17318E-02 ppm1      3.319 ppm2      2.004 CV     1
 ASSI {  133}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HB1 ))
      3.000     1.100     1.100 peak   133 spectrum    1 weight  0.10000E+01 volume  0.27174E-02 ppm1      3.178 ppm2      1.966 CV     1
 OR {  133}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HB1 ))
 ASSI {  136}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HB1 ))
      3.100     1.200     1.200 peak   136 spectrum    1 weight  0.10000E+01 volume  0.33296E-02 ppm1      3.161 ppm2      1.875 CV     1
 OR {  136}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  140}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HG1 ))
      2.400     0.700     0.700 peak   140 spectrum    1 weight  0.10000E+01 volume  0.28711E-02 ppm1      3.063 ppm2      1.758 CV     1
 OR {  140}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI {  151}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HA  ))
      2.800     1.000     1.000 peak   151 spectrum    1 weight  0.10000E+01 volume  0.18395E-02 ppm1      3.148 ppm2      4.606 CV     1
 ASSI {  152}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HA  ))
      3.000     1.100     1.100 peak   152 spectrum    1 weight  0.10000E+01 volume  0.20123E-02 ppm1      2.726 ppm2      4.606 CV     1
 ASSI {  153}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 25   and name HA  ))
      4.900     3.000     1.100 peak   153 spectrum    1 weight  0.10000E+01 volume  0.61688E-03 ppm1      3.148 ppm2      4.068 CV     1
 ASSI {  154}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
      4.700     2.800     1.300 peak   154 spectrum    1 weight  0.10000E+01 volume  0.59739E-03 ppm1      2.727 ppm2      4.071 CV     1
 ASSI {  155}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 27   and name HN  ))
      4.600     2.700     1.400 peak   155 spectrum    1 weight  0.10000E+01 volume  0.39502E-03 ppm1      3.145 ppm2      8.892 CV     1
 ASSI {  156}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 27   and name HN  ))
      4.300     2.300     1.700 peak   156 spectrum    1 weight  0.10000E+01 volume  0.59637E-03 ppm1      2.726 ppm2      8.897 CV     1
 ASSI {  158}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HN  ))
      2.800     1.000     1.000 peak   158 spectrum    1 weight  0.10000E+01 volume  0.33134E-02 ppm1      3.147 ppm2      8.455 CV     1
 ASSI {  159}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HN  ))
      2.600     0.800     0.800 peak   159 spectrum    1 weight  0.10000E+01 volume  0.30558E-02 ppm1      2.727 ppm2      8.457 CV     1
 ASSI {  160}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 28   and name HN  ))
      4.200     2.200     1.800 peak   160 spectrum    1 weight  0.10000E+01 volume  0.24726E-03 ppm1      3.151 ppm2      8.351 CV     1
 ASSI {  161}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      4.300     2.300     1.700 peak   161 spectrum    1 weight  0.10000E+01 volume  0.30687E-03 ppm1      2.731 ppm2      8.347 CV     1
 ASSI {  162}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HD22))
      4.200     2.300     1.800 peak   162 spectrum    1 weight  0.10000E+01 volume  0.86817E-03 ppm1      3.149 ppm2      7.523 CV     1
 ASSI {  163}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HD22))
      3.900     1.900     1.900 peak   163 spectrum    1 weight  0.10000E+01 volume  0.12795E-02 ppm1      2.726 ppm2      7.525 CV     1
 ASSI {  164}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 29   and name HN  ))
      4.000     2.000     2.000 peak   164 spectrum    1 weight  0.10000E+01 volume  0.40264E-03 ppm1      3.150 ppm2      7.361 CV     1
 ASSI {  165}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HD21))
      3.500     1.500     1.500 peak   165 spectrum    1 weight  0.10000E+01 volume  0.82036E-03 ppm1      3.151 ppm2      6.967 CV     1
 ASSI {  166}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HD21))
      3.100     1.200     1.200 peak   166 spectrum    1 weight  0.10000E+01 volume  0.94300E-03 ppm1      2.726 ppm2      6.968 CV     1
 ASSI {  167}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      4.200     2.200     1.800 peak   167 spectrum    1 weight  0.10000E+01 volume  0.34574E-03 ppm1      2.724 ppm2      7.360 CV     1
 ASSI {  168}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
      4.100     2.100     1.900 peak   168 spectrum    1 weight  0.10000E+01 volume  0.48281E-03 ppm1      4.189 ppm2      4.739 CV     1
 ASSI {  175}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      3.600     1.600     1.600 peak   175 spectrum    1 weight  0.10000E+01 volume  0.71886E-03 ppm1      1.709 ppm2      8.554 CV     1
 ASSI {  176}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HA  ))
      3.000     1.100     1.100 peak   176 spectrum    1 weight  0.10000E+01 volume  0.28013E-02 ppm1      1.852 ppm2      4.191 CV     1
 ASSI {  177}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HA  ))
      2.600     0.800     0.800 peak   177 spectrum    1 weight  0.10000E+01 volume  0.22666E-02 ppm1      1.709 ppm2      4.190 CV     1
 ASSI {  179}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HD2 ))
      2.900     1.000     1.000 peak   179 spectrum    1 weight  0.10000E+01 volume  0.23334E-02 ppm1      1.848 ppm2      3.129 CV     1
 OR {  179}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HD1 ))
 ASSI {  186}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HG1 ))
      2.400     0.700     0.700 peak   186 spectrum    1 weight  0.10000E+01 volume  0.32159E-02 ppm1      1.710 ppm2      1.625 CV     1
 ASSI {  191}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 20   and name HN  ))
      3.200     1.200     1.200 peak   191 spectrum    1 weight  0.10000E+01 volume  0.90215E-03 ppm1      1.855 ppm2      8.555 CV     1
 ASSI {  194}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HG2 ))
      2.900     1.100     1.100 peak   194 spectrum    1 weight  0.10000E+01 volume  0.19657E-02 ppm1      4.187 ppm2      1.540 CV     1
 ASSI {  195}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HG1 ))
      2.900     1.100     1.100 peak   195 spectrum    1 weight  0.10000E+01 volume  0.13387E-02 ppm1      4.187 ppm2      1.626 CV     1
 ASSI {  198}
   (( segid "    " and resid 20   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      3.200     1.300     1.300 peak   198 spectrum    1 weight  0.10000E+01 volume  0.57699E-03 ppm1      4.186 ppm2      8.552 CV     1
 ASSI {  212}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HA  ))
      3.800     1.800     1.800 peak   212 spectrum    1 weight  0.10000E+01 volume  0.16784E-02 ppm1      3.135 ppm2      4.189 CV     1
 OR {  212}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  218}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HB2 ))
      3.200     1.300     1.300 peak   218 spectrum    1 weight  0.10000E+01 volume  0.15406E-02 ppm1      3.135 ppm2      1.708 CV     1
 OR {  218}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HB2 ))
 ASSI {  224}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 20   and name HD1 ))
      2.300     0.700     0.700 peak   224 spectrum    1 weight  0.10000E+01 volume  0.49823E-02 ppm1      1.609 ppm2      3.133 CV     1
 OR {  224}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 20   and name HD2 ))
 ASSI {  226}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 21   and name HA  ))
      2.800     1.000     1.000 peak   226 spectrum    1 weight  0.10000E+01 volume  0.29037E-02 ppm1      2.681 ppm2      4.698 CV     1
 ASSI {  227}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HA  ))
      2.700     0.900     0.900 peak   227 spectrum    1 weight  0.10000E+01 volume  0.36325E-02 ppm1      2.489 ppm2      4.698 CV     1
 ASSI {  228}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 21   and name HN  ))
      3.400     1.400     1.400 peak   228 spectrum    1 weight  0.10000E+01 volume  0.93614E-03 ppm1      2.678 ppm2      7.537 CV     1
 ASSI {  229}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 21   and name HN  ))
      2.900     1.100     1.100 peak   229 spectrum    1 weight  0.10000E+01 volume  0.85902E-03 ppm1      2.486 ppm2      7.539 CV     1
 ASSI {  230}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 20   and name HN  ))
      5.800     4.100     0.200 peak   230 spectrum    1 weight  0.10000E+01 volume  0.26297E-03 ppm1      2.682 ppm2      8.545 CV     1
 ASSI {  231}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      4.800     2.900     1.200 peak   231 spectrum    1 weight  0.10000E+01 volume  0.52684E-03 ppm1      2.487 ppm2      8.546 CV     1
 ASSI {  234}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HD1%)
      2.000     0.500     0.500 peak   234 spectrum    1 weight  0.10000E+01 volume  0.58833E-02 ppm1      3.982 ppm2      0.657 CV     1
 ASSI {  235}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HD2%)
      2.600     0.900     0.900 peak   235 spectrum    1 weight  0.10000E+01 volume  0.37666E-02 ppm1      3.981 ppm2      0.753 CV     1
 ASSI {  240}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB2 ))
      2.200     0.600     0.600 peak   240 spectrum    1 weight  0.10000E+01 volume  0.64673E-02 ppm1      3.981 ppm2      1.550 CV     1
 OR {  240}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {  243}
   (( segid "    " and resid 22   and name HG  ))
   (  segid "    " and resid 22   and name HD1%)
      2.300     0.700     0.700 peak   243 spectrum    1 weight  0.10000E+01 volume  0.24221E-02 ppm1      1.531 ppm2      0.656 CV     1
 ASSI {  244}
   (( segid "    " and resid 22   and name HG  ))
   (  segid "    " and resid 22   and name HD2%)
      2.300     0.700     0.700 peak   244 spectrum    1 weight  0.10000E+01 volume  0.31622E-02 ppm1      1.532 ppm2      0.747 CV     1
 ASSI {  247}
   (( segid "    " and resid 22   and name HG  ))
   (( segid "    " and resid 22   and name HA  ))
      3.300     1.300     1.300 peak   247 spectrum    1 weight  0.10000E+01 volume  0.19841E-02 ppm1      1.527 ppm2      3.982 CV     1
 ASSI {  248}
   (( segid "    " and resid 22   and name HG  ))
   (( segid "    " and resid 21   and name HA  ))
      4.500     2.600     1.500 peak   248 spectrum    1 weight  0.10000E+01 volume  0.54496E-03 ppm1      1.529 ppm2      4.721 CV     1
 ASSI {  249}
   (( segid "    " and resid 22   and name HG  ))
   (( segid "    " and resid 20   and name HN  ))
      4.100     2.100     1.900 peak   249 spectrum    1 weight  0.10000E+01 volume  0.12795E-02 ppm1      1.529 ppm2      8.544 CV     1
 ASSI {  257}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      3.500     1.600     1.600 peak   257 spectrum    1 weight  0.10000E+01 volume  0.68059E-03 ppm1      3.978 ppm2      7.346 CV     1
 ASSI {  258}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      2.900     1.000     1.000 peak   258 spectrum    1 weight  0.10000E+01 volume  0.12780E-02 ppm1      3.983 ppm2      8.209 CV     1
 ASSI {  259}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   259 spectrum    1 weight  0.10000E+01 volume  0.81322E-03 ppm1      3.978 ppm2      8.542 CV     1
 ASSI {  266}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 23   and name HB% )
      3.400     1.400     1.400 peak   266 spectrum    1 weight  0.10000E+01 volume  0.31874E-02 ppm1      3.981 ppm2      1.320 CV     1
 ASSI {  273}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 24   and name HA2 ))
      4.800     2.800     1.200 peak   273 spectrum    1 weight  0.10000E+01 volume  0.72273E-03 ppm1      0.657 ppm2      3.818 CV     1
 ASSI {  279}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HN  ))
      4.700     2.800     1.300 peak   279 spectrum    1 weight  0.10000E+01 volume  0.19627E-03 ppm1      0.651 ppm2      8.548 CV     1
 ASSI {  280}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HN  ))
      3.400     1.500     1.500 peak   280 spectrum    1 weight  0.10000E+01 volume  0.27375E-03 ppm1      0.746 ppm2      8.547 CV     1
 ASSI {  281}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HB2 ))
      2.600     0.900     0.900 peak   281 spectrum    1 weight  0.10000E+01 volume  0.32255E-02 ppm1      0.650 ppm2      1.546 CV     1
 OR {  281}
   (  segid "    " and resid 22   and name HD1%)
   (( segid "    " and resid 22   and name HB1 ))
 ASSI {  282}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HB1 ))
      2.600     0.900     0.900 peak   282 spectrum    1 weight  0.10000E+01 volume  0.33347E-02 ppm1      0.747 ppm2      1.543 CV     1
 OR {  282}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 22   and name HB2 ))
 ASSI {  287}
   (  segid "    " and resid 22   and name HD2%)
   (  segid "    " and resid 23   and name HB% )
      5.300     3.600     0.700 peak   287 spectrum    1 weight  0.10000E+01 volume  0.32411E-03 ppm1      0.746 ppm2      1.327 CV     1
 ASSI {  301}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 32   and name HA  ))
      2.100     0.600     0.600 peak   301 spectrum    1 weight  0.10000E+01 volume  0.10357E-01 ppm1      1.379 ppm2      4.080 CV     1
 ASSI {  304}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      2.700     0.900     0.900 peak   304 spectrum    1 weight  0.10000E+01 volume  0.32603E-02 ppm1      4.065 ppm2      8.218 CV     1
 ASSI {  307}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 23   and name HN  ))
      2.400     0.700     0.700 peak   307 spectrum    1 weight  0.10000E+01 volume  0.56769E-02 ppm1      1.338 ppm2      8.210 CV     1
 ASSI {  315}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HN  ))
      2.900     1.000     1.000 peak   315 spectrum    1 weight  0.10000E+01 volume  0.20877E-02 ppm1      2.957 ppm2      8.346 CV     1
 ASSI {  316}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      2.900     1.000     1.000 peak   316 spectrum    1 weight  0.10000E+01 volume  0.24809E-02 ppm1      2.503 ppm2      8.347 CV     1
 ASSI {  317}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      4.200     2.200     1.800 peak   317 spectrum    1 weight  0.10000E+01 volume  0.51925E-03 ppm1      2.502 ppm2      7.369 CV     1
 ASSI {  318}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 29   and name HN  ))
      4.400     2.400     1.600 peak   318 spectrum    1 weight  0.10000E+01 volume  0.39259E-03 ppm1      2.959 ppm2      7.368 CV     1
 ASSI {  319}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      3.600     1.600     1.600 peak   319 spectrum    1 weight  0.10000E+01 volume  0.58953E-03 ppm1      4.954 ppm2      8.346 CV     1
 ASSI {  320}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      4.000     2.000     2.000 peak   320 spectrum    1 weight  0.10000E+01 volume  0.38473E-03 ppm1      4.956 ppm2      7.368 CV     1
 ASSI {  327}
   (( segid "    " and resid 29   and name HB1 ))
   (  segid "    " and resid 34   and name HD2%)
      3.200     1.300     1.300 peak   327 spectrum    1 weight  0.10000E+01 volume  0.15694E-02 ppm1      3.860 ppm2      0.862 CV     1
 ASSI {  330}
   (( segid "    " and resid 29   and name HB1 ))
   (  segid "    " and resid 34   and name HD1%)
      3.400     1.500     1.500 peak   330 spectrum    1 weight  0.10000E+01 volume  0.89307E-03 ppm1      3.866 ppm2      0.726 CV     1
 ASSI {  331}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 34   and name HG  ))
      3.500     1.600     1.600 peak   331 spectrum    1 weight  0.10000E+01 volume  0.11049E-02 ppm1      3.862 ppm2      1.749 CV     1
 ASSI {  332}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 34   and name HG  ))
      3.700     1.700     1.700 peak   332 spectrum    1 weight  0.10000E+01 volume  0.92036E-03 ppm1      3.760 ppm2      1.750 CV     1
 ASSI {  333}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 33   and name HB2 ))
      4.000     2.000     2.000 peak   333 spectrum    1 weight  0.10000E+01 volume  0.42888E-03 ppm1      3.863 ppm2      2.674 CV     1
 ASSI {  334}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 33   and name HB1 ))
      3.400     1.500     1.500 peak   334 spectrum    1 weight  0.10000E+01 volume  0.37552E-03 ppm1      3.867 ppm2      3.035 CV     1
 ASSI {  338}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HA  ))
      3.200     1.300     1.300 peak   338 spectrum    1 weight  0.10000E+01 volume  0.20055E-02 ppm1      3.760 ppm2      4.525 CV     1
 ASSI {  339}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 29   and name HA  ))
      2.900     1.100     1.100 peak   339 spectrum    1 weight  0.10000E+01 volume  0.11864E-02 ppm1      3.865 ppm2      4.528 CV     1
 ASSI {  340}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
      3.400     1.400     1.400 peak   340 spectrum    1 weight  0.10000E+01 volume  0.10582E-02 ppm1      3.864 ppm2      9.193 CV     1
 ASSI {  341}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 30   and name HN  ))
      4.300     2.300     1.700 peak   341 spectrum    1 weight  0.10000E+01 volume  0.92717E-03 ppm1      3.759 ppm2      9.193 CV     1
 ASSI {  342}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      2.900     1.000     1.000 peak   342 spectrum    1 weight  0.10000E+01 volume  0.11264E-02 ppm1      3.760 ppm2      7.368 CV     1
 ASSI {  343}
   (( segid "    " and resid 29   and name HB1 ))
   (( segid "    " and resid 29   and name HN  ))
      4.100     2.100     1.900 peak   343 spectrum    1 weight  0.10000E+01 volume  0.96706E-03 ppm1      3.867 ppm2      7.370 CV     1
 ASSI {  352}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HA  ))
      3.000     1.200     1.200 peak   352 spectrum    1 weight  0.10000E+01 volume  0.10185E-02 ppm1      4.480 ppm2      4.666 CV     1
 ASSI {  354}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HA  ))
      3.000     1.100     1.100 peak   354 spectrum    1 weight  0.10000E+01 volume  0.17263E-02 ppm1      3.984 ppm2      4.662 CV     1
 ASSI {  355}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
      3.300     1.400     1.400 peak   355 spectrum    1 weight  0.10000E+01 volume  0.10743E-02 ppm1      4.482 ppm2      9.193 CV     1
 ASSI {  356}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 30   and name HN  ))
      2.900     1.100     1.100 peak   356 spectrum    1 weight  0.10000E+01 volume  0.16885E-02 ppm1      3.982 ppm2      9.193 CV     1
 ASSI {  359}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.700     1.700     1.700 peak   359 spectrum    1 weight  0.10000E+01 volume  0.60725E-03 ppm1      4.482 ppm2      8.569 CV     1
 ASSI {  360}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 31   and name HN  ))
      3.500     1.500     1.500 peak   360 spectrum    1 weight  0.10000E+01 volume  0.96673E-03 ppm1      3.984 ppm2      8.569 CV     1
 ASSI {  361}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
      3.300     1.300     1.300 peak   361 spectrum    1 weight  0.10000E+01 volume  0.74451E-03 ppm1      3.982 ppm2      8.475 CV     1
 ASSI {  362}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 32   and name HN  ))
      4.200     2.200     1.800 peak   362 spectrum    1 weight  0.10000E+01 volume  0.24093E-03 ppm1      4.480 ppm2      8.478 CV     1
 ASSI {  363}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 33   and name HA  ))
      3.900     1.900     1.900 peak   363 spectrum    1 weight  0.10000E+01 volume  0.11093E-02 ppm1      3.982 ppm2      4.376 CV     1
 ASSI {  364}
   (( segid "    " and resid 30   and name HB1 ))
   (( segid "    " and resid 33   and name HA  ))
      4.500     2.600     1.500 peak   364 spectrum    1 weight  0.10000E+01 volume  0.75458E-03 ppm1      4.480 ppm2      4.376 CV     1
 ASSI {  368}
   (( segid "    " and resid 30   and name HB2 ))
   (( segid "    " and resid 31   and name HA  ))
      5.100     3.300     0.900 peak   368 spectrum    1 weight  0.10000E+01 volume  0.17445E-03 ppm1      3.981 ppm2      3.879 CV     1
 ASSI {  370}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 62   and name HA  ))
      2.900     1.000     1.000 peak   370 spectrum    1 weight  0.10000E+01 volume  0.10484E-02 ppm1      1.884 ppm2      3.707 CV     1
 ASSI {  371}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 32   and name HN  ))
      3.200     1.300     1.300 peak   371 spectrum    1 weight  0.10000E+01 volume  0.76661E-03 ppm1      1.885 ppm2      8.476 CV     1
 ASSI {  372}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 31   and name HN  ))
      3.200     1.300     1.300 peak   372 spectrum    1 weight  0.10000E+01 volume  0.13969E-02 ppm1      1.883 ppm2      8.569 CV     1
 ASSI {  373}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 31   and name HN  ))
      2.900     1.000     1.000 peak   373 spectrum    1 weight  0.10000E+01 volume  0.92114E-03 ppm1      1.286 ppm2      8.570 CV     1
 ASSI {  374}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
      3.800     1.800     1.800 peak   374 spectrum    1 weight  0.10000E+01 volume  0.52696E-03 ppm1      1.292 ppm2      8.476 CV     1
 ASSI {  382}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 36   and name HB2 ))
      4.200     2.200     1.800 peak   382 spectrum    1 weight  0.10000E+01 volume  0.48722E-03 ppm1      1.883 ppm2      1.183 CV     1
 ASSI {  383}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 36   and name HB2 ))
      4.400     2.500     1.600 peak   383 spectrum    1 weight  0.10000E+01 volume  0.64283E-03 ppm1      1.287 ppm2      1.186 CV     1
 ASSI {  385}
   (( segid "    " and resid 31   and name HB1 ))
   (  segid "    " and resid 36   and name HD2%)
      2.500     0.800     0.800 peak   385 spectrum    1 weight  0.10000E+01 volume  0.25822E-02 ppm1      1.884 ppm2      0.737 CV     1
 ASSI {  387}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 31   and name HD2%)
      2.800     1.000     1.000 peak   387 spectrum    1 weight  0.10000E+01 volume  0.22992E-02 ppm1      1.289 ppm2      0.852 CV     1
 ASSI {  388}
   (( segid "    " and resid 31   and name HB2 ))
   (  segid "    " and resid 36   and name HD2%)
      3.300     1.300     1.300 peak   388 spectrum    1 weight  0.10000E+01 volume  0.26729E-02 ppm1      1.288 ppm2      0.740 CV     1
 ASSI {  392}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.100     1.200     1.200 peak   392 spectrum    1 weight  0.10000E+01 volume  0.97417E-03 ppm1      3.884 ppm2      8.570 CV     1
 ASSI {  393}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB1 ))
      2.800     1.000     1.000 peak   393 spectrum    1 weight  0.10000E+01 volume  0.23569E-02 ppm1      3.883 ppm2      1.883 CV     1
 ASSI {  394}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
      3.000     1.100     1.100 peak   394 spectrum    1 weight  0.10000E+01 volume  0.11973E-02 ppm1      3.882 ppm2      1.290 CV     1
 ASSI {  395}
   (( segid "    " and resid 31   and name HA  ))
   (  segid "    " and resid 31   and name HD2%)
      3.700     1.700     1.700 peak   395 spectrum    1 weight  0.10000E+01 volume  0.11522E-02 ppm1      3.882 ppm2      0.853 CV     1
 ASSI {  396}
   (( segid "    " and resid 31   and name HA  ))
   (  segid "    " and resid 36   and name HD2%)
      3.300     1.400     1.400 peak   396 spectrum    1 weight  0.10000E+01 volume  0.21546E-02 ppm1      3.882 ppm2      0.737 CV     1
 ASSI {  398}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.800     1.800     1.800 peak   398 spectrum    1 weight  0.10000E+01 volume  0.74565E-03 ppm1      3.882 ppm2      7.584 CV     1
 ASSI {  399}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HG  ))
      3.900     1.900     1.900 peak   399 spectrum    1 weight  0.10000E+01 volume  0.53803E-03 ppm1      3.881 ppm2      1.751 CV     1
 ASSI {  400}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      3.300     1.300     1.300 peak   400 spectrum    1 weight  0.10000E+01 volume  0.70134E-03 ppm1      3.881 ppm2      1.656 CV     1
 ASSI {  401}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HA  ))
      2.400     0.700     0.700 peak   401 spectrum    1 weight  0.10000E+01 volume  0.58014E-02 ppm1      0.583 ppm2      3.880 CV     1
 ASSI {  402}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HB2 ))
      2.600     0.900     0.900 peak   402 spectrum    1 weight  0.10000E+01 volume  0.29598E-02 ppm1      0.584 ppm2      1.289 CV     1
 ASSI {  403}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HN  ))
      3.400     1.500     1.500 peak   403 spectrum    1 weight  0.10000E+01 volume  0.24796E-02 ppm1      0.584 ppm2      8.570 CV     1
 ASSI {  404}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 66   and name HN  ))
      3.600     1.600     1.600 peak   404 spectrum    1 weight  0.10000E+01 volume  0.68701E-03 ppm1      0.584 ppm2      8.808 CV     1
 ASSI {  406}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 30   and name HA  ))
      4.600     2.700     1.400 peak   406 spectrum    1 weight  0.10000E+01 volume  0.64922E-03 ppm1      0.585 ppm2      4.663 CV     1
 ASSI {  408}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 31   and name HB1 ))
      2.600     0.900     0.900 peak   408 spectrum    1 weight  0.10000E+01 volume  0.70086E-02 ppm1      0.583 ppm2      1.895 CV     1
 ASSI {  409}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 62   and name HG1 ))
      3.700     3.700     2.300 peak   409 spectrum    1 weight  0.10000E+01 volume  0.18525E-02 ppm1      0.583 ppm2      1.753 CV     1
 ASSI {  410}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 34   and name HB2 ))
      3.400     1.500     1.500 peak   410 spectrum    1 weight  0.10000E+01 volume  0.79223E-03 ppm1      0.583 ppm2      1.655 CV     1
 ASSI {  411}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 64   and name HG  ))
      3.700     1.700     1.700 peak   411 spectrum    1 weight  0.10000E+01 volume  0.16225E-02 ppm1      0.583 ppm2      2.010 CV     1
 ASSI {  413}
   (  segid "    " and resid 31   and name HD1%)
   (  segid "    " and resid 31   and name HD2%)
      2.200     0.600     0.600 peak   413 spectrum    1 weight  0.10000E+01 volume  0.12644E-01 ppm1      0.584 ppm2      0.848 CV     1
 ASSI {  416}
   (  segid "    " and resid 31   and name HD2%)
   (( segid "    " and resid 31   and name HN  ))
      4.200     2.200     1.800 peak   416 spectrum    1 weight  0.10000E+01 volume  0.57591E-03 ppm1      0.854 ppm2      8.568 CV     1
 ASSI {  418}
   (  segid "    " and resid 31   and name HD2%)
   (( segid "    " and resid 64   and name HG  ))
      3.300     1.300     1.300 peak   418 spectrum    1 weight  0.10000E+01 volume  0.21350E-02 ppm1      0.851 ppm2      2.021 CV     1
 ASSI {  419}
   (  segid "    " and resid 31   and name HD2%)
   (( segid "    " and resid 31   and name HB1 ))
      2.600     0.800     0.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.33473E-02 ppm1      0.852 ppm2      1.889 CV     1
 ASSI {  425}
   (( segid "    " and resid 31   and name HG  ))
   (( segid "    " and resid 31   and name HN  ))
      3.500     1.500     1.500 peak   425 spectrum    1 weight  0.10000E+01 volume  0.15201E-02 ppm1      1.905 ppm2      8.569 CV     1
 ASSI {  426}
   (( segid "    " and resid 31   and name HG  ))
   (( segid "    " and resid 31   and name HA  ))
      3.800     1.800     1.800 peak   426 spectrum    1 weight  0.10000E+01 volume  0.42258E-03 ppm1      1.893 ppm2      3.882 CV     1
 ASSI {  427}
   (( segid "    " and resid 31   and name HG  ))
   (  segid "    " and resid 31   and name HD1%)
      3.100     1.200     1.200 peak   427 spectrum    1 weight  0.10000E+01 volume  0.93704E-03 ppm1      1.903 ppm2      0.586 CV     1
 ASSI {  430}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
      2.900     1.000     1.000 peak   430 spectrum    1 weight  0.10000E+01 volume  0.17000E-02 ppm1      4.079 ppm2      7.696 CV     1
 ASSI {  431}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      2.800     1.000     1.000 peak   431 spectrum    1 weight  0.10000E+01 volume  0.23051E-02 ppm1      4.081 ppm2      8.475 CV     1
 ASSI {  433}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 62   and name HG2 ))
      3.000     3.000     3.000 peak   433 spectrum    1 weight  0.10000E+01 volume  0.17930E-02 ppm1      4.083 ppm2      1.459 CV     1
 ASSI {  435}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 62   and name HN  ))
      4.400     2.400     1.600 peak   435 spectrum    1 weight  0.10000E+01 volume  0.75044E-03 ppm1      1.380 ppm2      7.824 CV     1
 ASSI {  436}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 36   and name HN  ))
      4.400     2.400     1.600 peak   436 spectrum    1 weight  0.10000E+01 volume  0.62111E-03 ppm1      1.380 ppm2      7.701 CV     1
 ASSI {  437}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 35   and name HN  ))
      4.000     2.000     2.000 peak   437 spectrum    1 weight  0.10000E+01 volume  0.94861E-03 ppm1      1.380 ppm2      7.586 CV     1
 ASSI {  439}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 33   and name HN  ))
      2.500     0.800     0.800 peak   439 spectrum    1 weight  0.10000E+01 volume  0.47123E-02 ppm1      1.380 ppm2      8.074 CV     1
 ASSI {  440}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 32   and name HN  ))
      2.100     0.600     0.600 peak   440 spectrum    1 weight  0.10000E+01 volume  0.10687E-01 ppm1      1.380 ppm2      8.474 CV     1
 ASSI {  441}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 63   and name HN  ))
      4.000     2.000     2.000 peak   441 spectrum    1 weight  0.10000E+01 volume  0.66889E-03 ppm1      1.380 ppm2      6.831 CV     1
 ASSI {  442}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HN  ))
      4.400     2.400     1.600 peak   442 spectrum    1 weight  0.10000E+01 volume  0.72495E-03 ppm1      1.381 ppm2      8.569 CV     1
 ASSI {  444}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 30   and name HB1 ))
      3.700     1.700     1.700 peak   444 spectrum    1 weight  0.10000E+01 volume  0.90155E-03 ppm1      1.380 ppm2      4.482 CV     1
 ASSI {  446}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 62   and name HA  ))
      3.300     1.400     1.400 peak   446 spectrum    1 weight  0.10000E+01 volume  0.17836E-02 ppm1      1.379 ppm2      3.705 CV     1
 ASSI {  448}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 33   and name HB1 ))
      4.200     2.200     1.800 peak   448 spectrum    1 weight  0.10000E+01 volume  0.12176E-02 ppm1      1.381 ppm2      3.047 CV     1
 ASSI {  449}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 31   and name HB1 ))
      2.900     2.900     3.100 peak   449 spectrum    1 weight  0.10000E+01 volume  0.47432E-02 ppm1      1.380 ppm2      1.868 CV     1
 ASSI {  450}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 62   and name HB2 ))
      3.200     1.300     1.300 peak   450 spectrum    1 weight  0.10000E+01 volume  0.35216E-02 ppm1      1.380 ppm2      1.763 CV     1
 ASSI {  454}
   (( segid "    " and resid 32   and name HA  ))
   (  segid "    " and resid 34   and name HD1%)
      3.700     1.700     1.700 peak   454 spectrum    1 weight  0.10000E+01 volume  0.12115E-02 ppm1      4.079 ppm2      0.742 CV     1
 ASSI {  456}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 30   and name HB2 ))
      3.500     1.500     1.500 peak   456 spectrum    1 weight  0.10000E+01 volume  0.80467E-03 ppm1      1.382 ppm2      3.977 CV     1
 ASSI {  458}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      4.100     2.100     1.900 peak   458 spectrum    1 weight  0.10000E+01 volume  0.30927E-03 ppm1      4.082 ppm2      8.074 CV     1
 ASSI {  460}
   (( segid "    " and resid 32   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.400     1.500     1.500 peak   460 spectrum    1 weight  0.10000E+01 volume  0.59064E-03 ppm1      4.078 ppm2      7.601 CV     1
 ASSI {  464}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HG  ))
      3.500     1.500     1.500 peak   464 spectrum    1 weight  0.10000E+01 volume  0.75635E-03 ppm1      4.308 ppm2      1.746 CV     1
 ASSI {  465}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 34   and name HB2 ))
      3.100     1.200     1.200 peak   465 spectrum    1 weight  0.10000E+01 volume  0.23780E-02 ppm1      4.309 ppm2      1.657 CV     1
 ASSI {  469}
   (( segid "    " and resid 34   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      3.300     1.300     1.300 peak   469 spectrum    1 weight  0.10000E+01 volume  0.14856E-02 ppm1      4.311 ppm2      7.582 CV     1
 ASSI {  470}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 31   and name HA  ))
      4.000     2.000     2.000 peak   470 spectrum    1 weight  0.10000E+01 volume  0.12549E-02 ppm1      1.873 ppm2      3.879 CV     1
 ASSI {  472}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HA  ))
      2.900     1.100     1.100 peak   472 spectrum    1 weight  0.10000E+01 volume  0.13672E-02 ppm1      1.872 ppm2      4.308 CV     1
 ASSI {  474}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      3.400     1.500     1.500 peak   474 spectrum    1 weight  0.10000E+01 volume  0.18716E-02 ppm1      1.875 ppm2      7.578 CV     1
 ASSI {  475}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      2.800     1.000     1.000 peak   475 spectrum    1 weight  0.10000E+01 volume  0.14449E-02 ppm1      1.654 ppm2      7.581 CV     1
 ASSI {  487}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HG  ))
      3.000     1.100     1.100 peak   487 spectrum    1 weight  0.10000E+01 volume  0.12217E-02 ppm1      1.875 ppm2      1.749 CV     1
 ASSI {  491}
   (( segid "    " and resid 34   and name HG  ))
   (  segid "    " and resid 34   and name HD1%)
      2.400     0.700     0.700 peak   491 spectrum    1 weight  0.10000E+01 volume  0.52999E-02 ppm1      1.744 ppm2      0.726 CV     1
 ASSI {  493}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.900     1.100     1.100 peak   493 spectrum    1 weight  0.10000E+01 volume  0.26623E-02 ppm1      4.306 ppm2      1.534 CV     1
 ASSI {  497}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   497 spectrum    1 weight  0.10000E+01 volume  0.26674E-02 ppm1      4.306 ppm2      7.705 CV     1
 ASSI {  498}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HA  ))
      2.800     1.000     1.000 peak   498 spectrum    1 weight  0.10000E+01 volume  0.12540E-02 ppm1      1.816 ppm2      4.304 CV     1
 ASSI {  500}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
      3.400     1.500     1.500 peak   500 spectrum    1 weight  0.10000E+01 volume  0.19901E-02 ppm1      1.816 ppm2      7.707 CV     1
 ASSI {  501}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HN  ))
      2.500     0.800     0.800 peak   501 spectrum    1 weight  0.10000E+01 volume  0.19201E-02 ppm1      1.526 ppm2      7.707 CV     1
 ASSI {  502}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      4.900     3.000     1.100 peak   502 spectrum    1 weight  0.10000E+01 volume  0.59115E-03 ppm1      1.817 ppm2      8.045 CV     1
 ASSI {  503}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      4.200     2.200     1.800 peak   503 spectrum    1 weight  0.10000E+01 volume  0.34685E-03 ppm1      1.525 ppm2      8.036 CV     1
 ASSI {  507}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 17   and name HG  ))
      2.500     0.800     0.800 peak   507 spectrum    1 weight  0.10000E+01 volume  0.20601E-02 ppm1      1.527 ppm2      1.651 CV     1
 ASSI {  510}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HG  ))
      3.100     1.200     1.200 peak   510 spectrum    1 weight  0.10000E+01 volume  0.14955E-02 ppm1      1.821 ppm2      1.654 CV     1
 ASSI {  512}
   (( segid "    " and resid 17   and name HB2 ))
   (( segid "    " and resid 19   and name HG12))
      2.800     1.000     1.000 peak   512 spectrum    1 weight  0.10000E+01 volume  0.48578E-03 ppm1      1.525 ppm2      1.011 CV     1
 ASSI {  514}
   (( segid "    " and resid 17   and name HB1 ))
   (  segid "    " and resid 17   and name HD2%)
      2.600     0.900     0.900 peak   514 spectrum    1 weight  0.10000E+01 volume  0.29676E-02 ppm1      1.819 ppm2      0.766 CV     1
 OR {  514}
   (( segid "    " and resid 17   and name HB1 ))
   (  segid "    " and resid 17   and name HD1%)
 ASSI {  515}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 19   and name HD1%)
      2.800     1.000     1.000 peak   515 spectrum    1 weight  0.10000E+01 volume  0.11510E-02 ppm1      1.526 ppm2      0.848 CV     1
 ASSI {  516}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 17   and name HD2%)
      2.700     0.900     0.900 peak   516 spectrum    1 weight  0.10000E+01 volume  0.41220E-02 ppm1      1.526 ppm2      0.766 CV     1
 OR {  516}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 17   and name HD1%)
 ASSI {  519}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HG  ))
      3.300     1.400     1.400 peak   519 spectrum    1 weight  0.10000E+01 volume  0.15114E-02 ppm1      4.302 ppm2      1.645 CV     1
 ASSI {  521}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   521 spectrum    1 weight  0.10000E+01 volume  0.16186E-02 ppm1      1.657 ppm2      7.706 CV     1
 ASSI {  523}
   (( segid "    " and resid 39   and name HG  ))
   (( segid "    " and resid 40   and name HN  ))
      3.800     1.800     1.800 peak   523 spectrum    1 weight  0.10000E+01 volume  0.84969E-03 ppm1      1.654 ppm2      9.315 CV     1
 ASSI {  524}
   (( segid "    " and resid 39   and name HG  ))
   (( segid "    " and resid 39   and name HN  ))
      3.500     1.600     1.600 peak   524 spectrum    1 weight  0.10000E+01 volume  0.24041E-02 ppm1      1.653 ppm2      7.799 CV     1
 ASSI {  538}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 36   and name HB2 ))
      3.800     1.800     1.800 peak   538 spectrum    1 weight  0.10000E+01 volume  0.13061E-02 ppm1      0.771 ppm2      1.180 CV     1
 OR {  538}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
 OR {  538}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
 ASSI {  540}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HG  ))
      2.200     0.600     0.600 peak   540 spectrum    1 weight  0.10000E+01 volume  0.62579E-02 ppm1      0.771 ppm2      1.655 CV     1
 OR {  540}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HG  ))
 ASSI {  541}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 19   and name HG11))
      3.300     1.400     1.400 peak   541 spectrum    1 weight  0.10000E+01 volume  0.28791E-02 ppm1      0.772 ppm2      1.446 CV     1
 ASSI {  543}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 16   and name HA  ))
      3.600     1.600     1.600 peak   543 spectrum    1 weight  0.10000E+01 volume  0.42663E-03 ppm1      0.773 ppm2      3.597 CV     1
 OR {  543}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 16   and name HA  ))
 ASSI {  545}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HA  ))
      2.400     0.700     0.700 peak   545 spectrum    1 weight  0.10000E+01 volume  0.62417E-02 ppm1      0.771 ppm2      4.307 CV     1
 OR {  545}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  546}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 17   and name HN  ))
      3.000     1.100     1.100 peak   546 spectrum    1 weight  0.10000E+01 volume  0.34337E-02 ppm1      0.771 ppm2      7.702 CV     1
 OR {  546}
   (  segid "    " and resid 17   and name HD2%)
   (( segid "    " and resid 17   and name HN  ))
 ASSI {  553}
   (  segid "    " and resid 17   and name HD1%)
   (  segid "    " and resid 19   and name HG2%)
      3.900     1.900     1.900 peak   553 spectrum    1 weight  0.10000E+01 volume  0.29997E-02 ppm1      0.770 ppm2      0.690 CV     1
 ASSI {  555}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB2 ))
      3.100     1.200     1.200 peak   555 spectrum    1 weight  0.10000E+01 volume  0.17190E-02 ppm1      4.069 ppm2      1.797 CV     1
 ASSI {  556}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HB1 ))
      2.700     0.900     0.900 peak   556 spectrum    1 weight  0.10000E+01 volume  0.19049E-02 ppm1      4.069 ppm2      1.886 CV     1
 ASSI {  557}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 37   and name HN  ))
      4.800     2.800     1.200 peak   557 spectrum    1 weight  0.10000E+01 volume  0.64307E-03 ppm1      1.881 ppm2      7.875 CV     1
 ASSI {  558}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.300     1.300     1.300 peak   558 spectrum    1 weight  0.10000E+01 volume  0.88230E-03 ppm1      1.797 ppm2      7.871 CV     1
 ASSI {  559}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
      3.800     1.800     1.800 peak   559 spectrum    1 weight  0.10000E+01 volume  0.52837E-03 ppm1      1.801 ppm2      8.366 CV     1
 ASSI {  560}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 38   and name HN  ))
      5.200     3.400     0.800 peak   560 spectrum    1 weight  0.10000E+01 volume  0.43734E-03 ppm1      1.876 ppm2      8.361 CV     1
 ASSI {  563}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      4.000     2.000     2.000 peak   563 spectrum    1 weight  0.10000E+01 volume  0.78665E-03 ppm1      1.881 ppm2      9.316 CV     1
 ASSI {  564}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
      2.800     1.000     1.000 peak   564 spectrum    1 weight  0.10000E+01 volume  0.74361E-03 ppm1      1.803 ppm2      9.315 CV     1
 ASSI {  568}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HG1 ))
      4.000     2.000     2.000 peak   568 spectrum    1 weight  0.10000E+01 volume  0.46445E-03 ppm1      1.880 ppm2      2.921 CV     1
 ASSI {  569}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HG1 ))
      3.000     1.100     1.100 peak   569 spectrum    1 weight  0.10000E+01 volume  0.67159E-03 ppm1      1.800 ppm2      2.920 CV     1
 ASSI {  570}
   (( segid "    " and resid 40   and name HB2 ))
   (( segid "    " and resid 40   and name HG2 ))
      3.600     1.600     1.600 peak   570 spectrum    1 weight  0.10000E+01 volume  0.73623E-03 ppm1      1.799 ppm2      2.515 CV     1
 ASSI {  572}
   (( segid "    " and resid 40   and name HB1 ))
   (( segid "    " and resid 40   and name HG2 ))
      3.500     1.500     1.500 peak   572 spectrum    1 weight  0.10000E+01 volume  0.30030E-03 ppm1      1.884 ppm2      2.515 CV     1
 ASSI {  578}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 36   and name HD1%)
      4.000     2.000     2.000 peak   578 spectrum    1 weight  0.10000E+01 volume  0.84729E-03 ppm1      1.882 ppm2      0.707 CV     1
 ASSI {  579}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 36   and name HD1%)
      3.300     1.400     1.400 peak   579 spectrum    1 weight  0.10000E+01 volume  0.84436E-03 ppm1      1.795 ppm2      0.709 CV     1
 ASSI {  580}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 39   and name HD2%)
      4.300     2.300     1.700 peak   580 spectrum    1 weight  0.10000E+01 volume  0.72195E-03 ppm1      1.878 ppm2      0.906 CV     1
 ASSI {  581}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 39   and name HD2%)
      4.000     2.000     2.000 peak   581 spectrum    1 weight  0.10000E+01 volume  0.10121E-02 ppm1      1.798 ppm2      0.903 CV     1
 ASSI {  587}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
      2.900     1.100     1.100 peak   587 spectrum    1 weight  0.10000E+01 volume  0.15919E-02 ppm1      1.848 ppm2      3.823 CV     1
 ASSI {  589}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      3.700     3.700     2.300 peak   589 spectrum    1 weight  0.10000E+01 volume  0.12259E-02 ppm1      2.097 ppm2      8.105 CV     1
 ASSI {  590}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      4.200     2.200     1.800 peak   590 spectrum    1 weight  0.10000E+01 volume  0.67654E-03 ppm1      1.846 ppm2      8.109 CV     1
 ASSI {  591}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HN  ))
      3.300     1.400     1.400 peak   591 spectrum    1 weight  0.10000E+01 volume  0.14312E-02 ppm1      2.103 ppm2      8.410 CV     1
 ASSI {  592}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HN  ))
      2.500     0.800     0.800 peak   592 spectrum    1 weight  0.10000E+01 volume  0.20157E-02 ppm1      1.848 ppm2      8.411 CV     1
 ASSI {  600}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.700     0.900     0.900 peak   600 spectrum    1 weight  0.10000E+01 volume  0.17878E-02 ppm1      2.099 ppm2      1.667 CV     1
 ASSI {  601}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.200     0.600     0.600 peak   601 spectrum    1 weight  0.10000E+01 volume  0.12041E-01 ppm1      1.861 ppm2      1.676 CV     1
 ASSI {  609}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HG2 ))
      3.700     1.700     1.700 peak   609 spectrum    1 weight  0.10000E+01 volume  0.47102E-03 ppm1      3.824 ppm2      1.663 CV     1
 ASSI {  610}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      3.200     1.300     1.300 peak   610 spectrum    1 weight  0.10000E+01 volume  0.82702E-03 ppm1      3.828 ppm2      8.409 CV     1
 ASSI {  611}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      3.600     1.600     1.600 peak   611 spectrum    1 weight  0.10000E+01 volume  0.42252E-03 ppm1      3.825 ppm2      8.119 CV     1
 ASSI {  612}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      3.700     1.700     1.700 peak   612 spectrum    1 weight  0.10000E+01 volume  0.46787E-03 ppm1      3.830 ppm2      7.927 CV     1
 ASSI {  615}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HG1 ))
      3.400     1.400     1.400 peak   615 spectrum    1 weight  0.10000E+01 volume  0.64550E-03 ppm1      3.829 ppm2      1.960 CV     1
 ASSI {  617}
   (( segid "    " and resid 45   and name HA  ))
   (  segid "    " and resid 44   and name HG1%)
      3.400     1.400     1.400 peak   617 spectrum    1 weight  0.10000E+01 volume  0.94336E-03 ppm1      3.824 ppm2      0.716 CV     1
 ASSI {  618}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HA  ))
      3.000     1.100     1.100 peak   618 spectrum    1 weight  0.10000E+01 volume  0.14351E-02 ppm1      2.095 ppm2      3.829 CV     1
 ASSI {  620}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HB2 ))
      2.400     0.700     0.700 peak   620 spectrum    1 weight  0.10000E+01 volume  0.58881E-02 ppm1      4.290 ppm2      3.258 CV     1
 OR {  620}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HB1 ))
 ASSI {  621}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      3.200     1.300     1.300 peak   621 spectrum    1 weight  0.10000E+01 volume  0.10378E-02 ppm1      4.293 ppm2      7.744 CV     1
 ASSI {  622}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      2.600     0.900     0.900 peak   622 spectrum    1 weight  0.10000E+01 volume  0.32603E-02 ppm1      4.289 ppm2      8.033 CV     1
 ASSI {  623}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      3.600     1.600     1.600 peak   623 spectrum    1 weight  0.10000E+01 volume  0.58134E-03 ppm1      4.290 ppm2      7.596 CV     1
 ASSI {  628}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 12   and name HA  ))
      2.900     1.100     1.100 peak   628 spectrum    1 weight  0.10000E+01 volume  0.19599E-02 ppm1      3.259 ppm2      4.103 CV     1
 OR {  628}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI {  629}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 16   and name HN  ))
      2.800     1.000     1.000 peak   629 spectrum    1 weight  0.10000E+01 volume  0.19700E-02 ppm1      3.257 ppm2      7.597 CV     1
 OR {  629}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 16   and name HN  ))
 ASSI {  630}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
      2.500     0.800     0.800 peak   630 spectrum    1 weight  0.10000E+01 volume  0.40261E-02 ppm1      3.260 ppm2      8.031 CV     1
 OR {  630}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  635}
   (( segid "    " and resid 15   and name HB1 ))
   (  segid "    " and resid 16   and name HD1%)
      4.200     2.200     1.800 peak   635 spectrum    1 weight  0.10000E+01 volume  0.40864E-03 ppm1      3.257 ppm2      0.776 CV     1
 OR {  635}
   (( segid "    " and resid 15   and name HB2 ))
   (  segid "    " and resid 16   and name HD1%)
 ASSI {  637}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB  ))
      2.900     1.000     1.000 peak   637 spectrum    1 weight  0.10000E+01 volume  0.20893E-02 ppm1      3.585 ppm2      2.001 CV     1
 ASSI {  639}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HG12))
      2.700     0.900     0.900 peak   639 spectrum    1 weight  0.10000E+01 volume  0.38146E-02 ppm1      3.584 ppm2      1.225 CV     1
 ASSI {  640}
   (( segid "    " and resid 16   and name HA  ))
   (  segid "    " and resid 16   and name HG2%)
      2.500     0.800     0.800 peak   640 spectrum    1 weight  0.10000E+01 volume  0.52759E-02 ppm1      3.584 ppm2      0.901 CV     1
 ASSI {  642}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.400     1.400     1.400 peak   642 spectrum    1 weight  0.10000E+01 volume  0.78791E-03 ppm1      3.583 ppm2      7.703 CV     1
 ASSI {  644}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.700     0.900     0.900 peak   644 spectrum    1 weight  0.10000E+01 volume  0.23401E-02 ppm1      3.584 ppm2      7.599 CV     1
 ASSI {  647}
   (( segid "    " and resid 16   and name HB  ))
   (( segid "    " and resid 16   and name HN  ))
      2.500     0.800     0.800 peak   647 spectrum    1 weight  0.10000E+01 volume  0.34319E-02 ppm1      1.999 ppm2      7.601 CV     1
 ASSI {  648}
   (( segid "    " and resid 16   and name HB  ))
   (( segid "    " and resid 17   and name HN  ))
      2.700     0.900     0.900 peak   648 spectrum    1 weight  0.10000E+01 volume  0.15285E-02 ppm1      2.001 ppm2      7.700 CV     1
 ASSI {  654}
   (( segid "    " and resid 16   and name HB  ))
   (( segid "    " and resid 16   and name HG11))
      2.800     1.000     1.000 peak   654 spectrum    1 weight  0.10000E+01 volume  0.13818E-02 ppm1      2.002 ppm2      1.791 CV     1
 ASSI {  661}
   (( segid "    " and resid 16   and name HG12))
   (  segid "    " and resid 16   and name HD1%)
      2.300     0.600     0.600 peak   661 spectrum    1 weight  0.10000E+01 volume  0.55372E-02 ppm1      1.222 ppm2      0.773 CV     1
 ASSI {  663}
   (( segid "    " and resid 16   and name HG12))
   (( segid "    " and resid 16   and name HB  ))
      2.400     0.700     0.700 peak   663 spectrum    1 weight  0.10000E+01 volume  0.31958E-02 ppm1      1.215 ppm2      2.003 CV     1
 ASSI {  664}
   (( segid "    " and resid 16   and name HG12))
   (( segid "    " and resid 16   and name HN  ))
      2.400     0.700     0.700 peak   664 spectrum    1 weight  0.10000E+01 volume  0.17389E-02 ppm1      1.220 ppm2      7.597 CV     1
 ASSI {  666}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HG12))
      3.300     1.400     1.400 peak   666 spectrum    1 weight  0.10000E+01 volume  0.34496E-02 ppm1      0.903 ppm2      1.225 CV     1
 ASSI {  668}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HB  ))
      2.300     0.600     0.600 peak   668 spectrum    1 weight  0.10000E+01 volume  0.57498E-02 ppm1      0.903 ppm2      2.000 CV     1
 ASSI {  675}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      2.800     2.800     3.200 peak   675 spectrum    1 weight  0.10000E+01 volume  0.31044E-02 ppm1      0.902 ppm2      4.061 CV     1
 ASSI {  676}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name HA  ))
      3.500     1.500     1.500 peak   676 spectrum    1 weight  0.10000E+01 volume  0.94438E-03 ppm1      0.903 ppm2      4.303 CV     1
 ASSI {  678}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HN  ))
      3.900     1.900     1.900 peak   678 spectrum    1 weight  0.10000E+01 volume  0.20680E-02 ppm1      0.903 ppm2      7.598 CV     1
 ASSI {  679}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 17   and name HN  ))
      3.600     1.600     1.600 peak   679 spectrum    1 weight  0.10000E+01 volume  0.11824E-02 ppm1      0.903 ppm2      7.701 CV     1
 ASSI {  681}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 40   and name HN  ))
      3.800     1.800     1.800 peak   681 spectrum    1 weight  0.10000E+01 volume  0.79172E-03 ppm1      0.903 ppm2      9.318 CV     1
 ASSI {  684}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 16   and name HG11))
      2.400     0.700     0.700 peak   684 spectrum    1 weight  0.10000E+01 volume  0.47714E-02 ppm1      0.903 ppm2      1.788 CV     1
 ASSI {  689}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 18   and name HA2 ))
      5.100     3.200     0.900 peak   689 spectrum    1 weight  0.10000E+01 volume  0.23067E-03 ppm1      4.309 ppm2      3.671 CV     1
 ASSI {  691}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 17   and name HD2%)
      2.500     0.800     0.800 peak   691 spectrum    1 weight  0.10000E+01 volume  0.40810E-02 ppm1      4.307 ppm2      0.772 CV     1
 ASSI {  692}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 19   and name HG2%)
      5.300     3.500     0.700 peak   692 spectrum    1 weight  0.10000E+01 volume  0.34568E-03 ppm1      4.307 ppm2      0.688 CV     1
 ASSI {  697}
   (( segid "    " and resid 17   and name HG  ))
   (( segid "    " and resid 14   and name HA  ))
      3.300     1.400     1.400 peak   697 spectrum    1 weight  0.10000E+01 volume  0.69370E-03 ppm1      1.660 ppm2      3.825 CV     1
 ASSI {  698}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 17   and name HD2%)
      2.500     0.800     0.800 peak   698 spectrum    1 weight  0.10000E+01 volume  0.33917E-02 ppm1      1.656 ppm2      0.773 CV     1
 ASSI {  699}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 19   and name HG2%)
      5.300     3.500     0.700 peak   699 spectrum    1 weight  0.10000E+01 volume  0.57045E-03 ppm1      1.657 ppm2      0.693 CV     1
 ASSI {  700}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 14   and name HB% )
      5.000     3.100     1.000 peak   700 spectrum    1 weight  0.10000E+01 volume  0.30225E-03 ppm1      1.657 ppm2      1.418 CV     1
 ASSI {  701}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 19   and name HD1%)
      3.800     1.800     1.800 peak   701 spectrum    1 weight  0.10000E+01 volume  0.95338E-03 ppm1      1.659 ppm2      0.855 CV     1
 ASSI {  702}
   (( segid "    " and resid 17   and name HG  ))
   (  segid "    " and resid 16   and name HG2%)
      3.600     1.600     1.600 peak   702 spectrum    1 weight  0.10000E+01 volume  0.11375E-02 ppm1      1.657 ppm2      0.926 CV     1
 ASSI {  706}
   (( segid "    " and resid 18   and name HA2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.000     1.100     1.100 peak   706 spectrum    1 weight  0.10000E+01 volume  0.14847E-02 ppm1      3.662 ppm2      8.045 CV     1
 ASSI {  708}
   (( segid "    " and resid 18   and name HA1 ))
   (( segid "    " and resid 18   and name HN  ))
      2.800     1.000     1.000 peak   708 spectrum    1 weight  0.10000E+01 volume  0.44427E-02 ppm1      3.999 ppm2      7.750 CV     1
 ASSI {  709}
   (( segid "    " and resid 18   and name HA2 ))
   (( segid "    " and resid 18   and name HN  ))
      2.300     0.600     0.600 peak   709 spectrum    1 weight  0.10000E+01 volume  0.51997E-02 ppm1      3.662 ppm2      7.751 CV     1
 ASSI {  710}
   (( segid "    " and resid 18   and name HA1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.600     1.600     1.600 peak   710 spectrum    1 weight  0.10000E+01 volume  0.13386E-02 ppm1      3.997 ppm2      8.043 CV     1
 ASSI {  712}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.300     0.700     0.700 peak   712 spectrum    1 weight  0.10000E+01 volume  0.31847E-02 ppm1      3.896 ppm2      8.551 CV     1
 ASSI {  713}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
      2.800     1.000     1.000 peak   713 spectrum    1 weight  0.10000E+01 volume  0.17746E-02 ppm1      3.896 ppm2      8.045 CV     1
 ASSI {  714}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 19   and name HN  ))
      2.700     0.900     0.900 peak   714 spectrum    1 weight  0.10000E+01 volume  0.43482E-02 ppm1      1.577 ppm2      8.046 CV     1
 ASSI {  715}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 18   and name HN  ))
      4.600     2.700     1.400 peak   715 spectrum    1 weight  0.10000E+01 volume  0.65341E-03 ppm1      1.576 ppm2      7.747 CV     1
 ASSI {  717}
   (( segid "    " and resid 19   and name HB  ))
   (( segid "    " and resid 19   and name HG12))
      3.000     1.100     1.100 peak   717 spectrum    1 weight  0.10000E+01 volume  0.15651E-02 ppm1      1.577 ppm2      1.016 CV     1
 ASSI {  718}
   (( segid "    " and resid 19   and name HB  ))
   (  segid "    " and resid 19   and name HD1%)
      2.400     0.700     0.700 peak   718 spectrum    1 weight  0.10000E+01 volume  0.37888E-02 ppm1      1.578 ppm2      0.842 CV     1
 ASSI {  723}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG12))
      2.900     1.000     1.000 peak   723 spectrum    1 weight  0.10000E+01 volume  0.23550E-02 ppm1      3.895 ppm2      1.014 CV     1
 ASSI {  724}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 19   and name HD1%)
      4.000     2.000     2.000 peak   724 spectrum    1 weight  0.10000E+01 volume  0.18258E-02 ppm1      3.896 ppm2      0.850 CV     1
 ASSI {  725}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB  ))
      2.900     1.000     1.000 peak   725 spectrum    1 weight  0.10000E+01 volume  0.15613E-02 ppm1      3.896 ppm2      1.573 CV     1
 ASSI {  726}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG11))
      3.300     1.400     1.400 peak   726 spectrum    1 weight  0.10000E+01 volume  0.15324E-02 ppm1      3.895 ppm2      1.465 CV     1
 ASSI {  727}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HA  ))
      4.200     2.200     1.800 peak   727 spectrum    1 weight  0.10000E+01 volume  0.62672E-03 ppm1      3.896 ppm2      4.187 CV     1
 ASSI {  744}
   (( segid "    " and resid 19   and name HG11))
   (  segid "    " and resid 19   and name HG2%)
      2.800     1.000     1.000 peak   744 spectrum    1 weight  0.10000E+01 volume  0.57624E-02 ppm1      1.455 ppm2      0.705 CV     1
 ASSI {  745}
   (( segid "    " and resid 19   and name HG11))
   (  segid "    " and resid 19   and name HD1%)
      1.900     0.400     0.400 peak   745 spectrum    1 weight  0.10000E+01 volume  0.11590E-01 ppm1      1.452 ppm2      0.841 CV     1
 ASSI {  749}
   (( segid "    " and resid 19   and name HG11))
   (( segid "    " and resid 19   and name HN  ))
      2.800     1.000     1.000 peak   749 spectrum    1 weight  0.10000E+01 volume  0.98929E-03 ppm1      1.463 ppm2      8.053 CV     1
 ASSI {  750}
   (( segid "    " and resid 19   and name HG12))
   (( segid "    " and resid 19   and name HN  ))
      3.400     1.400     1.400 peak   750 spectrum    1 weight  0.10000E+01 volume  0.38476E-03 ppm1      1.014 ppm2      8.047 CV     1
 ASSI {  757}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 21   and name HN  ))
      3.800     1.800     1.800 peak   757 spectrum    1 weight  0.10000E+01 volume  0.16562E-02 ppm1      0.699 ppm2      7.537 CV     1
 ASSI {  758}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HN  ))
      3.500     1.500     1.500 peak   758 spectrum    1 weight  0.10000E+01 volume  0.17525E-02 ppm1      0.698 ppm2      8.048 CV     1
 ASSI {  759}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 20   and name HN  ))
      3.100     1.200     1.200 peak   759 spectrum    1 weight  0.10000E+01 volume  0.15167E-02 ppm1      0.699 ppm2      8.549 CV     1
 ASSI {  760}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 18   and name HA1 ))
      2.200     2.200     3.800 peak   760 spectrum    1 weight  0.10000E+01 volume  0.29060E-02 ppm1      0.699 ppm2      3.983 CV     1
 ASSI {  761}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HA  ))
      2.300     0.700     0.700 peak   761 spectrum    1 weight  0.10000E+01 volume  0.50048E-02 ppm1      0.699 ppm2      3.897 CV     1
 ASSI {  762}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 21   and name HA  ))
      4.300     2.300     1.700 peak   762 spectrum    1 weight  0.10000E+01 volume  0.10625E-02 ppm1      0.693 ppm2      4.735 CV     1
 ASSI {  763}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 20   and name HA  ))
      4.400     2.500     1.600 peak   763 spectrum    1 weight  0.10000E+01 volume  0.64988E-03 ppm1      0.699 ppm2      4.190 CV     1
 ASSI {  764}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
      4.100     2.100     1.900 peak   764 spectrum    1 weight  0.10000E+01 volume  0.93770E-03 ppm1      0.699 ppm2      1.884 CV     1
 ASSI {  765}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 25   and name HG11))
      2.300     0.700     0.700 peak   765 spectrum    1 weight  0.10000E+01 volume  0.28474E-02 ppm1      0.699 ppm2      1.322 CV     1
 ASSI {  767}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HB  ))
      2.000     0.500     0.500 peak   767 spectrum    1 weight  0.10000E+01 volume  0.85920E-02 ppm1      0.699 ppm2      1.575 CV     1
 ASSI {  768}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 19   and name HG12))
      2.300     0.700     0.700 peak   768 spectrum    1 weight  0.10000E+01 volume  0.43680E-02 ppm1      0.699 ppm2      1.015 CV     1
 ASSI {  772}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      5.000     3.100     1.000 peak   772 spectrum    1 weight  0.10000E+01 volume  0.34346E-03 ppm1      3.896 ppm2      7.537 CV     1
 ASSI {  773}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak   773 spectrum    1 weight  0.10000E+01 volume  0.32375E-02 ppm1      3.781 ppm2      8.361 CV     1
 ASSI {  774}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 41   and name HN  ))
      2.800     1.000     1.000 peak   774 spectrum    1 weight  0.10000E+01 volume  0.28300E-02 ppm1      3.493 ppm2      8.361 CV     1
 ASSI {  775}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 42   and name HN  ))
      3.300     1.300     1.300 peak   775 spectrum    1 weight  0.10000E+01 volume  0.10315E-02 ppm1      3.783 ppm2      7.379 CV     1
 ASSI {  776}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 42   and name HN  ))
      3.500     1.600     1.600 peak   776 spectrum    1 weight  0.10000E+01 volume  0.10781E-02 ppm1      3.492 ppm2      7.381 CV     1
 ASSI {  777}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 44   and name HB  ))
      4.500     2.500     1.500 peak   777 spectrum    1 weight  0.10000E+01 volume  0.57705E-03 ppm1      3.780 ppm2      1.977 CV     1
 ASSI {  778}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 44   and name HB  ))
      3.000     1.100     1.100 peak   778 spectrum    1 weight  0.10000E+01 volume  0.98386E-03 ppm1      3.494 ppm2      1.979 CV     1
 ASSI {  781}
   (( segid "    " and resid 41   and name HA2 ))
   (  segid "    " and resid 44   and name HG1%)
      3.500     1.500     1.500 peak   781 spectrum    1 weight  0.10000E+01 volume  0.18757E-02 ppm1      3.491 ppm2      0.730 CV     1
 ASSI {  782}
   (( segid "    " and resid 41   and name HA1 ))
   (  segid "    " and resid 44   and name HG1%)
      4.500     2.500     1.500 peak   782 spectrum    1 weight  0.10000E+01 volume  0.12485E-02 ppm1      3.782 ppm2      0.731 CV     1
 ASSI {  783}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 36   and name HG  ))
      5.500     3.700     0.500 peak   783 spectrum    1 weight  0.10000E+01 volume  0.44592E-03 ppm1      3.495 ppm2      1.741 CV     1
 ASSI {  784}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 40   and name HA  ))
      5.400     3.700     0.600 peak   784 spectrum    1 weight  0.10000E+01 volume  0.13778E-03 ppm1      3.785 ppm2      4.081 CV     1
 ASSI {  793}
   (( segid "    " and resid 41   and name HA2 ))
   (( segid "    " and resid 40   and name HA  ))
      4.100     2.100     1.900 peak   793 spectrum    1 weight  0.10000E+01 volume  0.32621E-03 ppm1      3.501 ppm2      4.080 CV     1
 ASSI {  797}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HB1 ))
      3.100     1.200     1.200 peak   797 spectrum    1 weight  0.10000E+01 volume  0.15810E-02 ppm1      3.148 ppm2      2.101 CV     1
 OR {  797}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HB1 ))
 ASSI {  798}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG1 ))
      2.700     0.900     0.900 peak   798 spectrum    1 weight  0.10000E+01 volume  0.23567E-02 ppm1      3.148 ppm2      1.953 CV     1
 OR {  798}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HG1 ))
 ASSI {  800}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.800     0.900     0.900 peak   800 spectrum    1 weight  0.10000E+01 volume  0.17106E-02 ppm1      3.147 ppm2      1.663 CV     1
 OR {  800}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HG2 ))
 ASSI {  804}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 58   and name HA  ))
      3.900     1.900     1.900 peak   804 spectrum    1 weight  0.10000E+01 volume  0.60578E-03 ppm1      3.148 ppm2      3.690 CV     1
 OR {  804}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 58   and name HA  ))
 OR {  804}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 58   and name HA  ))
 OR {  804}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI {  807}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HE  ))
      3.300     1.400     1.400 peak   807 spectrum    1 weight  0.10000E+01 volume  0.66454E-03 ppm1      3.148 ppm2      7.367 CV     1
 OR {  807}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HE  ))
 ASSI {  809}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HN  ))
      5.700     4.100     0.300 peak   809 spectrum    1 weight  0.10000E+01 volume  0.15964E-03 ppm1      3.146 ppm2      8.410 CV     1
 OR {  809}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HN  ))
 ASSI {  812}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HA  ))
      4.600     2.600     1.400 peak   812 spectrum    1 weight  0.10000E+01 volume  0.45995E-03 ppm1      3.146 ppm2      3.823 CV     1
 OR {  812}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HA  ))
 ASSI {  815}
   (( segid "    " and resid 45   and name HD1 ))
   (( segid "    " and resid 45   and name HB2 ))
      3.400     1.400     1.400 peak   815 spectrum    1 weight  0.10000E+01 volume  0.12491E-02 ppm1      3.148 ppm2      1.857 CV     1
 OR {  815}
   (( segid "    " and resid 45   and name HD2 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {  816}
   (( segid "    " and resid 45   and name HD2 ))
   (  segid "    " and resid 61   and name HG1%)
      3.600     3.600     2.400 peak   816 spectrum    1 weight  0.10000E+01 volume  0.11384E-02 ppm1      3.144 ppm2      0.783 CV     1
 OR {  816}
   (( segid "    " and resid 45   and name HD1 ))
   (  segid "    " and resid 61   and name HG1%)
 ASSI {  819}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HG2 ))
      2.800     0.900     0.900 peak   819 spectrum    1 weight  0.10000E+01 volume  0.21760E-02 ppm1      4.241 ppm2      2.388 CV     1
 ASSI {  820}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HB1 ))
      2.500     0.800     0.800 peak   820 spectrum    1 weight  0.10000E+01 volume  0.33161E-02 ppm1      4.241 ppm2      2.295 CV     1
 ASSI {  822}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      3.500     1.600     1.600 peak   822 spectrum    1 weight  0.10000E+01 volume  0.66472E-03 ppm1      4.241 ppm2      8.485 CV     1
 ASSI {  823}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      4.800     2.900     1.200 peak   823 spectrum    1 weight  0.10000E+01 volume  0.35237E-03 ppm1      4.239 ppm2      8.413 CV     1
 ASSI {  824}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      2.400     0.700     0.700 peak   824 spectrum    1 weight  0.10000E+01 volume  0.33296E-02 ppm1      2.125 ppm2      8.104 CV     1
 ASSI {  825}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 47   and name HN  ))
      2.900     1.000     1.000 peak   825 spectrum    1 weight  0.10000E+01 volume  0.18961E-02 ppm1      2.126 ppm2      7.945 CV     1
 ASSI {  826}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
      3.300     1.400     1.400 peak   826 spectrum    1 weight  0.10000E+01 volume  0.34871E-02 ppm1      2.296 ppm2      8.104 CV     1
 ASSI {  828}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 47   and name HN  ))
      3.500     1.600     1.600 peak   828 spectrum    1 weight  0.10000E+01 volume  0.13051E-02 ppm1      2.294 ppm2      7.947 CV     1
 ASSI {  829}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      2.800     1.000     1.000 peak   829 spectrum    1 weight  0.10000E+01 volume  0.20471E-02 ppm1      4.242 ppm2      8.106 CV     1
 ASSI {  830}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      2.900     1.100     1.100 peak   830 spectrum    1 weight  0.10000E+01 volume  0.13429E-02 ppm1      4.241 ppm2      7.942 CV     1
 ASSI {  832}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 43   and name HA  ))
      4.000     2.000     2.000 peak   832 spectrum    1 weight  0.10000E+01 volume  0.14860E-02 ppm1      2.294 ppm2      4.090 CV     1
 ASSI {  833}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      3.100     1.200     1.200 peak   833 spectrum    1 weight  0.10000E+01 volume  0.20547E-02 ppm1      2.125 ppm2      4.243 CV     1
 ASSI {  835}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      3.100     1.200     1.200 peak   835 spectrum    1 weight  0.10000E+01 volume  0.72969E-03 ppm1      2.124 ppm2      4.089 CV     1
 ASSI {  836}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HG1 ))
      2.800     1.000     1.000 peak   836 spectrum    1 weight  0.10000E+01 volume  0.30360E-02 ppm1      2.297 ppm2      2.575 CV     1
 ASSI {  837}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HG1 ))
      2.500     0.800     0.800 peak   837 spectrum    1 weight  0.10000E+01 volume  0.26886E-02 ppm1      2.124 ppm2      2.575 CV     1
 ASSI {  838}
   (( segid "    " and resid 46   and name HB1 ))
   (( segid "    " and resid 46   and name HG2 ))
      2.400     0.700     0.700 peak   838 spectrum    1 weight  0.10000E+01 volume  0.57813E-02 ppm1      2.296 ppm2      2.391 CV     1
 ASSI {  839}
   (( segid "    " and resid 46   and name HB2 ))
   (( segid "    " and resid 46   and name HG2 ))
      2.600     0.800     0.800 peak   839 spectrum    1 weight  0.10000E+01 volume  0.50681E-02 ppm1      2.125 ppm2      2.390 CV     1
 ASSI {  845}
   (( segid "    " and resid 46   and name HA  ))
   (( segid "    " and resid 46   and name HG1 ))
      3.900     1.900     1.900 peak   845 spectrum    1 weight  0.10000E+01 volume  0.75644E-03 ppm1      4.239 ppm2      2.576 CV     1
 ASSI {  877}
   (( segid "    " and resid 46   and name HG2 ))
   (  segid "    " and resid 42   and name HG1%)
      4.100     2.100     1.900 peak   877 spectrum    1 weight  0.10000E+01 volume  0.39805E-03 ppm1      2.391 ppm2      0.944 CV     1
 ASSI {  880}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HE22))
      4.400     2.500     1.600 peak   880 spectrum    1 weight  0.10000E+01 volume  0.47297E-03 ppm1      2.575 ppm2      7.338 CV     1
 ASSI {  881}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HE22))
      4.500     2.600     1.500 peak   881 spectrum    1 weight  0.10000E+01 volume  0.44949E-03 ppm1      2.391 ppm2      7.338 CV     1
 ASSI {  883}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 47   and name HN  ))
      4.900     3.000     1.100 peak   883 spectrum    1 weight  0.10000E+01 volume  0.26604E-03 ppm1      2.388 ppm2      7.944 CV     1
 ASSI {  885}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HN  ))
      3.700     1.700     1.700 peak   885 spectrum    1 weight  0.10000E+01 volume  0.58410E-03 ppm1      2.388 ppm2      8.106 CV     1
 ASSI {  886}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HN  ))
      3.300     1.300     1.300 peak   886 spectrum    1 weight  0.10000E+01 volume  0.10014E-02 ppm1      2.576 ppm2      8.105 CV     1
 ASSI {  887}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 47   and name HN  ))
      5.100     3.200     0.900 peak   887 spectrum    1 weight  0.10000E+01 volume  0.25448E-03 ppm1      2.577 ppm2      7.945 CV     1
 ASSI {  890}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HG12))
      2.500     0.800     0.800 peak   890 spectrum    1 weight  0.10000E+01 volume  0.26768E-02 ppm1      3.787 ppm2      1.111 CV     1
 ASSI {  891}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.000     1.100     1.100 peak   891 spectrum    1 weight  0.10000E+01 volume  0.12921E-02 ppm1      3.789 ppm2      1.969 CV     1
 ASSI {  892}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HB  ))
      2.600     0.800     0.800 peak   892 spectrum    1 weight  0.10000E+01 volume  0.37030E-02 ppm1      3.788 ppm2      1.888 CV     1
 ASSI {  893}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HG11))
      2.800     0.900     0.900 peak   893 spectrum    1 weight  0.10000E+01 volume  0.28970E-02 ppm1      3.788 ppm2      1.810 CV     1
 ASSI {  894}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 51   and name HG2 ))
      3.000     1.100     1.100 peak   894 spectrum    1 weight  0.10000E+01 volume  0.12688E-02 ppm1      3.791 ppm2      2.233 CV     1
 OR {  894}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 51   and name HG1 ))
 ASSI {  895}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
      2.400     0.700     0.700 peak   895 spectrum    1 weight  0.10000E+01 volume  0.53914E-02 ppm1      3.789 ppm2      0.876 CV     1
 ASSI {  896}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 47   and name HD1%)
      4.100     2.100     1.900 peak   896 spectrum    1 weight  0.10000E+01 volume  0.15839E-02 ppm1      3.788 ppm2      0.787 CV     1
 ASSI {  897}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      2.500     0.800     0.800 peak   897 spectrum    1 weight  0.10000E+01 volume  0.34796E-02 ppm1      3.788 ppm2      7.946 CV     1
 ASSI {  898}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      3.400     1.400     1.400 peak   898 spectrum    1 weight  0.10000E+01 volume  0.10092E-02 ppm1      3.788 ppm2      8.134 CV     1
 ASSI {  899}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      3.600     1.600     1.600 peak   899 spectrum    1 weight  0.10000E+01 volume  0.85578E-03 ppm1      3.787 ppm2      8.556 CV     1
 ASSI {  900}
   (( segid "    " and resid 47   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      3.500     1.500     1.500 peak   900 spectrum    1 weight  0.10000E+01 volume  0.79963E-03 ppm1      3.789 ppm2      8.479 CV     1
 ASSI {  901}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 47   and name HN  ))
      2.200     0.600     0.600 peak   901 spectrum    1 weight  0.10000E+01 volume  0.52657E-02 ppm1      1.890 ppm2      7.947 CV     1
 ASSI {  902}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
      2.600     0.900     0.900 peak   902 spectrum    1 weight  0.10000E+01 volume  0.24292E-02 ppm1      1.889 ppm2      8.134 CV     1
 ASSI {  903}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 50   and name HN  ))
      4.900     2.900     1.100 peak   903 spectrum    1 weight  0.10000E+01 volume  0.27007E-03 ppm1      1.888 ppm2      8.454 CV     1
 ASSI {  904}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 44   and name HA  ))
      2.700     0.900     0.900 peak   904 spectrum    1 weight  0.10000E+01 volume  0.18827E-02 ppm1      1.889 ppm2      3.455 CV     1
 ASSI {  907}
   (( segid "    " and resid 47   and name HB  ))
   (( segid "    " and resid 47   and name HG12))
      3.400     1.400     1.400 peak   907 spectrum    1 weight  0.10000E+01 volume  0.10757E-02 ppm1      1.890 ppm2      1.111 CV     1
 ASSI {  908}
   (( segid "    " and resid 47   and name HB  ))
   (  segid "    " and resid 47   and name HG2%)
      2.300     0.600     0.600 peak   908 spectrum    1 weight  0.10000E+01 volume  0.51301E-02 ppm1      1.889 ppm2      0.875 CV     1
 ASSI {  914}
   (( segid "    " and resid 47   and name HG11))
   (  segid "    " and resid 48   and name HD1%)
      5.000     3.100     1.000 peak   914 spectrum    1 weight  0.10000E+01 volume  0.48917E-03 ppm1      1.811 ppm2      0.699 CV     1
 ASSI {  918}
   (( segid "    " and resid 47   and name HG12))
   (  segid "    " and resid 48   and name HD1%)
      5.200     3.400     0.800 peak   918 spectrum    1 weight  0.10000E+01 volume  0.38224E-03 ppm1      1.105 ppm2      0.701 CV     1
 ASSI {  923}
   (( segid "    " and resid 47   and name HG11))
   (( segid "    " and resid 44   and name HA  ))
      3.500     1.600     1.600 peak   923 spectrum    1 weight  0.10000E+01 volume  0.69964E-03 ppm1      1.812 ppm2      3.454 CV     1
 ASSI {  924}
   (( segid "    " and resid 47   and name HG12))
   (( segid "    " and resid 44   and name HA  ))
      4.900     3.000     1.100 peak   924 spectrum    1 weight  0.10000E+01 volume  0.56121E-03 ppm1      1.106 ppm2      3.456 CV     1
 ASSI {  927}
   (( segid "    " and resid 47   and name HG11))
   (( segid "    " and resid 48   and name HN  ))
      4.400     2.400     1.600 peak   927 spectrum    1 weight  0.10000E+01 volume  0.56196E-03 ppm1      1.812 ppm2      8.130 CV     1
 ASSI {  928}
   (( segid "    " and resid 47   and name HG11))
   (( segid "    " and resid 47   and name HN  ))
      2.300     0.700     0.700 peak   928 spectrum    1 weight  0.10000E+01 volume  0.34673E-02 ppm1      1.813 ppm2      7.945 CV     1
 ASSI {  929}
   (( segid "    " and resid 47   and name HG12))
   (( segid "    " and resid 48   and name HN  ))
      5.400     3.600     0.600 peak   929 spectrum    1 weight  0.10000E+01 volume  0.31125E-03 ppm1      1.110 ppm2      8.134 CV     1
 ASSI {  930}
   (( segid "    " and resid 47   and name HG12))
   (( segid "    " and resid 47   and name HN  ))
      3.600     1.600     1.600 peak   930 spectrum    1 weight  0.10000E+01 volume  0.18049E-02 ppm1      1.107 ppm2      7.944 CV     1
 ASSI {  931}
   (( segid "    " and resid 47   and name HA  ))
   (  segid "    " and resid 48   and name HD1%)
      4.700     2.800     1.300 peak   931 spectrum    1 weight  0.10000E+01 volume  0.38428E-03 ppm1      3.789 ppm2      0.697 CV     1
 ASSI {  933}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.800     1.800 peak   933 spectrum    1 weight  0.10000E+01 volume  0.62609E-03 ppm1      0.772 ppm2      7.602 CV     1
 ASSI {  943}
   (( segid "    " and resid 19   and name HG12))
   (( segid "    " and resid 17   and name HB1 ))
      3.600     1.600     1.600 peak   943 spectrum    1 weight  0.10000E+01 volume  0.79810E-03 ppm1      1.008 ppm2      1.815 CV     1
 ASSI {  946}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 20   and name HG2 ))
      2.800     1.000     1.000 peak   946 spectrum    1 weight  0.10000E+01 volume  0.41217E-02 ppm1      1.707 ppm2      1.541 CV     1
 ASSI {  948}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HG2 ))
      2.400     0.700     0.700 peak   948 spectrum    1 weight  0.10000E+01 volume  0.47033E-02 ppm1      3.135 ppm2      1.539 CV     1
 OR {  948}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HG2 ))
 ASSI {  967}
   (  segid "    " and resid 22   and name HD2%)
   (  segid "    " and resid 14   and name HB% )
      2.700     0.900     0.900 peak   967 spectrum    1 weight  0.10000E+01 volume  0.21880E-02 ppm1      0.748 ppm2      1.425 CV     1
 ASSI {  970}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 25   and name HG12))
      5.000     3.200     1.000 peak   970 spectrum    1 weight  0.10000E+01 volume  0.34703E-03 ppm1      0.747 ppm2      1.265 CV     1
 ASSI {  971}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 20   and name HB2 ))
      3.200     1.300     1.300 peak   971 spectrum    1 weight  0.10000E+01 volume  0.26236E-03 ppm1      0.747 ppm2      1.723 CV     1
 ASSI {  972}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      4.200     2.200     1.800 peak   972 spectrum    1 weight  0.10000E+01 volume  0.74658E-03 ppm1      4.063 ppm2      7.343 CV     1
 ASSI {  973}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 23   and name HA  ))
      2.300     0.600     0.600 peak   973 spectrum    1 weight  0.10000E+01 volume  0.97321E-02 ppm1      1.338 ppm2      4.066 CV     1
 ASSI {  974}
   (  segid "    " and resid 23   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
      4.700     2.700     1.300 peak   974 spectrum    1 weight  0.10000E+01 volume  0.71841E-03 ppm1      1.337 ppm2      7.342 CV     1
 ASSI {  975}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
      2.900     2.900     3.100 peak   975 spectrum    1 weight  0.10000E+01 volume  0.44652E-03 ppm1      4.062 ppm2      4.728 CV     1
 ASSI {  976}
   (( segid "    " and resid 24   and name HA1 ))
   (( segid "    " and resid 25   and name HN  ))
      3.900     1.900     1.900 peak   976 spectrum    1 weight  0.10000E+01 volume  0.11584E-02 ppm1      3.907 ppm2      7.344 CV     1
 ASSI {  977}
   (( segid "    " and resid 24   and name HA2 ))
   (( segid "    " and resid 25   and name HN  ))
      3.100     1.200     1.200 peak   977 spectrum    1 weight  0.10000E+01 volume  0.11922E-02 ppm1      3.840 ppm2      7.343 CV     1
 ASSI {  978}
   (( segid "    " and resid 24   and name HA1 ))
   (( segid "    " and resid 24   and name HN  ))
      2.900     1.100     1.100 peak   978 spectrum    1 weight  0.10000E+01 volume  0.21617E-02 ppm1      3.908 ppm2      8.249 CV     1
 ASSI {  979}
   (( segid "    " and resid 24   and name HA2 ))
   (( segid "    " and resid 24   and name HN  ))
      2.900     1.100     1.100 peak   979 spectrum    1 weight  0.10000E+01 volume  0.19716E-02 ppm1      3.839 ppm2      8.247 CV     1
 ASSI {  983}
   (( segid "    " and resid 24   and name HA2 ))
   (( segid "    " and resid 24   and name HA1 ))
      1.900     0.400     0.400 peak   983 spectrum    1 weight  0.10000E+01 volume  0.94288E-02 ppm1      3.835 ppm2      3.911 CV     1
 ASSI {  985}
   (( segid "    " and resid 24   and name HA1 ))
   (  segid "    " and resid 23   and name HB% )
      3.500     1.500     1.500 peak   985 spectrum    1 weight  0.10000E+01 volume  0.76427E-03 ppm1      3.907 ppm2      1.339 CV     1
 ASSI {  986}
   (( segid "    " and resid 24   and name HA2 ))
   (  segid "    " and resid 23   and name HB% )
      2.800     2.800     3.200 peak   986 spectrum    1 weight  0.10000E+01 volume  0.56763E-03 ppm1      3.840 ppm2      1.339 CV     1
 ASSI {  993}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HG  ))
      3.400     1.400     1.400 peak   993 spectrum    1 weight  0.10000E+01 volume  0.10514E-02 ppm1      4.038 ppm2      1.775 CV     1
 ASSI {  995}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 27   and name HB2 ))
      3.100     1.200     1.200 peak   995 spectrum    1 weight  0.10000E+01 volume  0.20280E-02 ppm1      4.039 ppm2      1.305 CV     1
 ASSI {  997}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 66   and name HB1 ))
      3.200     1.300     1.300 peak   997 spectrum    1 weight  0.10000E+01 volume  0.11020E-02 ppm1      4.036 ppm2      1.953 CV     1
 ASSI { 1001}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 28   and name HN  ))
      3.600     1.600     1.600 peak  1001 spectrum    1 weight  0.10000E+01 volume  0.49352E-03 ppm1      4.038 ppm2      8.350 CV     1
 ASSI { 1002}
   (( segid "    " and resid 27   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      4.200     2.200     1.800 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.36526E-03 ppm1      4.041 ppm2      8.814 CV     1
 ASSI { 1003}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 27   and name HA  ))
      3.100     1.200     1.200 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.78710E-03 ppm1      1.667 ppm2      4.038 CV     1
 ASSI { 1010}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 28   and name HN  ))
      4.300     2.300     1.700 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.27802E-03 ppm1      1.304 ppm2      8.341 CV     1
 ASSI { 1011}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 28   and name HN  ))
      5.000     3.100     1.000 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.22318E-03 ppm1      1.670 ppm2      8.349 CV     1
 ASSI { 1013}
   (  segid "    " and resid 16   and name HD1%)
   (( segid "    " and resid 16   and name HN  ))
      3.600     1.600     1.600 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.17307E-02 ppm1      0.768 ppm2      7.602 CV     1
 ASSI { 1014}
   (  segid "    " and resid 16   and name HD1%)
   (( segid "    " and resid 17   and name HN  ))
      3.200     3.200     2.800 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.28846E-03 ppm1      0.768 ppm2      7.699 CV     1
 ASSI { 1016}
   (  segid "    " and resid 16   and name HD1%)
   (( segid "    " and resid 16   and name HA  ))
      2.300     0.700     0.700 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.58656E-02 ppm1      0.768 ppm2      3.562 CV     1
 ASSI { 1017}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 43   and name HG1 ))
      3.100     1.200     1.200 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.13638E-02 ppm1      0.774 ppm2      2.389 CV     1
 ASSI { 1018}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 43   and name HG2 ))
      2.600     0.900     0.900 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.26665E-02 ppm1      0.776 ppm2      2.240 CV     1
 ASSI { 1020}
   (  segid "    " and resid 16   and name HD1%)
   (( segid "    " and resid 16   and name HB  ))
      3.100     1.200     1.200 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.53299E-02 ppm1      0.768 ppm2      2.001 CV     1
 ASSI { 1025}
   (  segid "    " and resid 16   and name HD1%)
   (  segid "    " and resid 16   and name HG2%)
      2.000     0.500     0.500 peak  1025 spectrum    1 weight  0.10000E+01 volume  0.17302E-01 ppm1      0.778 ppm2      0.894 CV     1
 ASSI { 1028}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 25   and name HG11))
      3.000     1.200     1.200 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.15431E-02 ppm1      0.839 ppm2      1.318 CV     1
 ASSI { 1029}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 19   and name HG12))
      1.900     0.500     0.500 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.10183E-01 ppm1      0.839 ppm2      1.013 CV     1
 ASSI { 1030}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 17   and name HA  ))
      2.600     2.600     3.400 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.97579E-03 ppm1      0.840 ppm2      4.307 CV     1
 ASSI { 1033}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 17   and name HB1 ))
      3.400     1.500     1.500 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.14055E-02 ppm1      0.841 ppm2      1.824 CV     1
 ASSI { 1034}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 18   and name HA1 ))
      3.200     3.200     2.800 peak  1034 spectrum    1 weight  0.10000E+01 volume  0.26941E-03 ppm1      0.839 ppm2      3.993 CV     1
 ASSI { 1035}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 14   and name HA  ))
      3.000     1.200     1.200 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.20029E-02 ppm1      0.839 ppm2      3.854 CV     1
 ASSI { 1036}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 19   and name HN  ))
      4.200     2.200     1.800 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.11412E-02 ppm1      0.842 ppm2      8.045 CV     1
 ASSI { 1037}
   (  segid "    " and resid 19   and name HD1%)
   (( segid "    " and resid 18   and name HN  ))
      3.000     3.000     3.000 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.38527E-03 ppm1      0.841 ppm2      7.718 CV     1
 ASSI { 1039}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 26   and name HN  ))
      2.100     0.600     0.600 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.73089E-02 ppm1      4.074 ppm2      8.458 CV     1
 ASSI { 1040}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 25   and name HN  ))
      2.600     0.900     0.900 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.25081E-02 ppm1      4.074 ppm2      7.352 CV     1
 ASSI { 1041}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 25   and name HG2%)
      2.100     0.600     0.600 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.61709E-02 ppm1      1.886 ppm2      0.766 CV     1
 ASSI { 1042}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 22   and name HD1%)
      2.400     0.700     0.700 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.15203E-02 ppm1      1.885 ppm2      0.666 CV     1
 ASSI { 1047}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 22   and name HA  ))
      5.000     3.100     1.000 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.38866E-03 ppm1      0.763 ppm2      3.988 CV     1
 ASSI { 1048}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      4.000     2.000     2.000 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.11237E-02 ppm1      0.763 ppm2      7.344 CV     1
 ASSI { 1049}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
      2.900     1.100     1.100 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.15890E-02 ppm1      0.763 ppm2      8.459 CV     1
 ASSI { 1051}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 26   and name HN  ))
      3.700     1.700     1.700 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.92696E-03 ppm1      1.884 ppm2      8.451 CV     1
 ASSI { 1054}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      2.300     0.600     0.600 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.41424E-02 ppm1      1.884 ppm2      7.341 CV     1
 ASSI { 1055}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HA  ))
      2.700     0.900     0.900 peak  1055 spectrum    1 weight  0.10000E+01 volume  0.23428E-02 ppm1      1.886 ppm2      4.072 CV     1
 ASSI { 1056}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 22   and name HA  ))
      2.900     1.000     1.000 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.17962E-02 ppm1      1.885 ppm2      3.982 CV     1
 ASSI { 1059}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 27   and name HD2%)
      3.500     1.500     1.500 peak  1059 spectrum    1 weight  0.10000E+01 volume  0.86655E-03 ppm1      1.887 ppm2      0.870 CV     1
 ASSI { 1060}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
      2.500     0.800     0.800 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.43230E-02 ppm1      4.074 ppm2      0.765 CV     1
 ASSI { 1061}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 26   and name HB1 ))
      5.100     3.200     0.900 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.25406E-03 ppm1      0.760 ppm2      3.148 CV     1
 ASSI { 1063}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HG11))
      2.400     0.700     0.700 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.29558E-02 ppm1      1.884 ppm2      1.330 CV     1
 ASSI { 1064}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HG12))
      2.600     0.800     0.800 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.16465E-02 ppm1      1.884 ppm2      1.289 CV     1
 ASSI { 1065}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 27   and name HG  ))
      4.100     2.100     1.900 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.31877E-03 ppm1      0.760 ppm2      1.784 CV     1
 ASSI { 1066}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 22   and name HD1%)
      2.900     1.100     1.100 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.25015E-02 ppm1      0.761 ppm2      0.657 CV     1
 ASSI { 1068}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 22   and name HB2 ))
      3.900     1.900     1.900 peak  1068 spectrum    1 weight  0.10000E+01 volume  0.52297E-03 ppm1      1.887 ppm2      1.552 CV     1
 OR { 1068}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 22   and name HB1 ))
 ASSI { 1069}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 26   and name HN  ))
      4.300     2.400     1.700 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.11103E-02 ppm1      0.767 ppm2      8.456 CV     1
 ASSI { 1070}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HN  ))
      3.800     1.800     1.800 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.86016E-03 ppm1      0.764 ppm2      7.347 CV     1
 ASSI { 1071}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 22   and name HA  ))
      3.400     1.400     1.400 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.19112E-02 ppm1      0.766 ppm2      3.983 CV     1
 ASSI { 1072}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 19   and name HA  ))
      2.800     2.800     3.200 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.56976E-03 ppm1      0.767 ppm2      3.893 CV     1
 ASSI { 1073}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HA  ))
      2.500     0.800     0.800 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.36565E-02 ppm1      0.765 ppm2      4.075 CV     1
 ASSI { 1075}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HG12))
      2.500     0.800     0.800 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.30249E-02 ppm1      0.766 ppm2      1.293 CV     1
 ASSI { 1076}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HG11))
      2.700     0.900     0.900 peak  1076 spectrum    1 weight  0.10000E+01 volume  0.17781E-02 ppm1      0.766 ppm2      1.332 CV     1
 ASSI { 1077}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 14   and name HB% )
      3.000     3.000     3.000 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.40093E-03 ppm1      0.766 ppm2      1.427 CV     1
 ASSI { 1078}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 22   and name HB1 ))
      4.200     2.200     1.800 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.76925E-03 ppm1      0.767 ppm2      1.557 CV     1
 ASSI { 1079}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HB  ))
      3.400     1.400     1.400 peak  1079 spectrum    1 weight  0.10000E+01 volume  0.18120E-02 ppm1      0.764 ppm2      1.883 CV     1
 ASSI { 1081}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 22   and name HD1%)
      3.300     1.300     1.300 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.43119E-02 ppm1      0.766 ppm2      0.661 CV     1
 ASSI { 1088}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
      3.100     1.200     1.200 peak  1088 spectrum    1 weight  0.10000E+01 volume  0.23244E-02 ppm1      2.657 ppm2      4.639 CV     1
 ASSI { 1089}
   (( segid "    " and resid 79   and name HB1 ))
   (( segid "    " and resid 79   and name HN  ))
      4.600     2.600     1.400 peak  1089 spectrum    1 weight  0.10000E+01 volume  0.34070E-03 ppm1      2.712 ppm2      8.506 CV     1
 ASSI { 1090}
   (( segid "    " and resid 79   and name HB2 ))
   (( segid "    " and resid 79   and name HN  ))
      3.900     1.900     1.900 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.35396E-03 ppm1      2.656 ppm2      8.507 CV     1
 ASSI { 1093}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HB1 ))
      2.700     0.900     0.900 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.26424E-02 ppm1      4.636 ppm2      2.714 CV     1
 ASSI { 1094}
   (( segid "    " and resid 78   and name HB2 ))
   (( segid "    " and resid 78   and name HA  ))
      3.000     1.100     1.100 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.22877E-02 ppm1      3.845 ppm2      4.474 CV     1
 ASSI { 1095}
   (( segid "    " and resid 78   and name HB1 ))
   (( segid "    " and resid 78   and name HA  ))
      3.000     1.100     1.100 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.15969E-02 ppm1      3.897 ppm2      4.471 CV     1
 ASSI { 1100}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      3.000     1.100     1.100 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.20016E-02 ppm1      4.475 ppm2      8.507 CV     1
 ASSI { 1119}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      2.700     0.900     0.900 peak  1119 spectrum    1 weight  0.10000E+01 volume  0.30063E-02 ppm1      4.114 ppm2      8.004 CV     1
 ASSI { 1120}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
      3.500     1.500     1.500 peak  1120 spectrum    1 weight  0.10000E+01 volume  0.16872E-02 ppm1      2.010 ppm2      8.004 CV     1
 ASSI { 1121}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 72   and name HN  ))
      2.700     0.900     0.900 peak  1121 spectrum    1 weight  0.10000E+01 volume  0.16893E-02 ppm1      1.913 ppm2      8.004 CV     1
 ASSI { 1122}
   (( segid "    " and resid 72   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      4.400     2.400     1.600 peak  1122 spectrum    1 weight  0.10000E+01 volume  0.53848E-03 ppm1      2.013 ppm2      7.732 CV     1
 ASSI { 1123}
   (( segid "    " and resid 72   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      4.000     2.000     2.000 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.47231E-03 ppm1      1.913 ppm2      7.728 CV     1
 ASSI { 1124}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      3.200     1.300     1.300 peak  1124 spectrum    1 weight  0.10000E+01 volume  0.10874E-02 ppm1      4.114 ppm2      7.734 CV     1
 ASSI { 1133}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HG2 ))
      3.100     1.200     1.200 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.18347E-02 ppm1      4.115 ppm2      2.494 CV     1
 ASSI { 1134}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB1 ))
      2.700     0.900     0.900 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.21841E-02 ppm1      4.114 ppm2      2.012 CV     1
 ASSI { 1135}
   (( segid "    " and resid 72   and name HA  ))
   (( segid "    " and resid 72   and name HB2 ))
      3.000     1.200     1.200 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.25236E-02 ppm1      4.116 ppm2      1.912 CV     1
 ASSI { 1140}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 72   and name HN  ))
      3.100     1.200     1.200 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.21690E-02 ppm1      2.618 ppm2      8.003 CV     1
 ASSI { 1141}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HN  ))
      2.800     1.000     1.000 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.16600E-02 ppm1      2.488 ppm2      8.002 CV     1
 ASSI { 1143}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 72   and name HA  ))
      3.500     1.600     1.600 peak  1143 spectrum    1 weight  0.10000E+01 volume  0.17160E-02 ppm1      2.617 ppm2      4.119 CV     1
 ASSI { 1145}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 69   and name HA  ))
      3.800     1.800     1.800 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.39703E-03 ppm1      2.617 ppm2      4.051 CV     1
 ASSI { 1146}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 69   and name HA  ))
      4.200     2.200     1.800 peak  1146 spectrum    1 weight  0.10000E+01 volume  0.22129E-03 ppm1      2.492 ppm2      4.051 CV     1
 ASSI { 1151}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 72   and name HB1 ))
      3.000     1.200     1.200 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.11444E-02 ppm1      2.618 ppm2      2.012 CV     1
 ASSI { 1152}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HB1 ))
      3.300     1.400     1.400 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.11615E-02 ppm1      2.489 ppm2      2.011 CV     1
 ASSI { 1153}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 72   and name HB2 ))
      3.100     1.200     1.200 peak  1153 spectrum    1 weight  0.10000E+01 volume  0.10724E-02 ppm1      2.618 ppm2      1.919 CV     1
 ASSI { 1154}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 72   and name HB2 ))
      3.000     1.100     1.100 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.12485E-02 ppm1      2.486 ppm2      1.914 CV     1
 ASSI { 1155}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 68   and name HB1 ))
      3.400     3.400     2.600 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.11752E-02 ppm1      2.618 ppm2      1.829 CV     1
 ASSI { 1156}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 68   and name HB1 ))
      3.400     1.400     1.400 peak  1156 spectrum    1 weight  0.10000E+01 volume  0.12270E-02 ppm1      2.487 ppm2      1.827 CV     1
 ASSI { 1159}
   (( segid "    " and resid 72   and name HG1 ))
   (  segid "    " and resid 69   and name HD2%)
      3.500     3.500     2.500 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.15498E-03 ppm1      2.617 ppm2      0.823 CV     1
 ASSI { 1160}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 69   and name HD2%)
      3.200     3.200     2.800 peak  1160 spectrum    1 weight  0.10000E+01 volume  0.27738E-03 ppm1      2.489 ppm2      0.822 CV     1
 ASSI { 1163}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
      2.700     0.900     0.900 peak  1163 spectrum    1 weight  0.10000E+01 volume  0.27155E-02 ppm1      4.040 ppm2      2.129 CV     1
 ASSI { 1164}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB1 ))
      3.400     1.400     1.400 peak  1164 spectrum    1 weight  0.10000E+01 volume  0.12193E-02 ppm1      4.037 ppm2      2.199 CV     1
 OR { 1164}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HG2 ))
 ASSI { 1165}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 44   and name HG2%)
      3.600     1.700     1.700 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.57963E-03 ppm1      2.191 ppm2      0.994 CV     1
 ASSI { 1166}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 44   and name HG2%)
      4.800     2.900     1.200 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.57687E-03 ppm1      2.113 ppm2      0.994 CV     1
 ASSI { 1167}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 39   and name HD2%)
      3.900     1.900     1.900 peak  1167 spectrum    1 weight  0.10000E+01 volume  0.10881E-02 ppm1      2.186 ppm2      0.906 CV     1
 ASSI { 1168}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 39   and name HD2%)
      3.300     1.400     1.400 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.12876E-02 ppm1      2.110 ppm2      0.903 CV     1
 ASSI { 1169}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 47   and name HD1%)
      3.300     1.400     1.400 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.16371E-02 ppm1      2.187 ppm2      0.774 CV     1
 ASSI { 1172}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      3.000     1.200     1.200 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.18895E-02 ppm1      4.037 ppm2      7.986 CV     1
 ASSI { 1183}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.900     1.900     1.900 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.12357E-02 ppm1      4.034 ppm2      1.148 CV     1
 ASSI { 1185}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HA  ))
      2.700     0.900     0.900 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.30009E-02 ppm1      1.951 ppm2      4.037 CV     1
 ASSI { 1186}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HA  ))
      2.400     0.700     0.700 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.30282E-02 ppm1      1.299 ppm2      4.036 CV     1
 ASSI { 1187}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      2.500     0.800     0.800 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.83143E-03 ppm1      1.951 ppm2      8.922 CV     1
 ASSI { 1188}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HN  ))
      3.400     1.400     1.400 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.11717E-02 ppm1      1.951 ppm2      8.808 CV     1
 ASSI { 1190}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      3.800     1.800     1.800 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.60836E-03 ppm1      4.037 ppm2      8.923 CV     1
 ASSI { 1191}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      3.200     1.200     1.200 peak  1191 spectrum    1 weight  0.10000E+01 volume  0.68989E-03 ppm1      4.037 ppm2      8.808 CV     1
 ASSI { 1192}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HN  ))
      3.400     1.400     1.400 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.66274E-03 ppm1      1.299 ppm2      8.807 CV     1
 ASSI { 1193}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 67   and name HN  ))
      4.600     2.600     1.400 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.52465E-03 ppm1      1.299 ppm2      8.920 CV     1
 ASSI { 1194}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HG  ))
      2.700     0.900     0.900 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.14458E-02 ppm1      1.298 ppm2      1.754 CV     1
 ASSI { 1195}
   (( segid "    " and resid 66   and name HB1 ))
   (( segid "    " and resid 66   and name HG  ))
      2.600     0.900     0.900 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.16121E-02 ppm1      1.953 ppm2      1.756 CV     1
 ASSI { 1205}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 66   and name HD2%)
      2.400     0.700     0.700 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.46517E-02 ppm1      1.298 ppm2      0.711 CV     1
 ASSI { 1206}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 66   and name HD2%)
      3.000     1.200     1.200 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.30501E-02 ppm1      1.953 ppm2      0.716 CV     1
 ASSI { 1210}
   (( segid "    " and resid 66   and name HG  ))
   (( segid "    " and resid 66   and name HN  ))
      4.900     3.000     1.100 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.43344E-03 ppm1      1.748 ppm2      8.804 CV     1
 ASSI { 1211}
   (( segid "    " and resid 66   and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
      4.400     2.500     1.600 peak  1211 spectrum    1 weight  0.10000E+01 volume  0.49901E-03 ppm1      1.294 ppm2      0.951 CV     1
 ASSI { 1212}
   (( segid "    " and resid 66   and name HB1 ))
   (  segid "    " and resid 65   and name HG2%)
      4.400     2.500     1.600 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.59889E-03 ppm1      1.964 ppm2      0.957 CV     1
 ASSI { 1213}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 66   and name HA  ))
      2.200     0.600     0.600 peak  1213 spectrum    1 weight  0.10000E+01 volume  0.79565E-02 ppm1      0.682 ppm2      4.035 CV     1
 ASSI { 1214}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 67   and name HD1 ))
      2.900     1.100     1.100 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.16116E-02 ppm1      0.679 ppm2      3.322 CV     1
 ASSI { 1215}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 66   and name HG  ))
      2.200     0.600     0.600 peak  1215 spectrum    1 weight  0.10000E+01 volume  0.53755E-02 ppm1      0.681 ppm2      1.752 CV     1
 ASSI { 1216}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 66   and name HB1 ))
      2.500     0.800     0.800 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.26543E-02 ppm1      0.683 ppm2      1.970 CV     1
 ASSI { 1220}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
      3.800     1.800     1.800 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.64412E-03 ppm1      0.678 ppm2      7.915 CV     1
 ASSI { 1221}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 66   and name HN  ))
      3.800     1.800     1.800 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.16374E-02 ppm1      0.681 ppm2      8.813 CV     1
 ASSI { 1223}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      3.000     1.100     1.100 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.26597E-02 ppm1      4.036 ppm2      7.918 CV     1
 ASSI { 1224}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 66   and name HA  ))
      2.600     0.800     0.800 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.26496E-02 ppm1      0.729 ppm2      4.038 CV     1
 ASSI { 1225}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 67   and name HN  ))
      5.200     3.400     0.800 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.36176E-03 ppm1      0.731 ppm2      8.918 CV     1
 ASSI { 1226}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 66   and name HN  ))
      4.700     2.800     1.300 peak  1226 spectrum    1 weight  0.10000E+01 volume  0.49340E-03 ppm1      0.730 ppm2      8.813 CV     1
 ASSI { 1233}
   (( segid "    " and resid 66   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      4.500     2.500     1.500 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.66859E-03 ppm1      4.038 ppm2      2.035 CV     1
 ASSI { 1235}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB2 ))
      2.400     0.700     0.700 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.39205E-02 ppm1      3.799 ppm2      1.594 CV     1
 OR { 1235}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HB1 ))
 ASSI { 1236}
   (( segid "    " and resid 11   and name HA  ))
   (  segid "    " and resid 10   and name HG1%)
      3.100     1.200     1.200 peak  1236 spectrum    1 weight  0.10000E+01 volume  0.15774E-02 ppm1      3.795 ppm2      0.856 CV     1
 ASSI { 1237}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.700     1.700     1.700 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.18081E-02 ppm1      3.800 ppm2      2.242 CV     1
 OR { 1237}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 1238}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HD1 ))
      2.800     1.000     1.000 peak  1238 spectrum    1 weight  0.10000E+01 volume  0.59127E-03 ppm1      3.797 ppm2      3.319 CV     1
 ASSI { 1239}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 68   and name HA  ))
      3.700     1.700     1.700 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.54211E-03 ppm1      3.801 ppm2      4.051 CV     1
 ASSI { 1240}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      3.200     1.300     1.300 peak  1240 spectrum    1 weight  0.10000E+01 volume  0.89843E-03 ppm1      3.799 ppm2      8.322 CV     1
 ASSI { 1242}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      2.600     0.800     0.800 peak  1242 spectrum    1 weight  0.10000E+01 volume  0.18878E-02 ppm1      3.799 ppm2      8.926 CV     1
 ASSI { 1244}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 70   and name HG1 ))
      4.100     2.100     1.900 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.42063E-03 ppm1      3.800 ppm2      2.434 CV     1
 ASSI { 1245}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 66   and name HB2 ))
      5.500     3.800     0.500 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.62318E-03 ppm1      1.578 ppm2      1.302 CV     1
 OR { 1245}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 66   and name HB2 ))
 ASSI { 1246}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HD1 ))
      4.300     2.300     1.700 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.30198E-03 ppm1      1.580 ppm2      3.326 CV     1
 OR { 1246}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 67   and name HD1 ))
 ASSI { 1247}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 67   and name HD2 ))
      4.100     2.100     1.900 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.20305E-03 ppm1      1.584 ppm2      3.001 CV     1
 OR { 1247}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 67   and name HD2 ))
 ASSI { 1248}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
      4.000     2.000     2.000 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.67000E-03 ppm1      1.587 ppm2      7.910 CV     1
 OR { 1248}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 1249}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HG1 ))
      3.400     3.400     2.600 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.22233E-02 ppm1      1.590 ppm2      1.481 CV     1
 OR { 1249}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 68   and name HG1 ))
 OR { 1249}
   (( segid "    " and resid 67   and name HB2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR { 1249}
   (( segid "    " and resid 67   and name HB1 ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI { 1252}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HB2 ))
      4.700     2.800     1.300 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.75902E-03 ppm1      3.803 ppm2      1.302 CV     1
 ASSI { 1253}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 66   and name HG  ))
      2.000     2.000     4.000 peak  1253 spectrum    1 weight  0.10000E+01 volume  0.41979E-02 ppm1      3.794 ppm2      1.731 CV     1
 ASSI { 1256}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 67   and name HE  ))
      2.900     1.000     1.000 peak  1256 spectrum    1 weight  0.10000E+01 volume  0.60327E-03 ppm1      3.322 ppm2      8.672 CV     1
 ASSI { 1257}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HE  ))
      3.200     1.300     1.300 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.56772E-03 ppm1      2.998 ppm2      8.675 CV     1
 ASSI { 1258}
   (( segid "    " and resid 67   and name HD1 ))
   (( segid "    " and resid 69   and name HN  ))
      4.600     2.600     1.400 peak  1258 spectrum    1 weight  0.10000E+01 volume  0.36065E-03 ppm1      3.322 ppm2      7.908 CV     1
 ASSI { 1259}
   (( segid "    " and resid 67   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      3.400     1.500     1.500 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.45039E-03 ppm1      3.796 ppm2      7.914 CV     1
 ASSI { 1275}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      2.200     0.600     0.600 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.40483E-02 ppm1      1.845 ppm2      6.391 CV     1
 OR { 1275}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 1278}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 69   and name HN  ))
      2.400     0.700     0.700 peak  1278 spectrum    1 weight  0.10000E+01 volume  0.55821E-02 ppm1      1.845 ppm2      7.913 CV     1
 OR { 1278}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 1280}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HA  ))
      3.200     1.300     1.300 peak  1280 spectrum    1 weight  0.10000E+01 volume  0.12892E-02 ppm1      1.844 ppm2      4.176 CV     1
 OR { 1280}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1281}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HA  ))
      2.200     0.600     0.600 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.59127E-02 ppm1      1.845 ppm2      4.050 CV     1
 OR { 1281}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 1285}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      4.600     2.600     1.400 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.68737E-03 ppm1      1.842 ppm2      1.122 CV     1
 OR { 1285}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HB2 ))
 ASSI { 1287}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 64   and name HD1%)
      3.400     1.400     1.400 peak  1287 spectrum    1 weight  0.10000E+01 volume  0.36493E-02 ppm1      1.845 ppm2      0.796 CV     1
 OR { 1287}
   (( segid "    " and resid 68   and name HB2 ))
   (  segid "    " and resid 64   and name HD1%)
 ASSI { 1292}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HE2 ))
      4.000     2.000     2.000 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.15170E-02 ppm1      4.057 ppm2      2.920 CV     1
 OR { 1292}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HE1 ))
 ASSI { 1294}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 72   and name HG2 ))
      3.800     1.800     1.800 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.11213E-02 ppm1      4.052 ppm2      2.511 CV     1
 ASSI { 1296}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 68   and name HB2 ))
      2.100     0.600     0.600 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.74385E-02 ppm1      1.505 ppm2      1.842 CV     1
 OR { 1296}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HB1 ))
 OR { 1296}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 68   and name HB1 ))
 OR { 1296}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 1297}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HD1 ))
      1.800     0.400     0.400 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.20665E-01 ppm1      1.504 ppm2      1.698 CV     1
 OR { 1297}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR { 1297}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR { 1297}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 68   and name HD1 ))
 ASSI { 1299}
   (( segid "    " and resid 68   and name HG1 ))
   (  segid "    " and resid 65   and name HG2%)
      4.300     2.300     1.700 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.75392E-03 ppm1      1.501 ppm2      0.966 CV     1
 OR { 1299}
   (( segid "    " and resid 68   and name HG2 ))
   (  segid "    " and resid 65   and name HG2%)
 ASSI { 1302}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 68   and name HA  ))
      2.600     0.800     0.800 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.31332E-02 ppm1      1.505 ppm2      4.049 CV     1
 OR { 1302}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 1303}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 64   and name HA  ))
      4.400     2.400     1.600 peak  1303 spectrum    1 weight  0.10000E+01 volume  0.57453E-03 ppm1      1.502 ppm2      4.171 CV     1
 OR { 1303}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 1305}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 65   and name HN  ))
      4.400     2.400     1.600 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.85128E-03 ppm1      1.505 ppm2      6.391 CV     1
 OR { 1305}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 1306}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 69   and name HN  ))
      3.100     1.200     1.200 peak  1306 spectrum    1 weight  0.10000E+01 volume  0.23254E-02 ppm1      1.505 ppm2      7.912 CV     1
 OR { 1306}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 1308}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HA  ))
      3.800     1.800     1.800 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.12890E-02 ppm1      3.178 ppm2      4.092 CV     1
 OR { 1308}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1309}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HE  ))
      3.700     1.700     1.700 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.42459E-03 ppm1      3.178 ppm2      7.356 CV     1
 OR { 1309}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HE  ))
 ASSI { 1312}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     3.000     3.000 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.36826E-03 ppm1      3.181 ppm2      8.484 CV     1
 OR { 1312}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1315}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      2.700     0.900     0.900 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.33875E-02 ppm1      4.094 ppm2      1.968 CV     1
 ASSI { 1316}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG2 ))
      3.100     1.200     1.200 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.20821E-02 ppm1      4.094 ppm2      1.609 CV     1
 ASSI { 1317}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 51   and name HG2 ))
      3.100     3.100     2.900 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.35138E-03 ppm1      3.173 ppm2      2.230 CV     1
 OR { 1317}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 51   and name HG2 ))
 OR { 1317}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 51   and name HG1 ))
 ASSI { 1318}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HG1 ))
      2.500     0.800     0.800 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.36098E-02 ppm1      3.175 ppm2      1.780 CV     1
 OR { 1318}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 1319}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG1 ))
      3.000     1.100     1.100 peak  1319 spectrum    1 weight  0.10000E+01 volume  0.14252E-02 ppm1      4.089 ppm2      1.782 CV     1
 ASSI { 1323}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      3.000     1.100     1.100 peak  1323 spectrum    1 weight  0.10000E+01 volume  0.14550E-02 ppm1      1.875 ppm2      4.097 CV     1
 ASSI { 1325}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HD2 ))
      3.100     1.200     1.200 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.11439E-02 ppm1      1.873 ppm2      3.173 CV     1
 OR { 1325}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HD1 ))
 ASSI { 1333}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
      3.700     1.700     1.700 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.49583E-03 ppm1      1.946 ppm2      8.552 CV     1
 ASSI { 1334}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      4.500     2.500     1.500 peak  1334 spectrum    1 weight  0.10000E+01 volume  0.36176E-03 ppm1      1.881 ppm2      8.555 CV     1
 ASSI { 1337}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 46   and name HE21))
      4.500     2.600     1.500 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.15518E-03 ppm1      2.391 ppm2      6.840 CV     1
 ASSI { 1338}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 46   and name HE21))
      4.000     2.000     2.000 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.22337E-03 ppm1      2.577 ppm2      6.848 CV     1
 ASSI { 1339}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 54   and name HN  ))
      4.200     2.200     1.800 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.68485E-03 ppm1      2.089 ppm2      7.630 CV     1
 OR { 1339}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
 ASSI { 1340}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HN  ))
      2.400     0.700     0.700 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.42252E-02 ppm1      2.086 ppm2      7.929 CV     1
 OR { 1340}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HN  ))
 ASSI { 1341}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.000     1.100     1.100 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.24683E-02 ppm1      2.085 ppm2      8.486 CV     1
 OR { 1341}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 50   and name HN  ))
 ASSI { 1342}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 50   and name HN  ))
      3.500     1.500     1.500 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.58275E-03 ppm1      3.833 ppm2      8.491 CV     1
 ASSI { 1344}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 49   and name HA  ))
      2.700     0.900     0.900 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.25853E-02 ppm1      2.088 ppm2      3.837 CV     1
 OR { 1344}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
 ASSI { 1346}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 46   and name HN  ))
      3.000     3.000     3.000 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.37561E-03 ppm1      2.091 ppm2      8.101 CV     1
 OR { 1346}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 46   and name HN  ))
 ASSI { 1347}
   (( segid "    " and resid 49   and name HB1 ))
   (  segid "    " and resid 55   and name HG2%)
      3.800     1.800     1.800 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.19533E-02 ppm1      2.091 ppm2      0.796 CV     1
 OR { 1347}
   (( segid "    " and resid 49   and name HB2 ))
   (  segid "    " and resid 55   and name HG2%)
 ASSI { 1349}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HD1 ))
      4.200     2.200     1.800 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.45609E-03 ppm1      2.093 ppm2      3.159 CV     1
 OR { 1349}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR { 1349}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 50   and name HD1 ))
 OR { 1349}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 1351}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 54   and name HN  ))
      2.500     0.800     0.800 peak  1351 spectrum    1 weight  0.10000E+01 volume  0.35828E-02 ppm1      3.833 ppm2      7.633 CV     1
 ASSI { 1352}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      3.500     1.600     1.600 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.49652E-03 ppm1      3.837 ppm2      4.499 CV     1
 ASSI { 1353}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 46   and name HA  ))
      4.600     2.700     1.400 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.35405E-03 ppm1      3.832 ppm2      4.250 CV     1
 ASSI { 1354}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 48   and name HA  ))
      3.900     1.900     1.900 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.46697E-03 ppm1      3.836 ppm2      3.975 CV     1
 ASSI { 1357}
   (( segid "    " and resid 49   and name HG2 ))
   (  segid "    " and resid 55   and name HG2%)
      4.600     2.600     1.400 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.97522E-03 ppm1      2.072 ppm2      0.803 CV     1
 ASSI { 1362}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 49   and name HN  ))
      2.800     1.000     1.000 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.18855E-02 ppm1      3.831 ppm2      7.927 CV     1
 ASSI { 1368}
   (( segid "    " and resid 49   and name HG1 ))
   (( segid "    " and resid 49   and name HA  ))
      2.800     1.000     1.000 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.16552E-02 ppm1      2.174 ppm2      3.837 CV     1
 ASSI { 1369}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 49   and name HA  ))
      3.200     1.300     1.300 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.17737E-02 ppm1      2.064 ppm2      3.839 CV     1
 ASSI { 1370}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 46   and name HA  ))
      4.100     2.100     1.900 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.50318E-03 ppm1      2.073 ppm2      4.239 CV     1
 ASSI { 1371}
   (( segid "    " and resid 49   and name HG1 ))
   (( segid "    " and resid 49   and name HN  ))
      4.100     2.100     1.900 peak  1371 spectrum    1 weight  0.10000E+01 volume  0.11649E-02 ppm1      2.175 ppm2      7.932 CV     1
 ASSI { 1372}
   (( segid "    " and resid 49   and name HG1 ))
   (( segid "    " and resid 50   and name HN  ))
      4.300     2.300     1.700 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.64898E-03 ppm1      2.179 ppm2      8.486 CV     1
 ASSI { 1373}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 49   and name HN  ))
      4.500     2.500     1.500 peak  1373 spectrum    1 weight  0.10000E+01 volume  0.67057E-03 ppm1      2.072 ppm2      7.930 CV     1
 ASSI { 1374}
   (( segid "    " and resid 49   and name HG2 ))
   (( segid "    " and resid 50   and name HN  ))
      4.100     2.100     1.900 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.46358E-03 ppm1      2.070 ppm2      8.486 CV     1
 ASSI { 1375}
   (( segid "    " and resid 43   and name HA  ))
   (  segid "    " and resid 39   and name HD2%)
      3.900     1.900     1.900 peak  1375 spectrum    1 weight  0.10000E+01 volume  0.12574E-02 ppm1      4.090 ppm2      0.940 CV     1
 ASSI { 1376}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 46   and name HG1 ))
      3.700     1.700     1.700 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.48581E-03 ppm1      4.094 ppm2      2.584 CV     1
 ASSI { 1377}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG1 ))
      2.700     0.900     0.900 peak  1377 spectrum    1 weight  0.10000E+01 volume  0.23823E-02 ppm1      4.090 ppm2      2.393 CV     1
 ASSI { 1378}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG2 ))
      3.300     1.300     1.300 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.23544E-02 ppm1      4.089 ppm2      2.273 CV     1
 ASSI { 1379}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      3.000     1.100     1.100 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.24767E-02 ppm1      4.089 ppm2      2.198 CV     1
 ASSI { 1380}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
      2.200     0.600     0.600 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.56742E-02 ppm1      4.089 ppm2      2.116 CV     1
 ASSI { 1383}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HN  ))
      3.700     1.700     1.700 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.23724E-02 ppm1      2.392 ppm2      7.360 CV     1
 ASSI { 1385}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 44   and name HN  ))
      4.100     2.100     1.900 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.62132E-03 ppm1      2.392 ppm2      8.417 CV     1
 ASSI { 1387}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      3.200     1.300     1.300 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.11420E-02 ppm1      4.090 ppm2      8.108 CV     1
 ASSI { 1388}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      3.900     1.900     1.900 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.66046E-03 ppm1      4.088 ppm2      7.940 CV     1
 ASSI { 1389}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.600     0.800     0.800 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.30075E-02 ppm1      4.088 ppm2      7.358 CV     1
 ASSI { 1394}
   (( segid "    " and resid 43   and name HG1 ))
   (  segid "    " and resid 39   and name HD2%)
      2.700     2.700     3.300 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.73545E-03 ppm1      2.393 ppm2      0.920 CV     1
 ASSI { 1398}
   (( segid "    " and resid 43   and name HG1 ))
   (( segid "    " and resid 43   and name HB2 ))
      2.500     0.800     0.800 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.48290E-02 ppm1      2.392 ppm2      2.117 CV     1
 ASSI { 1399}
   (( segid "    " and resid 43   and name HG2 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.600     1.600     1.600 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.68773E-03 ppm1      2.260 ppm2      2.120 CV     1
 ASSI { 1403}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
      2.600     0.800     0.800 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.30009E-02 ppm1      2.184 ppm2      7.360 CV     1
 ASSI { 1404}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HN  ))
      2.300     0.700     0.700 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.35432E-02 ppm1      2.110 ppm2      7.361 CV     1
 ASSI { 1405}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 44   and name HN  ))
      2.800     1.000     1.000 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.13346E-02 ppm1      2.187 ppm2      8.415 CV     1
 ASSI { 1406}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HG1 ))
      2.700     0.900     0.900 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.35780E-02 ppm1      2.188 ppm2      2.395 CV     1
 ASSI { 1408}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 47   and name HD1%)
      3.700     1.700     1.700 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.19843E-02 ppm1      2.110 ppm2      0.777 CV     1
 ASSI { 1409}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
      3.700     1.700     1.700 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.12415E-02 ppm1      2.110 ppm2      8.416 CV     1
 ASSI { 1411}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.300     0.700     0.700 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.47063E-02 ppm1      3.959 ppm2      1.877 CV     1
 ASSI { 1412}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
      3.300     3.300     2.700 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.88035E-03 ppm1      3.962 ppm2      1.766 CV     1
 ASSI { 1413}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.000     1.100     1.100 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.23992E-02 ppm1      3.958 ppm2      1.662 CV     1
 ASSI { 1416}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      2.600     0.800     0.800 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.22282E-02 ppm1      3.960 ppm2      8.588 CV     1
 ASSI { 1417}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      3.700     1.700     1.700 peak  1417 spectrum    1 weight  0.10000E+01 volume  0.64358E-03 ppm1      3.958 ppm2      7.827 CV     1
 ASSI { 1418}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      3.300     1.300     1.300 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.81934E-03 ppm1      3.960 ppm2      7.165 CV     1
 ASSI { 1419}
   (( segid "    " and resid 59   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      3.200     1.200     1.200 peak  1419 spectrum    1 weight  0.10000E+01 volume  0.12151E-02 ppm1      3.959 ppm2      0.875 CV     1
 ASSI { 1421}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 62   and name HD2 ))
      3.600     3.600     2.400 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.63776E-03 ppm1      3.960 ppm2      3.060 CV     1
 ASSI { 1425}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HD1 ))
      2.700     0.900     0.900 peak  1425 spectrum    1 weight  0.10000E+01 volume  0.17329E-02 ppm1      1.663 ppm2      3.161 CV     1
 OR { 1425}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HD2 ))
 ASSI { 1428}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      3.300     1.300     1.300 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.63227E-03 ppm1      1.663 ppm2      7.163 CV     1
 ASSI { 1429}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HN  ))
      3.400     1.400     1.400 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.16077E-02 ppm1      1.878 ppm2      8.587 CV     1
 ASSI { 1430}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HN  ))
      2.700     0.900     0.900 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.13812E-02 ppm1      1.661 ppm2      8.589 CV     1
 ASSI { 1431}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.300     2.300     1.700 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.37726E-03 ppm1      1.881 ppm2      7.163 CV     1
 ASSI { 1432}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HN  ))
      2.600     0.900     0.900 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.36598E-03 ppm1      3.162 ppm2      8.589 CV     1
 OR { 1432}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HN  ))
 ASSI { 1433}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HA  ))
      3.500     1.500     1.500 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.14622E-02 ppm1      3.152 ppm2      3.958 CV     1
 OR { 1433}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HA  ))
 ASSI { 1434}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HE21))
      3.700     1.700     1.700 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.11037E-02 ppm1      4.374 ppm2      6.837 CV     1
 ASSI { 1435}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HE22))
      4.800     2.900     1.200 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.62624E-03 ppm1      4.378 ppm2      7.389 CV     1
 ASSI { 1437}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 30   and name HB1 ))
      2.900     1.000     1.000 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.15171E-02 ppm1      4.376 ppm2      4.487 CV     1
 ASSI { 1438}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 30   and name HB2 ))
      3.300     1.400     1.400 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.12819E-02 ppm1      4.377 ppm2      3.980 CV     1
 ASSI { 1439}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HG1 ))
      3.100     1.200     1.200 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.99888E-03 ppm1      4.377 ppm2      2.544 CV     1
 ASSI { 1441}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 63   and name HG2 ))
      3.900     1.900     1.900 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.14001E-02 ppm1      4.377 ppm2      2.408 CV     1
 ASSI { 1444}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HA  ))
      2.600     0.800     0.800 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.26655E-02 ppm1      2.328 ppm2      4.374 CV     1
 ASSI { 1445}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      4.700     2.800     1.300 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.97201E-03 ppm1      2.329 ppm2      4.188 CV     1
 ASSI { 1446}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HA  ))
      3.100     1.200     1.200 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.18551E-02 ppm1      1.946 ppm2      4.371 CV     1
 ASSI { 1447}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 31   and name HN  ))
      3.900     1.900     1.900 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.28070E-03 ppm1      4.380 ppm2      8.576 CV     1
 ASSI { 1448}
   (( segid "    " and resid 63   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      3.900     1.900     1.900 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.40072E-03 ppm1      4.378 ppm2      8.471 CV     1
 ASSI { 1449}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HE21))
      2.100     0.500     0.500 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.30096E-02 ppm1      1.948 ppm2      6.841 CV     1
 ASSI { 1450}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HE21))
      3.300     1.400     1.400 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.19968E-02 ppm1      2.325 ppm2      6.838 CV     1
 ASSI { 1451}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HE22))
      5.400     3.600     0.600 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.65587E-03 ppm1      2.326 ppm2      7.392 CV     1
 ASSI { 1452}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HE22))
      4.300     2.300     1.700 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.86970E-03 ppm1      1.946 ppm2      7.393 CV     1
 ASSI { 1453}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HG1 ))
      2.400     0.700     0.700 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.57894E-02 ppm1      2.325 ppm2      2.546 CV     1
 ASSI { 1454}
   (( segid "    " and resid 63   and name HB2 ))
   (( segid "    " and resid 63   and name HG1 ))
      2.700     0.900     0.900 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.44949E-02 ppm1      1.947 ppm2      2.546 CV     1
 ASSI { 1455}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HG2 ))
      2.500     0.800     0.800 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.37438E-02 ppm1      2.325 ppm2      2.401 CV     1
 ASSI { 1459}
   (( segid "    " and resid 63   and name HG1 ))
   (( segid "    " and resid 63   and name HE21))
      3.200     1.300     1.300 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.18556E-02 ppm1      2.545 ppm2      6.837 CV     1
 ASSI { 1460}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HE21))
      2.900     1.000     1.000 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.19396E-02 ppm1      2.402 ppm2      6.837 CV     1
 ASSI { 1461}
   (( segid "    " and resid 63   and name HG1 ))
   (( segid "    " and resid 63   and name HE22))
      4.000     2.000     2.000 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.88239E-03 ppm1      2.541 ppm2      7.391 CV     1
 ASSI { 1462}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HE22))
      4.300     2.300     1.700 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.51637E-03 ppm1      2.403 ppm2      7.386 CV     1
 ASSI { 1466}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 60   and name HA  ))
      4.400     2.400     1.600 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.36970E-03 ppm1      2.405 ppm2      4.196 CV     1
 ASSI { 1468}
   (( segid "    " and resid 63   and name HG2 ))
   (( segid "    " and resid 63   and name HB2 ))
      2.400     0.700     0.700 peak  1468 spectrum    1 weight  0.10000E+01 volume  0.45600E-02 ppm1      2.404 ppm2      1.950 CV     1
 ASSI { 1478}
   (( segid "    " and resid 63   and name HG1 ))
   (( segid "    " and resid 60   and name HA  ))
      5.300     3.600     0.700 peak  1478 spectrum    1 weight  0.10000E+01 volume  0.26792E-03 ppm1      2.542 ppm2      4.196 CV     1
 ASSI { 1479}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      2.400     0.700     0.700 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.34127E-02 ppm1      3.897 ppm2      8.322 CV     1
 ASSI { 1480}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      3.200     1.200     1.200 peak  1480 spectrum    1 weight  0.10000E+01 volume  0.15927E-02 ppm1      3.896 ppm2      7.985 CV     1
 ASSI { 1481}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      4.200     2.200     1.800 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.67984E-03 ppm1      3.895 ppm2      7.905 CV     1
 ASSI { 1482}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      3.500     1.500     1.500 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.68449E-03 ppm1      3.894 ppm2      7.732 CV     1
 ASSI { 1486}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HG1 ))
      3.200     1.200     1.200 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.23500E-02 ppm1      3.896 ppm2      2.434 CV     1
 ASSI { 1487}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      2.200     0.600     0.600 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.71106E-02 ppm1      3.897 ppm2      2.238 CV     1
 OR { 1487}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 1488}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 71   and name HB2 ))
      4.500     2.600     1.500 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.44886E-03 ppm1      3.895 ppm2      2.135 CV     1
 ASSI { 1489}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 10   and name HG2%)
      2.700     0.900     0.900 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.45114E-02 ppm1      3.896 ppm2      0.940 CV     1
 ASSI { 1493}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HG1 ))
      2.300     0.700     0.700 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.62186E-02 ppm1      2.238 ppm2      2.438 CV     1
 OR { 1493}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HG1 ))
 ASSI { 1498}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.800     1.800     1.800 peak  1498 spectrum    1 weight  0.10000E+01 volume  0.67717E-03 ppm1      2.235 ppm2      4.043 CV     1
 OR { 1498}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI { 1499}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 72   and name HN  ))
      3.600     1.600     1.600 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.20841E-02 ppm1      2.234 ppm2      7.985 CV     1
 OR { 1499}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 72   and name HN  ))
 ASSI { 1500}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
      2.700     0.900     0.900 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.36703E-02 ppm1      2.238 ppm2      8.321 CV     1
 OR { 1500}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
 ASSI { 1504}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HA  ))
      3.400     1.400     1.400 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.14693E-02 ppm1      2.298 ppm2      3.899 CV     1
 ASSI { 1506}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 67   and name HA  ))
      3.400     1.400     1.400 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.42120E-03 ppm1      2.301 ppm2      3.799 CV     1
 ASSI { 1507}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HE21))
      3.700     1.700     1.700 peak  1507 spectrum    1 weight  0.10000E+01 volume  0.55513E-03 ppm1      2.300 ppm2      6.602 CV     1
 ASSI { 1508}
   (( segid "    " and resid 70   and name HG1 ))
   (( segid "    " and resid 70   and name HN  ))
      2.900     1.000     1.000 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.16602E-02 ppm1      2.433 ppm2      8.322 CV     1
 ASSI { 1509}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HE22))
      4.300     2.300     1.700 peak  1509 spectrum    1 weight  0.10000E+01 volume  0.71100E-03 ppm1      2.298 ppm2      7.339 CV     1
 ASSI { 1510}
   (( segid "    " and resid 70   and name HG1 ))
   (( segid "    " and resid 70   and name HE22))
      4.400     2.400     1.600 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.57399E-03 ppm1      2.435 ppm2      7.339 CV     1
 ASSI { 1511}
   (( segid "    " and resid 70   and name HG1 ))
   (( segid "    " and resid 70   and name HE21))
      3.100     1.200     1.200 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.38953E-03 ppm1      2.436 ppm2      6.601 CV     1
 ASSI { 1513}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 70   and name HN  ))
      2.700     0.900     0.900 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.95443E-03 ppm1      2.299 ppm2      8.321 CV     1
 ASSI { 1514}
   (( segid "    " and resid 70   and name HG2 ))
   (( segid "    " and resid 72   and name HN  ))
      4.800     2.900     1.200 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.55929E-03 ppm1      2.299 ppm2      7.986 CV     1
 ASSI { 1515}
   (( segid "    " and resid 70   and name HG1 ))
   (( segid "    " and resid 72   and name HN  ))
      4.500     2.600     1.500 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.46082E-03 ppm1      2.435 ppm2      7.986 CV     1
 ASSI { 1516}
   (( segid "    " and resid 70   and name HG2 ))
   (  segid "    " and resid 10   and name HG2%)
      2.800     1.000     1.000 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.84900E-03 ppm1      2.299 ppm2      0.941 CV     1
 ASSI { 1531}
   (( segid "    " and resid 87   and name HB1 ))
   (( segid "    " and resid 87   and name HA  ))
      3.500     1.600     1.600 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.65225E-03 ppm1      3.834 ppm2      4.373 CV     1
 OR { 1531}
   (( segid "    " and resid 87   and name HB2 ))
   (( segid "    " and resid 87   and name HA  ))
 ASSI { 1534}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HN  ))
      4.200     2.200     1.800 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.24400E-03 ppm1      4.333 ppm2      8.143 CV     1
 ASSI { 1535}
   (  segid "    " and resid 84   and name HB% )
   (( segid "    " and resid 84   and name HN  ))
      3.000     1.100     1.100 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.18972E-02 ppm1      1.316 ppm2      8.077 CV     1
 ASSI { 1536}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      3.400     1.400     1.400 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.79301E-03 ppm1      4.538 ppm2      8.071 CV     1
 ASSI { 1537}
   (  segid "    " and resid 84   and name HB% )
   (( segid "    " and resid 85   and name HD1 ))
      4.700     2.800     1.300 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.47579E-03 ppm1      1.316 ppm2      3.758 CV     1
 ASSI { 1538}
   (  segid "    " and resid 84   and name HB% )
   (( segid "    " and resid 85   and name HD2 ))
      3.100     1.200     1.200 peak  1538 spectrum    1 weight  0.10000E+01 volume  0.12071E-02 ppm1      1.315 ppm2      3.595 CV     1
 ASSI { 1539}
   (  segid "    " and resid 84   and name HB% )
   (( segid "    " and resid 84   and name HA  ))
      2.300     0.700     0.700 peak  1539 spectrum    1 weight  0.10000E+01 volume  0.63362E-02 ppm1      1.317 ppm2      4.539 CV     1
 ASSI { 1540}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HD1 ))
      2.100     0.600     0.600 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.52987E-02 ppm1      4.540 ppm2      3.760 CV     1
 ASSI { 1541}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 85   and name HD2 ))
      2.700     0.900     0.900 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.41121E-02 ppm1      4.537 ppm2      3.597 CV     1
 ASSI { 1552}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      2.600     0.900     0.900 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.35609E-02 ppm1      4.265 ppm2      8.078 CV     1
 ASSI { 1555}
   (  segid "    " and resid 83   and name HB% )
   (( segid "    " and resid 83   and name HA  ))
      2.600     0.900     0.900 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.38956E-02 ppm1      1.339 ppm2      4.251 CV     1
 ASSI { 1557}
   (  segid "    " and resid 83   and name HB% )
   (( segid "    " and resid 83   and name HN  ))
      3.100     1.200     1.200 peak  1557 spectrum    1 weight  0.10000E+01 volume  0.16470E-02 ppm1      1.331 ppm2      8.091 CV     1
 ASSI { 1560}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      2.800     1.000     1.000 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.25064E-02 ppm1      4.257 ppm2      8.098 CV     1
 ASSI { 1562}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 82   and name HD1%)
      3.400     1.400     1.400 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.12289E-02 ppm1      4.261 ppm2      0.840 CV     1
 ASSI { 1563}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.200     1.300     1.300 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.10213E-02 ppm1      4.259 ppm2      1.548 CV     1
 ASSI { 1565}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HN  ))
      3.500     1.500     1.500 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.87795E-03 ppm1      1.602 ppm2      8.113 CV     1
 ASSI { 1566}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HN  ))
      3.400     1.400     1.400 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.88995E-03 ppm1      1.547 ppm2      8.112 CV     1
 ASSI { 1567}
   (( segid "    " and resid 82   and name HB1 ))
   (( segid "    " and resid 82   and name HA  ))
      3.600     1.600     1.600 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.57285E-03 ppm1      1.608 ppm2      4.258 CV     1
 ASSI { 1572}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 6    and name HG1 ))
      2.700     0.900     0.900 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.30063E-02 ppm1      4.251 ppm2      2.321 CV     1
 ASSI { 1581}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 52   and name HA  ))
      2.700     0.900     0.900 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.26933E-02 ppm1      3.418 ppm2      4.704 CV     1
 ASSI { 1582}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      3.700     1.800     1.800 peak  1582 spectrum    1 weight  0.10000E+01 volume  0.74769E-03 ppm1      3.041 ppm2      7.632 CV     1
 ASSI { 1583}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HN  ))
      2.900     1.000     1.000 peak  1583 spectrum    1 weight  0.10000E+01 volume  0.96052E-03 ppm1      3.043 ppm2      7.137 CV     1
 ASSI { 1584}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 6    and name HE21))
      2.900     2.900     3.100 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.51625E-03 ppm1      3.412 ppm2      6.783 CV     1
 ASSI { 1585}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 6    and name HE21))
      2.900     2.900     3.100 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.53728E-03 ppm1      3.046 ppm2      6.781 CV     1
 ASSI { 1586}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 52   and name HN  ))
      3.900     1.900     1.900 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.51427E-03 ppm1      3.419 ppm2      7.137 CV     1
 ASSI { 1587}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
      3.800     1.800     1.800 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.57507E-03 ppm1      3.415 ppm2      7.633 CV     1
 ASSI { 1588}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 52   and name HA  ))
      3.400     1.500     1.500 peak  1588 spectrum    1 weight  0.10000E+01 volume  0.85578E-03 ppm1      3.044 ppm2      4.707 CV     1
 ASSI { 1589}
   (( segid "    " and resid 52   and name HB1 ))
   (  segid "    " and resid 54   and name HD1%)
      3.300     1.300     1.300 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.71466E-03 ppm1      3.406 ppm2      0.843 CV     1
 OR { 1589}
   (( segid "    " and resid 52   and name HB1 ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 1593}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 54   and name HD1%)
      4.800     2.800     1.200 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.24825E-03 ppm1      3.044 ppm2      0.843 CV     1
 OR { 1593}
   (( segid "    " and resid 52   and name HB2 ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 1594}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 54   and name HB1 ))
      4.700     2.700     1.300 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.61004E-03 ppm1      3.417 ppm2      1.361 CV     1
 ASSI { 1596}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HG2 ))
      2.700     0.900     0.900 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.54070E-02 ppm1      4.348 ppm2      2.228 CV     1
 OR { 1596}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HG1 ))
 ASSI { 1598}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 6    and name HE21))
      3.400     1.400     1.400 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.98653E-03 ppm1      1.932 ppm2      6.784 CV     1
 ASSI { 1599}
   (( segid "    " and resid 51   and name HB1 ))
   (( segid "    " and resid 51   and name HN  ))
      3.700     1.700     1.700 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.16332E-02 ppm1      1.929 ppm2      8.553 CV     1
 ASSI { 1600}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 51   and name HN  ))
      2.700     0.900     0.900 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.14746E-02 ppm1      1.813 ppm2      8.556 CV     1
 ASSI { 1601}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      2.800     1.000     1.000 peak  1601 spectrum    1 weight  0.10000E+01 volume  0.22605E-02 ppm1      4.349 ppm2      8.553 CV     1
 ASSI { 1602}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.700     1.700     1.700 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.10962E-02 ppm1      4.350 ppm2      7.143 CV     1
 ASSI { 1604}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
      2.600     0.900     0.900 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.25254E-02 ppm1      4.350 ppm2      1.923 CV     1
 ASSI { 1605}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.900     1.100     1.100 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.29430E-02 ppm1      4.353 ppm2      1.809 CV     1
 ASSI { 1606}
   (( segid "    " and resid 51   and name HB2 ))
   (( segid "    " and resid 6    and name HE21))
      3.800     1.800     1.800 peak  1606 spectrum    1 weight  0.10000E+01 volume  0.78290E-03 ppm1      1.810 ppm2      6.785 CV     1
 ASSI { 1613}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 51   and name HB1 ))
      2.200     0.600     0.600 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.99318E-02 ppm1      2.220 ppm2      1.928 CV     1
 OR { 1613}
   (( segid "    " and resid 51   and name HG2 ))
   (( segid "    " and resid 51   and name HB1 ))
 ASSI { 1614}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 51   and name HB2 ))
      2.300     0.600     0.600 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.50369E-02 ppm1      2.231 ppm2      1.813 CV     1
 OR { 1614}
   (( segid "    " and resid 51   and name HG2 ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI { 1617}
   (( segid "    " and resid 51   and name HG2 ))
   (( segid "    " and resid 51   and name HN  ))
      2.900     1.100     1.100 peak  1617 spectrum    1 weight  0.10000E+01 volume  0.17683E-02 ppm1      2.229 ppm2      8.553 CV     1
 OR { 1617}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 51   and name HN  ))
 ASSI { 1619}
   (( segid "    " and resid 51   and name HG2 ))
   (( segid "    " and resid 50   and name HG2 ))
      3.900     1.900     1.900 peak  1619 spectrum    1 weight  0.10000E+01 volume  0.45135E-03 ppm1      2.229 ppm2      1.602 CV     1
 OR { 1619}
   (( segid "    " and resid 51   and name HG1 ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI { 1620}
   (( segid "    " and resid 51   and name HG1 ))
   (  segid "    " and resid 47   and name HG2%)
      3.200     1.200     1.200 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.12012E-02 ppm1      2.232 ppm2      0.866 CV     1
 OR { 1620}
   (( segid "    " and resid 51   and name HG2 ))
   (  segid "    " and resid 47   and name HG2%)
 ASSI { 1625}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HB  ))
      2.400     0.700     0.700 peak  1625 spectrum    1 weight  0.10000E+01 volume  0.43740E-02 ppm1      5.030 ppm2      4.667 CV     1
 ASSI { 1627}
   (( segid "    " and resid 65   and name HA  ))
   (  segid "    " and resid 31   and name HD1%)
      3.400     1.400     1.400 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.87168E-03 ppm1      5.027 ppm2      0.585 CV     1
 ASSI { 1628}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      3.100     1.200     1.200 peak  1628 spectrum    1 weight  0.10000E+01 volume  0.91496E-03 ppm1      5.031 ppm2      6.393 CV     1
 ASSI { 1630}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 66   and name HN  ))
      2.700     0.900     0.900 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.24032E-02 ppm1      5.030 ppm2      8.804 CV     1
 ASSI { 1631}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 68   and name HB2 ))
      3.500     1.500     1.500 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.13487E-02 ppm1      0.961 ppm2      1.851 CV     1
 OR { 1631}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1632}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 68   and name HD2 ))
      3.200     1.300     1.300 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.11030E-02 ppm1      0.961 ppm2      1.706 CV     1
 OR { 1632}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 68   and name HD1 ))
 ASSI { 1633}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 67   and name HB1 ))
      4.500     2.500     1.500 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.49532E-03 ppm1      0.961 ppm2      1.595 CV     1
 OR { 1633}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 67   and name HB2 ))
 ASSI { 1637}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 28   and name HB1 ))
      2.500     2.500     3.500 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.11569E-02 ppm1      0.961 ppm2      2.939 CV     1
 ASSI { 1639}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 30   and name HA  ))
      2.200     0.600     0.600 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.84963E-02 ppm1      0.962 ppm2      4.673 CV     1
 ASSI { 1642}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 64   and name HA  ))
      3.400     1.400     1.400 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.94270E-03 ppm1      0.960 ppm2      4.173 CV     1
 ASSI { 1643}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 65   and name HA  ))
      2.500     0.800     0.800 peak  1643 spectrum    1 weight  0.10000E+01 volume  0.52099E-02 ppm1      0.962 ppm2      5.032 CV     1
 ASSI { 1644}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 28   and name HA  ))
      2.700     0.900     0.900 peak  1644 spectrum    1 weight  0.10000E+01 volume  0.31724E-02 ppm1      0.962 ppm2      4.947 CV     1
 ASSI { 1646}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 65   and name HN  ))
      2.600     0.800     0.800 peak  1646 spectrum    1 weight  0.10000E+01 volume  0.30534E-02 ppm1      0.962 ppm2      6.391 CV     1
 ASSI { 1647}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 69   and name HN  ))
      4.200     2.200     1.800 peak  1647 spectrum    1 weight  0.10000E+01 volume  0.11357E-02 ppm1      0.962 ppm2      7.914 CV     1
 ASSI { 1648}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 30   and name HN  ))
      2.600     2.600     3.400 peak  1648 spectrum    1 weight  0.10000E+01 volume  0.89603E-03 ppm1      0.962 ppm2      9.195 CV     1
 ASSI { 1649}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 67   and name HN  ))
      3.900     1.900     1.900 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.10363E-02 ppm1      0.962 ppm2      8.924 CV     1
 ASSI { 1650}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 66   and name HN  ))
      3.700     1.700     1.700 peak  1650 spectrum    1 weight  0.10000E+01 volume  0.14262E-02 ppm1      0.961 ppm2      8.810 CV     1
 ASSI { 1651}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 31   and name HN  ))
      3.600     1.600     1.600 peak  1651 spectrum    1 weight  0.10000E+01 volume  0.12443E-02 ppm1      0.962 ppm2      8.569 CV     1
 ASSI { 1653}
   (( segid "    " and resid 65   and name HA  ))
   (( segid "    " and resid 67   and name HN  ))
      4.100     2.100     1.900 peak  1653 spectrum    1 weight  0.10000E+01 volume  0.49982E-03 ppm1      5.037 ppm2      8.920 CV     1
 ASSI { 1658}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
      3.200     1.300     1.300 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.81340E-03 ppm1      2.051 ppm2      8.269 CV     1
 ASSI { 1659}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
      3.500     1.500     1.500 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.82483E-03 ppm1      1.957 ppm2      8.270 CV     1
 ASSI { 1660}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HA  ))
      3.200     1.300     1.300 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.19960E-02 ppm1      2.052 ppm2      4.251 CV     1
 ASSI { 1661}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HA  ))
      2.600     0.900     0.900 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.25288E-02 ppm1      1.960 ppm2      4.251 CV     1
 ASSI { 1663}
   (( segid "    " and resid 6    and name HG1 ))
   (( segid "    " and resid 6    and name HA  ))
      2.800     1.000     1.000 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.30075E-02 ppm1      2.323 ppm2      4.251 CV     1
 OR { 1663}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 6    and name HA  ))
 ASSI { 1664}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 6    and name HE22))
      3.600     1.600     1.600 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.17070E-02 ppm1      2.323 ppm2      7.516 CV     1
 OR { 1664}
   (( segid "    " and resid 6    and name HG1 ))
   (( segid "    " and resid 6    and name HE22))
 ASSI { 1665}
   (( segid "    " and resid 6    and name HG2 ))
   (( segid "    " and resid 6    and name HE21))
      3.300     1.300     1.300 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.75851E-03 ppm1      2.324 ppm2      6.814 CV     1
 OR { 1665}
   (( segid "    " and resid 6    and name HG1 ))
   (( segid "    " and resid 6    and name HE21))
 ASSI { 1668}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      3.300     1.300     1.300 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.12666E-02 ppm1      1.838 ppm2      4.278 CV     1
 ASSI { 1670}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HB2 ))
      2.700     0.900     0.900 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.19561E-02 ppm1      4.279 ppm2      1.766 CV     1
 ASSI { 1679}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG2 ))
      3.100     1.200     1.200 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.21647E-02 ppm1      4.280 ppm2      1.601 CV     1
 OR { 1679}
   (( segid "    " and resid 7    and name HA  ))
   (( segid "    " and resid 7    and name HG1 ))
 ASSI { 1680}
   (( segid "    " and resid 62   and name HB2 ))
   (( segid "    " and resid 62   and name HN  ))
      3.000     1.100     1.100 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.46307E-03 ppm1      1.770 ppm2      7.826 CV     1
 ASSI { 1683}
   (( segid "    " and resid 7    and name HD2 ))
   (( segid "    " and resid 7    and name HA  ))
      4.200     2.200     1.800 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.12141E-02 ppm1      3.120 ppm2      4.277 CV     1
 OR { 1683}
   (( segid "    " and resid 7    and name HD1 ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 1687}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HD1 ))
      2.700     0.900     0.900 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.24564E-02 ppm1      1.602 ppm2      3.122 CV     1
 OR { 1687}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HD2 ))
 OR { 1687}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HD2 ))
 OR { 1687}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HD1 ))
 ASSI { 1688}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HN  ))
      4.600     2.700     1.400 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.21269E-03 ppm1      1.593 ppm2      8.417 CV     1
 OR { 1688}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HN  ))
 ASSI { 1689}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB2 ))
      2.600     0.900     0.900 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.29485E-02 ppm1      1.599 ppm2      1.771 CV     1
 OR { 1689}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HB2 ))
 ASSI { 1690}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 7    and name HB1 ))
      2.200     0.600     0.600 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.77498E-02 ppm1      1.603 ppm2      1.849 CV     1
 OR { 1690}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 7    and name HB1 ))
 ASSI { 1692}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
      2.900     1.100     1.100 peak  1692 spectrum    1 weight  0.10000E+01 volume  0.28321E-02 ppm1      2.637 ppm2      4.579 CV     1
 ASSI { 1693}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.300     1.400     1.400 peak  1693 spectrum    1 weight  0.10000E+01 volume  0.72372E-03 ppm1      2.763 ppm2      8.475 CV     1
 ASSI { 1694}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
      4.100     2.100     1.900 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.86280E-03 ppm1      2.638 ppm2      8.472 CV     1
 ASSI { 1695}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 8    and name HN  ))
      4.200     2.200     1.800 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.60875E-03 ppm1      2.759 ppm2      8.232 CV     1
 ASSI { 1696}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
      3.200     1.300     1.300 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.77804E-03 ppm1      2.636 ppm2      8.232 CV     1
 ASSI { 1697}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
      3.700     1.700     1.700 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.50294E-03 ppm1      2.760 ppm2      7.785 CV     1
 ASSI { 1698}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 11   and name HN  ))
      3.300     1.400     1.400 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.55815E-03 ppm1      2.637 ppm2      7.784 CV     1
 ASSI { 1699}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
      2.100     0.600     0.600 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.69787E-02 ppm1      4.572 ppm2      8.475 CV     1
 ASSI { 1700}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB1 ))
      2.500     0.800     0.800 peak  1700 spectrum    1 weight  0.10000E+01 volume  0.29355E-02 ppm1      4.577 ppm2      2.754 CV     1
 ASSI { 1706}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 11   and name HB1 ))
      3.900     1.900     1.900 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.16756E-02 ppm1      2.761 ppm2      1.732 CV     1
 OR { 1706}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1707}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 11   and name HB1 ))
      2.800     1.000     1.000 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.17818E-02 ppm1      2.635 ppm2      1.732 CV     1
 OR { 1707}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1709}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 11   and name HD1 ))
      4.300     2.300     1.700 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.41661E-03 ppm1      2.765 ppm2      1.626 CV     1
 OR { 1709}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 1710}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 11   and name HD1 ))
      3.700     1.700     1.700 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.44127E-03 ppm1      2.638 ppm2      1.626 CV     1
 OR { 1710}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 1711}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB1 ))
      2.400     0.700     0.700 peak  1711 spectrum    1 weight  0.10000E+01 volume  0.26349E-02 ppm1      4.020 ppm2      1.583 CV     1
 ASSI { 1712}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HB2 ))
      2.400     0.700     0.700 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.72051E-02 ppm1      4.021 ppm2      1.479 CV     1
 ASSI { 1713}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 9    and name HD1%)
      3.100     1.200     1.200 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.31125E-02 ppm1      4.024 ppm2      0.577 CV     1
 ASSI { 1714}
   (( segid "    " and resid 9    and name HA  ))
   (  segid "    " and resid 9    and name HD2%)
      2.700     0.900     0.900 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.27064E-02 ppm1      4.020 ppm2      0.702 CV     1
 ASSI { 1717}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
      2.700     0.900     0.900 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.21105E-02 ppm1      4.020 ppm2      8.473 CV     1
 ASSI { 1719}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      3.200     1.300     1.300 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.87852E-03 ppm1      4.020 ppm2      8.147 CV     1
 ASSI { 1724}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.300     1.400     1.400 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.19469E-02 ppm1      1.586 ppm2      8.474 CV     1
 ASSI { 1725}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
      2.400     0.700     0.700 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.19268E-02 ppm1      1.500 ppm2      8.473 CV     1
 ASSI { 1726}
   (( segid "    " and resid 9    and name HB1 ))
   (  segid "    " and resid 9    and name HD1%)
      2.700     0.900     0.900 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.20607E-02 ppm1      1.583 ppm2      0.577 CV     1
 ASSI { 1727}
   (( segid "    " and resid 9    and name HB1 ))
   (  segid "    " and resid 9    and name HD2%)
      2.900     1.000     1.000 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.15503E-02 ppm1      1.584 ppm2      0.704 CV     1
 ASSI { 1728}
   (( segid "    " and resid 9    and name HB2 ))
   (  segid "    " and resid 9    and name HD2%)
      3.200     1.300     1.300 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.17447E-02 ppm1      1.497 ppm2      0.705 CV     1
 ASSI { 1731}
   (( segid "    " and resid 9    and name HB2 ))
   (  segid "    " and resid 9    and name HD1%)
      3.000     1.100     1.100 peak  1731 spectrum    1 weight  0.10000E+01 volume  0.13373E-02 ppm1      1.497 ppm2      0.576 CV     1
 ASSI { 1761}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 10   and name HG1%)
      2.300     0.700     0.700 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.51211E-02 ppm1      3.320 ppm2      0.847 CV     1
 ASSI { 1762}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 13   and name HG1%)
      4.000     2.000     2.000 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.11378E-02 ppm1      3.322 ppm2      0.777 CV     1
 ASSI { 1763}
   (( segid "    " and resid 10   and name HA  ))
   (  segid "    " and resid 9    and name HD2%)
      3.900     1.900     1.900 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.14044E-02 ppm1      3.317 ppm2      0.683 CV     1
 ASSI { 1771}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.700     0.900     0.900 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.21471E-02 ppm1      3.320 ppm2      7.904 CV     1
 ASSI { 1773}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      3.200     1.200     1.200 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.63893E-03 ppm1      3.322 ppm2      8.819 CV     1
 ASSI { 1776}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      3.500     1.500     1.500 peak  1776 spectrum    1 weight  0.10000E+01 volume  0.69115E-03 ppm1      3.319 ppm2      7.786 CV     1
 ASSI { 1777}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 10   and name HN  ))
      2.400     0.700     0.700 peak  1777 spectrum    1 weight  0.10000E+01 volume  0.36484E-02 ppm1      2.138 ppm2      7.905 CV     1
 ASSI { 1779}
   (( segid "    " and resid 10   and name HB  ))
   (( segid "    " and resid 11   and name HN  ))
      2.500     0.800     0.800 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.23529E-02 ppm1      2.139 ppm2      7.785 CV     1
 ASSI { 1784}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 10   and name HB  ))
      2.100     0.500     0.500 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.84211E-02 ppm1      0.846 ppm2      2.140 CV     1
 ASSI { 1789}
   (  segid "    " and resid 10   and name HG1%)
   (  segid "    " and resid 14   and name HB% )
      2.700     0.900     0.900 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.19748E-02 ppm1      0.846 ppm2      1.426 CV     1
 ASSI { 1793}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 14   and name HN  ))
      3.800     1.800     1.800 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.66259E-03 ppm1      0.846 ppm2      8.817 CV     1
 ASSI { 1794}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 10   and name HN  ))
      3.600     1.700     1.700 peak  1794 spectrum    1 weight  0.10000E+01 volume  0.23284E-02 ppm1      0.846 ppm2      7.904 CV     1
 ASSI { 1796}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 11   and name HN  ))
      3.400     1.400     1.400 peak  1796 spectrum    1 weight  0.10000E+01 volume  0.16725E-02 ppm1      0.846 ppm2      7.784 CV     1
 ASSI { 1797}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HA  ))
      2.200     0.600     0.600 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.62003E-02 ppm1      0.938 ppm2      3.321 CV     1
 ASSI { 1799}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HG1 ))
      3.500     1.600     1.600 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.18175E-02 ppm1      0.938 ppm2      2.435 CV     1
 ASSI { 1801}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HB  ))
      2.100     0.500     0.500 peak  1801 spectrum    1 weight  0.10000E+01 volume  0.76757E-02 ppm1      0.939 ppm2      2.139 CV     1
 ASSI { 1802}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 68   and name HB1 ))
      4.200     2.300     1.800 peak  1802 spectrum    1 weight  0.10000E+01 volume  0.71817E-03 ppm1      0.940 ppm2      1.856 CV     1
 OR { 1802}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 1803}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 69   and name HB1 ))
      2.900     1.000     1.000 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.25407E-02 ppm1      0.939 ppm2      2.032 CV     1
 ASSI { 1806}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 9    and name HB1 ))
      4.500     2.500     1.500 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.57132E-03 ppm1      0.942 ppm2      1.583 CV     1
 ASSI { 1808}
   (  segid "    " and resid 10   and name HG2%)
   (  segid "    " and resid 9    and name HD1%)
      4.300     2.400     1.700 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.78632E-03 ppm1      0.941 ppm2      0.576 CV     1
 ASSI { 1809}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 10   and name HN  ))
      2.000     0.500     0.500 peak  1809 spectrum    1 weight  0.10000E+01 volume  0.74745E-02 ppm1      0.939 ppm2      7.905 CV     1
 ASSI { 1811}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
      4.000     2.000     2.000 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.11594E-02 ppm1      0.939 ppm2      7.785 CV     1
 ASSI { 1812}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HN  ))
      3.000     1.100     1.100 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.13285E-02 ppm1      0.939 ppm2      8.324 CV     1
 ASSI { 1813}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      3.600     1.600     1.600 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.24001E-02 ppm1      0.939 ppm2      4.038 CV     1
 ASSI { 1822}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 11   and name HA  ))
      4.700     2.800     1.300 peak  1822 spectrum    1 weight  0.10000E+01 volume  0.52102E-03 ppm1      0.940 ppm2      3.797 CV     1
 ASSI { 1825}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 9    and name HB2 ))
      3.500     1.600     1.600 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.74730E-03 ppm1      0.942 ppm2      1.477 CV     1
 ASSI { 1830}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HE2 ))
      5.300     3.500     0.700 peak  1830 spectrum    1 weight  0.10000E+01 volume  0.29075E-03 ppm1      1.730 ppm2      2.945 CV     1
 OR { 1830}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HE1 ))
 OR { 1830}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HE1 ))
 OR { 1830}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HE2 ))
 ASSI { 1832}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 47   and name HG12))
      2.200     0.600     0.600 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.70944E-02 ppm1      0.791 ppm2      1.108 CV     1
 ASSI { 1833}
   (  segid "    " and resid 47   and name HD1%)
   (  segid "    " and resid 12   and name HB% )
      2.400     0.700     0.700 peak  1833 spectrum    1 weight  0.10000E+01 volume  0.52990E-02 ppm1      0.790 ppm2      1.476 CV     1
 ASSI { 1835}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 47   and name HN  ))
      3.600     1.600     1.600 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.19224E-02 ppm1      0.791 ppm2      7.945 CV     1
 ASSI { 1836}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 48   and name HN  ))
      2.600     2.600     3.400 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.95716E-03 ppm1      0.790 ppm2      8.136 CV     1
 ASSI { 1837}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 44   and name HA  ))
      2.400     0.700     0.700 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.43206E-02 ppm1      0.787 ppm2      3.457 CV     1
 ASSI { 1838}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 47   and name HB  ))
      2.300     0.700     0.700 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.57756E-02 ppm1      0.790 ppm2      1.888 CV     1
 ASSI { 1839}
   (  segid "    " and resid 47   and name HD1%)
   (( segid "    " and resid 47   and name HG11))
      2.100     0.500     0.500 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.99417E-02 ppm1      0.787 ppm2      1.807 CV     1
 ASSI { 1840}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 48   and name HN  ))
      3.200     1.300     1.300 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.21708E-02 ppm1      0.873 ppm2      8.137 CV     1
 ASSI { 1841}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
      3.500     1.500     1.500 peak  1841 spectrum    1 weight  0.10000E+01 volume  0.24498E-02 ppm1      0.873 ppm2      7.947 CV     1
 ASSI { 1842}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 6    and name HE21))
      3.200     1.200     1.200 peak  1842 spectrum    1 weight  0.10000E+01 volume  0.19398E-02 ppm1      0.872 ppm2      6.779 CV     1
 ASSI { 1843}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 47   and name HG11))
      3.300     1.400     1.400 peak  1843 spectrum    1 weight  0.10000E+01 volume  0.35252E-02 ppm1      0.876 ppm2      1.810 CV     1
 ASSI { 1845}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 47   and name HG12))
      2.500     0.800     0.800 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.34736E-02 ppm1      0.873 ppm2      1.107 CV     1
 ASSI { 1846}
   (  segid "    " and resid 47   and name HG2%)
   (  segid "    " and resid 9    and name HD1%)
      3.000     1.100     1.100 peak  1846 spectrum    1 weight  0.10000E+01 volume  0.22912E-02 ppm1      0.873 ppm2      0.577 CV     1
 ASSI { 1847}
   (  segid "    " and resid 47   and name HG2%)
   (  segid "    " and resid 48   and name HD1%)
      2.500     0.800     0.800 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.65105E-02 ppm1      0.873 ppm2      0.698 CV     1
 ASSI { 1850}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 44   and name HA  ))
      4.400     2.400     1.600 peak  1850 spectrum    1 weight  0.10000E+01 volume  0.97651E-03 ppm1      0.875 ppm2      3.454 CV     1
 ASSI { 1851}
   (  segid "    " and resid 47   and name HG2%)
   (( segid "    " and resid 9    and name HB2 ))
      2.600     2.600     3.400 peak  1851 spectrum    1 weight  0.10000E+01 volume  0.92276E-03 ppm1      0.876 ppm2      1.475 CV     1
 ASSI { 1853}
   (( segid "    " and resid 16   and name HG11))
   (  segid "    " and resid 16   and name HD1%)
      2.300     0.700     0.700 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.48329E-02 ppm1      1.780 ppm2      0.773 CV     1
 ASSI { 1857}
   (( segid "    " and resid 16   and name HG11))
   (( segid "    " and resid 16   and name HA  ))
      3.400     1.400     1.400 peak  1857 spectrum    1 weight  0.10000E+01 volume  0.30489E-02 ppm1      1.777 ppm2      3.582 CV     1
 ASSI { 1860}
   (( segid "    " and resid 16   and name HG11))
   (( segid "    " and resid 16   and name HN  ))
      3.700     1.700     1.700 peak  1860 spectrum    1 weight  0.10000E+01 volume  0.25938E-02 ppm1      1.778 ppm2      7.598 CV     1
 ASSI { 1861}
   (( segid "    " and resid 9    and name HA  ))
   (( segid "    " and resid 8    and name HA  ))
      4.400     2.400     1.600 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.46238E-03 ppm1      4.016 ppm2      4.577 CV     1
 ASSI { 1862}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 8    and name HA  ))
      5.700     4.000     0.300 peak  1862 spectrum    1 weight  0.10000E+01 volume  0.34457E-03 ppm1      1.583 ppm2      4.579 CV     1
 ASSI { 1863}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
      6.000     4.800     0.000 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.90095E-04 ppm1      1.497 ppm2      4.578 CV     1
 ASSI { 1864}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HB1 ))
      3.000     1.100     1.100 peak  1864 spectrum    1 weight  0.10000E+01 volume  0.10713E-02 ppm1      4.382 ppm2      2.265 CV     1
 ASSI { 1867}
   (( segid "    " and resid 85   and name HD1 ))
   (( segid "    " and resid 85   and name HB1 ))
      4.200     2.200     1.800 peak  1867 spectrum    1 weight  0.10000E+01 volume  0.57195E-03 ppm1      3.758 ppm2      2.265 CV     1
 ASSI { 1868}
   (( segid "    " and resid 85   and name HD2 ))
   (( segid "    " and resid 85   and name HB1 ))
      4.700     2.800     1.300 peak  1868 spectrum    1 weight  0.10000E+01 volume  0.41802E-03 ppm1      3.590 ppm2      2.258 CV     1
 ASSI { 1869}
   (( segid "    " and resid 85   and name HD2 ))
   (( segid "    " and resid 85   and name HG2 ))
      2.700     0.900     0.900 peak  1869 spectrum    1 weight  0.10000E+01 volume  0.26290E-02 ppm1      3.596 ppm2      1.996 CV     1
 OR { 1869}
   (( segid "    " and resid 85   and name HD2 ))
   (( segid "    " and resid 85   and name HG1 ))
 ASSI { 1870}
   (( segid "    " and resid 85   and name HD1 ))
   (( segid "    " and resid 85   and name HG1 ))
      2.500     0.800     0.800 peak  1870 spectrum    1 weight  0.10000E+01 volume  0.37714E-02 ppm1      3.760 ppm2      1.994 CV     1
 OR { 1870}
   (( segid "    " and resid 85   and name HD1 ))
   (( segid "    " and resid 85   and name HG2 ))
 ASSI { 1885}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HA  ))
      2.200     0.600     0.600 peak  1885 spectrum    1 weight  0.10000E+01 volume  0.41319E-02 ppm1      2.407 ppm2      4.593 CV     1
 ASSI { 1887}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HD2 ))
      3.800     1.800     1.800 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.11604E-02 ppm1      2.405 ppm2      3.549 CV     1
 ASSI { 1890}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HD1 ))
      3.900     1.900     1.900 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.10704E-02 ppm1      2.407 ppm2      3.827 CV     1
 ASSI { 1893}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 57   and name HG1 ))
      2.100     0.600     0.600 peak  1893 spectrum    1 weight  0.10000E+01 volume  0.41478E-02 ppm1      2.407 ppm2      2.078 CV     1
 ASSI { 1898}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.400     2.500     1.600 peak  1898 spectrum    1 weight  0.10000E+01 volume  0.72621E-03 ppm1      2.407 ppm2      7.162 CV     1
 ASSI { 1899}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 59   and name HN  ))
      4.500     2.600     1.500 peak  1899 spectrum    1 weight  0.10000E+01 volume  0.56448E-03 ppm1      2.407 ppm2      8.590 CV     1
 ASSI { 1901}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
      5.600     4.000     0.400 peak  1901 spectrum    1 weight  0.10000E+01 volume  0.44295E-03 ppm1      2.405 ppm2      1.489 CV     1
 ASSI { 1906}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 56   and name HA  ))
      1.800     0.400     0.400 peak  1906 spectrum    1 weight  0.10000E+01 volume  0.66508E-02 ppm1      3.832 ppm2      4.917 CV     1
 ASSI { 1907}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 56   and name HA  ))
      2.500     0.800     0.800 peak  1907 spectrum    1 weight  0.10000E+01 volume  0.53140E-02 ppm1      3.547 ppm2      4.918 CV     1
 ASSI { 1908}
   (( segid "    " and resid 57   and name HG1 ))
   (( segid "    " and resid 56   and name HA  ))
      4.400     2.400     1.600 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.92402E-03 ppm1      2.078 ppm2      4.916 CV     1
 ASSI { 1909}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 56   and name HA  ))
      4.900     3.000     1.100 peak  1909 spectrum    1 weight  0.10000E+01 volume  0.80248E-03 ppm1      1.934 ppm2      4.916 CV     1
 ASSI { 1910}
   (( segid "    " and resid 57   and name HG1 ))
   (( segid "    " and resid 57   and name HA  ))
      3.500     1.500     1.500 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.99927E-03 ppm1      2.076 ppm2      4.596 CV     1
 ASSI { 1911}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name HA  ))
      4.400     2.400     1.600 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.67873E-03 ppm1      1.933 ppm2      4.595 CV     1
 ASSI { 1912}
   (( segid "    " and resid 57   and name HG1 ))
   (  segid "    " and resid 56   and name HD2%)
      5.000     3.200     1.000 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.66478E-03 ppm1      2.085 ppm2      0.848 CV     1
 ASSI { 1914}
   (( segid "    " and resid 57   and name HG2 ))
   (  segid "    " and resid 56   and name HD2%)
      5.000     3.200     1.000 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.78911E-03 ppm1      1.947 ppm2      0.848 CV     1
 ASSI { 1915}
   (( segid "    " and resid 57   and name HG2 ))
   (  segid "    " and resid 55   and name HG1%)
      4.500     2.600     1.500 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.53656E-03 ppm1      1.947 ppm2      0.746 CV     1
 ASSI { 1916}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name HB1 ))
      2.700     0.900     0.900 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.26263E-02 ppm1      1.934 ppm2      2.408 CV     1
 ASSI { 1922}
   (( segid "    " and resid 57   and name HG1 ))
   (( segid "    " and resid 60   and name HG1 ))
      4.800     2.900     1.200 peak  1922 spectrum    1 weight  0.10000E+01 volume  0.66235E-03 ppm1      2.080 ppm2      2.232 CV     1
 OR { 1922}
   (( segid "    " and resid 57   and name HG1 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1925}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 57   and name HD1 ))
      2.600     0.800     0.800 peak  1925 spectrum    1 weight  0.10000E+01 volume  0.35195E-02 ppm1      1.939 ppm2      3.830 CV     1
 ASSI { 1927}
   (( segid "    " and resid 57   and name HG1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.400     2.400     1.600 peak  1927 spectrum    1 weight  0.10000E+01 volume  0.84004E-03 ppm1      2.077 ppm2      7.163 CV     1
 ASSI { 1928}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 60   and name HN  ))
      3.800     1.800     1.800 peak  1928 spectrum    1 weight  0.10000E+01 volume  0.99630E-03 ppm1      1.934 ppm2      7.163 CV     1
 ASSI { 1929}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 60   and name HG1 ))
      4.400     2.400     1.600 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.66289E-03 ppm1      3.836 ppm2      2.225 CV     1
 OR { 1929}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1930}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 57   and name HG1 ))
      2.200     0.600     0.600 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.38986E-02 ppm1      3.832 ppm2      2.078 CV     1
 ASSI { 1934}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HG2 ))
      2.100     0.600     0.600 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.47189E-02 ppm1      3.546 ppm2      1.933 CV     1
 ASSI { 1935}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HG1 ))
      2.900     1.000     1.000 peak  1935 spectrum    1 weight  0.10000E+01 volume  0.37246E-02 ppm1      3.546 ppm2      2.080 CV     1
 ASSI { 1936}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 60   and name HG1 ))
      3.000     1.100     1.100 peak  1936 spectrum    1 weight  0.10000E+01 volume  0.11462E-02 ppm1      3.547 ppm2      2.229 CV     1
 OR { 1936}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1939}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.200     2.200     1.800 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.13229E-02 ppm1      3.832 ppm2      1.345 CV     1
 ASSI { 1940}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.100     2.100     1.900 peak  1940 spectrum    1 weight  0.10000E+01 volume  0.15312E-02 ppm1      3.545 ppm2      1.343 CV     1
 ASSI { 1941}
   (( segid "    " and resid 57   and name HD1 ))
   (  segid "    " and resid 56   and name HD2%)
      3.700     1.700     1.700 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.19319E-02 ppm1      3.832 ppm2      0.845 CV     1
 ASSI { 1942}
   (( segid "    " and resid 57   and name HD2 ))
   (  segid "    " and resid 56   and name HD2%)
      3.800     1.800     1.800 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.22873E-02 ppm1      3.547 ppm2      0.847 CV     1
 ASSI { 1943}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 57   and name HA  ))
      3.900     1.900     1.900 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.53959E-03 ppm1      3.830 ppm2      4.599 CV     1
 ASSI { 1944}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 57   and name HA  ))
      4.100     2.100     1.900 peak  1944 spectrum    1 weight  0.10000E+01 volume  0.42102E-03 ppm1      3.546 ppm2      4.598 CV     1
 ASSI { 1951}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HB1 ))
      2.100     0.600     0.600 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.10435E-01 ppm1      1.993 ppm2      2.261 CV     1
 OR { 1951}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HB1 ))
 ASSI { 1952}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HB2 ))
      2.200     0.600     0.600 peak  1952 spectrum    1 weight  0.10000E+01 volume  0.87939E-02 ppm1      1.993 ppm2      1.867 CV     1
 OR { 1952}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HB2 ))
 ASSI { 1953}
   (( segid "    " and resid 85   and name HG2 ))
   (( segid "    " and resid 85   and name HA  ))
      4.400     2.400     1.600 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.47879E-03 ppm1      1.994 ppm2      4.382 CV     1
 OR { 1953}
   (( segid "    " and resid 85   and name HG1 ))
   (( segid "    " and resid 85   and name HA  ))
 ASSI { 1961}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HA  ))
      3.200     1.300     1.300 peak  1961 spectrum    1 weight  0.10000E+01 volume  0.10398E-02 ppm1      1.477 ppm2      3.790 CV     1
 ASSI { 1962}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HA  ))
      3.300     1.300     1.300 peak  1962 spectrum    1 weight  0.10000E+01 volume  0.19643E-02 ppm1      1.250 ppm2      3.789 CV     1
 ASSI { 1963}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HN  ))
      3.500     1.500     1.500 peak  1963 spectrum    1 weight  0.10000E+01 volume  0.13602E-02 ppm1      1.480 ppm2      7.785 CV     1
 ASSI { 1964}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HN  ))
      3.200     1.200     1.200 peak  1964 spectrum    1 weight  0.10000E+01 volume  0.11519E-02 ppm1      1.251 ppm2      7.784 CV     1
 ASSI { 1965}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HB1 ))
      2.400     0.700     0.700 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.40594E-02 ppm1      1.250 ppm2      1.725 CV     1
 OR { 1965}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1966}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HD1 ))
      2.500     0.800     0.800 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.36349E-02 ppm1      1.250 ppm2      1.643 CV     1
 OR { 1966}
   (( segid "    " and resid 11   and name HG2 ))
   (( segid "    " and resid 11   and name HD2 ))
 ASSI { 1970}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HE2 ))
      3.600     1.600     1.600 peak  1970 spectrum    1 weight  0.10000E+01 volume  0.65392E-03 ppm1      1.486 ppm2      2.941 CV     1
 OR { 1970}
   (( segid "    " and resid 11   and name HG1 ))
   (( segid "    " and resid 11   and name HE1 ))
 ASSI { 1971}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      3.600     1.600     1.600 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.85713E-03 ppm1      3.792 ppm2      8.822 CV     1
 ASSI { 1972}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      3.500     1.600     1.600 peak  1972 spectrum    1 weight  0.10000E+01 volume  0.42573E-03 ppm1      3.796 ppm2      8.147 CV     1
 ASSI { 1973}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      2.900     1.000     1.000 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.16451E-02 ppm1      3.790 ppm2      7.786 CV     1
 ASSI { 1975}
   (( segid "    " and resid 20   and name HD1 ))
   (( segid "    " and resid 20   and name HN  ))
      3.100     3.100     2.900 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.30045E-03 ppm1      3.136 ppm2      8.566 CV     1
 OR { 1975}
   (( segid "    " and resid 20   and name HD2 ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI { 1980}
   (( segid "    " and resid 21   and name HB1 ))
   (( segid "    " and resid 23   and name HN  ))
      3.700     1.700     1.700 peak  1980 spectrum    1 weight  0.10000E+01 volume  0.33455E-03 ppm1      2.677 ppm2      8.211 CV     1
 ASSI { 1981}
   (( segid "    " and resid 21   and name HB2 ))
   (( segid "    " and resid 23   and name HN  ))
      4.700     2.800     1.300 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.27488E-03 ppm1      2.490 ppm2      8.212 CV     1
 ASSI { 1989}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 25   and name HB  ))
      5.700     4.100     0.300 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.22319E-03 ppm1      0.746 ppm2      1.888 CV     1
 ASSI { 1992}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 27   and name HN  ))
      3.800     1.800     1.800 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.91970E-03 ppm1      1.670 ppm2      8.901 CV     1
 ASSI { 1993}
   (( segid "    " and resid 27   and name HB1 ))
   (( segid "    " and resid 26   and name HA  ))
      6.000     4.400     0.000 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.25987E-03 ppm1      1.670 ppm2      4.603 CV     1
 ASSI { 1996}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HB1 ))
      2.400     0.700     0.700 peak  1996 spectrum    1 weight  0.10000E+01 volume  0.42096E-02 ppm1      0.868 ppm2      1.674 CV     1
 ASSI { 1997}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HB1 ))
      3.000     1.100     1.100 peak  1997 spectrum    1 weight  0.10000E+01 volume  0.20488E-02 ppm1      0.707 ppm2      1.676 CV     1
 ASSI { 1999}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HG  ))
      2.400     0.700     0.700 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.45911E-02 ppm1      0.707 ppm2      1.784 CV     1
 ASSI { 2001}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 67   and name HA  ))
      4.400     2.400     1.600 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.87969E-03 ppm1      0.706 ppm2      3.803 CV     1
 ASSI { 2002}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HA  ))
      3.000     1.100     1.100 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.12853E-02 ppm1      0.868 ppm2      4.040 CV     1
 ASSI { 2004}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HA  ))
      3.400     1.400     1.400 peak  2004 spectrum    1 weight  0.10000E+01 volume  0.44997E-02 ppm1      0.707 ppm2      4.039 CV     1
 ASSI { 2006}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 25   and name HN  ))
      2.900     2.900     3.100 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.51553E-03 ppm1      0.706 ppm2      7.344 CV     1
 ASSI { 2007}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 70   and name HE21))
      4.400     2.400     1.600 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.75980E-03 ppm1      0.868 ppm2      6.603 CV     1
 ASSI { 2008}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 25   and name HN  ))
      2.900     2.900     3.100 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.47210E-03 ppm1      0.868 ppm2      7.339 CV     1
 ASSI { 2009}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HN  ))
      3.800     1.800     1.800 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.11141E-02 ppm1      0.867 ppm2      8.902 CV     1
 ASSI { 2010}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HN  ))
      3.700     1.700     1.700 peak  2010 spectrum    1 weight  0.10000E+01 volume  0.17670E-02 ppm1      0.707 ppm2      8.905 CV     1
 ASSI { 2011}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 28   and name HN  ))
      5.300     3.500     0.700 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.28814E-03 ppm1      0.707 ppm2      8.333 CV     1
 ASSI { 2013}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HG  ))
      2.600     0.900     0.900 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.20259E-02 ppm1      0.868 ppm2      1.783 CV     1
 ASSI { 2014}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 27   and name HB2 ))
      2.600     0.800     0.800 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.36418E-02 ppm1      0.706 ppm2      1.307 CV     1
 ASSI { 2015}
   (  segid "    " and resid 27   and name HD2%)
   (( segid "    " and resid 27   and name HB2 ))
      3.400     1.400     1.400 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.23859E-02 ppm1      0.867 ppm2      1.304 CV     1
 ASSI { 2018}
   (( segid "    " and resid 27   and name HG  ))
   (( segid "    " and resid 27   and name HN  ))
      2.600     0.900     0.900 peak  2018 spectrum    1 weight  0.10000E+01 volume  0.19411E-02 ppm1      1.785 ppm2      8.898 CV     1
 ASSI { 2019}
   (( segid "    " and resid 27   and name HG  ))
   (( segid "    " and resid 26   and name HA  ))
      4.400     2.400     1.600 peak  2019 spectrum    1 weight  0.10000E+01 volume  0.39664E-03 ppm1      1.784 ppm2      4.605 CV     1
 ASSI { 2020}
   (( segid "    " and resid 27   and name HG  ))
   (( segid "    " and resid 27   and name HB2 ))
      2.800     1.000     1.000 peak  2020 spectrum    1 weight  0.10000E+01 volume  0.16668E-02 ppm1      1.779 ppm2      1.307 CV     1
 ASSI { 2021}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      2.100     0.600     0.600 peak  2021 spectrum    1 weight  0.10000E+01 volume  0.82042E-02 ppm1      4.525 ppm2      9.193 CV     1
 ASSI { 2022}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      2.800     1.000     1.000 peak  2022 spectrum    1 weight  0.10000E+01 volume  0.21260E-02 ppm1      4.527 ppm2      7.361 CV     1
 ASSI { 2024}
   (( segid "    " and resid 30   and name HB1 ))
   (  segid "    " and resid 65   and name HG2%)
      4.600     2.600     1.400 peak  2024 spectrum    1 weight  0.10000E+01 volume  0.39352E-03 ppm1      4.482 ppm2      0.968 CV     1
 ASSI { 2025}
   (( segid "    " and resid 30   and name HB2 ))
   (  segid "    " and resid 65   and name HG2%)
      4.300     2.300     1.700 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.75128E-03 ppm1      3.983 ppm2      0.968 CV     1
 ASSI { 2027}
   (( segid "    " and resid 31   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      3.600     1.600     1.600 peak  2027 spectrum    1 weight  0.10000E+01 volume  0.56178E-03 ppm1      3.886 ppm2      8.476 CV     1
 ASSI { 2030}
   (( segid "    " and resid 31   and name HB2 ))
   (( segid "    " and resid 36   and name HB1 ))
      4.200     2.200     1.800 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.51241E-03 ppm1      1.286 ppm2      1.440 CV     1
 ASSI { 2032}
   (( segid "    " and resid 31   and name HB1 ))
   (( segid "    " and resid 36   and name HB1 ))
      4.100     2.100     1.900 peak  2032 spectrum    1 weight  0.10000E+01 volume  0.18491E-03 ppm1      1.883 ppm2      1.434 CV     1
 ASSI { 2033}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 62   and name HD1 ))
      3.200     1.300     1.300 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.63575E-03 ppm1      1.380 ppm2      3.135 CV     1
 ASSI { 2035}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 30   and name HA  ))
      5.400     3.600     0.600 peak  2035 spectrum    1 weight  0.10000E+01 volume  0.26682E-03 ppm1      1.379 ppm2      4.646 CV     1
 ASSI { 2036}
   (  segid "    " and resid 32   and name HB% )
   (  segid "    " and resid 31   and name HD2%)
      5.900     4.300     0.100 peak  2036 spectrum    1 weight  0.10000E+01 volume  0.11707E-03 ppm1      1.383 ppm2      0.864 CV     1
 ASSI { 2042}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 32   and name HB% )
      4.500     2.500     1.500 peak  2042 spectrum    1 weight  0.10000E+01 volume  0.25932E-03 ppm1      4.375 ppm2      1.385 CV     1
 ASSI { 2045}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 34   and name HD2%)
      5.300     3.500     0.700 peak  2045 spectrum    1 weight  0.10000E+01 volume  0.20124E-03 ppm1      4.369 ppm2      0.868 CV     1
 ASSI { 2046}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 29   and name HB2 ))
      4.700     2.700     1.300 peak  2046 spectrum    1 weight  0.10000E+01 volume  0.48887E-03 ppm1      3.035 ppm2      3.765 CV     1
 ASSI { 2047}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 29   and name HB2 ))
      5.500     3.800     0.500 peak  2047 spectrum    1 weight  0.10000E+01 volume  0.35078E-03 ppm1      2.671 ppm2      3.764 CV     1
 ASSI { 2048}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HA  ))
      3.000     1.100     1.100 peak  2048 spectrum    1 weight  0.10000E+01 volume  0.24736E-02 ppm1      3.028 ppm2      4.372 CV     1
 ASSI { 2049}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HA  ))
      2.700     0.900     0.900 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.32576E-02 ppm1      2.675 ppm2      4.370 CV     1
 ASSI { 2054}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      4.200     2.200     1.800 peak  2054 spectrum    1 weight  0.10000E+01 volume  0.85233E-03 ppm1      3.028 ppm2      7.580 CV     1
 ASSI { 2055}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      4.400     2.400     1.600 peak  2055 spectrum    1 weight  0.10000E+01 volume  0.95065E-03 ppm1      2.676 ppm2      7.580 CV     1
 ASSI { 2056}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      2.600     0.900     0.900 peak  2056 spectrum    1 weight  0.10000E+01 volume  0.23901E-02 ppm1      2.676 ppm2      8.072 CV     1
 ASSI { 2057}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 33   and name HN  ))
      2.900     1.100     1.100 peak  2057 spectrum    1 weight  0.10000E+01 volume  0.24477E-02 ppm1      3.031 ppm2      8.072 CV     1
 ASSI { 2058}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.800     1.000     1.000 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.24710E-02 ppm1      4.373 ppm2      8.074 CV     1
 ASSI { 2059}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      4.100     2.100     1.900 peak  2059 spectrum    1 weight  0.10000E+01 volume  0.48149E-03 ppm1      4.370 ppm2      7.581 CV     1
 ASSI { 2060}
   (( segid "    " and resid 33   and name HB1 ))
   (( segid "    " and resid 30   and name HN  ))
      3.300     1.300     1.300 peak  2060 spectrum    1 weight  0.10000E+01 volume  0.13222E-02 ppm1      3.028 ppm2      9.193 CV     1
 ASSI { 2061}
   (( segid "    " and resid 33   and name HB2 ))
   (( segid "    " and resid 30   and name HN  ))
      3.000     1.100     1.100 peak  2061 spectrum    1 weight  0.10000E+01 volume  0.12651E-02 ppm1      2.676 ppm2      9.193 CV     1
 ASSI { 2065}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HB2 ))
      2.400     0.700     0.700 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.59358E-02 ppm1      0.714 ppm2      1.658 CV     1
 ASSI { 2071}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 31   and name HA  ))
      2.500     0.800     0.800 peak  2071 spectrum    1 weight  0.10000E+01 volume  0.41262E-02 ppm1      0.715 ppm2      3.876 CV     1
 ASSI { 2072}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 29   and name HB2 ))
      3.000     1.100     1.100 peak  2072 spectrum    1 weight  0.10000E+01 volume  0.13914E-02 ppm1      0.715 ppm2      3.760 CV     1
 ASSI { 2073}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HA  ))
      3.100     1.200     1.200 peak  2073 spectrum    1 weight  0.10000E+01 volume  0.23561E-02 ppm1      0.714 ppm2      4.310 CV     1
 ASSI { 2076}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 35   and name HN  ))
      3.400     1.500     1.500 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.28272E-02 ppm1      0.714 ppm2      7.578 CV     1
 ASSI { 2078}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 31   and name HN  ))
      3.200     1.300     1.300 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.25572E-03 ppm1      0.718 ppm2      8.568 CV     1
 ASSI { 2079}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 33   and name HN  ))
      4.400     2.400     1.600 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.27311E-03 ppm1      0.714 ppm2      8.069 CV     1
 ASSI { 2085}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 34   and name HB1 ))
      3.300     1.400     1.400 peak  2085 spectrum    1 weight  0.10000E+01 volume  0.18716E-02 ppm1      0.718 ppm2      1.883 CV     1
 ASSI { 2086}
   (( segid "    " and resid 34   and name HG  ))
   (( segid "    " and resid 35   and name HN  ))
      4.100     2.100     1.900 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.73809E-03 ppm1      1.744 ppm2      7.579 CV     1
 ASSI { 2087}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 29   and name HN  ))
      3.800     1.800     1.800 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.89951E-04 ppm1      0.717 ppm2      7.370 CV     1
 ASSI { 2089}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 31   and name HA  ))
      2.700     0.900     0.900 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.26214E-02 ppm1      0.860 ppm2      3.868 CV     1
 ASSI { 2090}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 29   and name HB2 ))
      2.800     1.000     1.000 peak  2090 spectrum    1 weight  0.10000E+01 volume  0.21231E-02 ppm1      0.860 ppm2      3.762 CV     1
 ASSI { 2091}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.800     0.800 peak  2091 spectrum    1 weight  0.10000E+01 volume  0.10302E-01 ppm1      0.860 ppm2      4.310 CV     1
 ASSI { 2093}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 33   and name HB2 ))
      3.000     1.100     1.100 peak  2093 spectrum    1 weight  0.10000E+01 volume  0.42732E-03 ppm1      0.859 ppm2      2.685 CV     1
 ASSI { 2094}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 34   and name HB1 ))
      2.700     0.900     0.900 peak  2094 spectrum    1 weight  0.10000E+01 volume  0.32411E-02 ppm1      0.860 ppm2      1.876 CV     1
 ASSI { 2095}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 34   and name HG  ))
      2.400     0.700     0.700 peak  2095 spectrum    1 weight  0.10000E+01 volume  0.56289E-02 ppm1      0.860 ppm2      1.749 CV     1
 ASSI { 2096}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 34   and name HB2 ))
      2.700     0.900     0.900 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.44871E-02 ppm1      0.859 ppm2      1.659 CV     1
 ASSI { 2099}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 35   and name HN  ))
      2.300     2.300     3.700 peak  2099 spectrum    1 weight  0.10000E+01 volume  0.17653E-02 ppm1      0.860 ppm2      7.582 CV     1
 ASSI { 2100}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 29   and name HN  ))
      3.100     3.100     2.900 peak  2100 spectrum    1 weight  0.10000E+01 volume  0.34595E-03 ppm1      0.860 ppm2      7.368 CV     1
 ASSI { 2101}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 32   and name HN  ))
      2.800     2.800     3.200 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.56745E-03 ppm1      0.860 ppm2      8.458 CV     1
 ASSI { 2102}
   (  segid "    " and resid 34   and name HD1%)
   (( segid "    " and resid 32   and name HN  ))
      4.500     2.600     1.500 peak  2102 spectrum    1 weight  0.10000E+01 volume  0.24787E-03 ppm1      0.713 ppm2      8.467 CV     1
 ASSI { 2103}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 33   and name HN  ))
      3.200     1.300     1.300 peak  2103 spectrum    1 weight  0.10000E+01 volume  0.26503E-03 ppm1      0.861 ppm2      8.064 CV     1
 ASSI { 2105}
   (( segid "    " and resid 35   and name HA1 ))
   (( segid "    " and resid 36   and name HN  ))
      4.000     2.000     2.000 peak  2105 spectrum    1 weight  0.10000E+01 volume  0.86484E-03 ppm1      4.316 ppm2      7.700 CV     1
 ASSI { 2106}
   (( segid "    " and resid 35   and name HA2 ))
   (( segid "    " and resid 36   and name HN  ))
      3.000     1.100     1.100 peak  2106 spectrum    1 weight  0.10000E+01 volume  0.12341E-02 ppm1      3.605 ppm2      7.698 CV     1
 ASSI { 2107}
   (( segid "    " and resid 35   and name HA1 ))
   (( segid "    " and resid 35   and name HN  ))
      2.800     1.000     1.000 peak  2107 spectrum    1 weight  0.10000E+01 volume  0.41451E-02 ppm1      4.307 ppm2      7.612 CV     1
 ASSI { 2108}
   (( segid "    " and resid 35   and name HA2 ))
   (( segid "    " and resid 35   and name HN  ))
      2.300     0.700     0.700 peak  2108 spectrum    1 weight  0.10000E+01 volume  0.53017E-02 ppm1      3.607 ppm2      7.611 CV     1
 ASSI { 2114}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 36   and name HN  ))
      2.500     0.800     0.800 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.17512E-02 ppm1      1.445 ppm2      7.697 CV     1
 ASSI { 2115}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 36   and name HN  ))
      3.400     1.500     1.500 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.15608E-02 ppm1      1.177 ppm2      7.697 CV     1
 ASSI { 2116}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 35   and name HN  ))
      4.500     2.500     1.500 peak  2116 spectrum    1 weight  0.10000E+01 volume  0.32987E-03 ppm1      1.441 ppm2      7.608 CV     1
 ASSI { 2117}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 35   and name HN  ))
      3.300     3.300     2.700 peak  2117 spectrum    1 weight  0.10000E+01 volume  0.23769E-03 ppm1      1.179 ppm2      7.608 CV     1
 ASSI { 2119}
   (( segid "    " and resid 36   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      5.700     4.000     0.300 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.52864E-03 ppm1      1.446 ppm2      4.078 CV     1
 ASSI { 2120}
   (( segid "    " and resid 36   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      4.800     2.900     1.200 peak  2120 spectrum    1 weight  0.10000E+01 volume  0.55734E-03 ppm1      1.178 ppm2      4.078 CV     1
 ASSI { 2123}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HN  ))
      2.800     1.000     1.000 peak  2123 spectrum    1 weight  0.10000E+01 volume  0.16735E-02 ppm1      4.151 ppm2      7.702 CV     1
 ASSI { 2124}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      2.100     0.500     0.500 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.64040E-02 ppm1      4.149 ppm2      7.869 CV     1
 ASSI { 2125}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      5.400     3.700     0.600 peak  2125 spectrum    1 weight  0.10000E+01 volume  0.29840E-03 ppm1      4.152 ppm2      8.360 CV     1
 ASSI { 2126}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.600     0.800     0.800 peak  2126 spectrum    1 weight  0.10000E+01 volume  0.14724E-02 ppm1      4.149 ppm2      1.178 CV     1
 ASSI { 2127}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
      3.000     1.100     1.100 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.13004E-02 ppm1      4.148 ppm2      1.442 CV     1
 ASSI { 2129}
   (( segid "    " and resid 36   and name HA  ))
   (  segid "    " and resid 36   and name HD1%)
      2.900     1.100     1.100 peak  2129 spectrum    1 weight  0.10000E+01 volume  0.39994E-02 ppm1      4.151 ppm2      0.704 CV     1
 ASSI { 2134}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 36   and name HB1 ))
      2.200     0.600     0.600 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.53755E-02 ppm1      0.732 ppm2      1.458 CV     1
 ASSI { 2135}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 36   and name HB2 ))
      2.800     1.000     1.000 peak  2135 spectrum    1 weight  0.10000E+01 volume  0.26641E-02 ppm1      0.732 ppm2      1.180 CV     1
 ASSI { 2136}
   (  segid "    " and resid 36   and name HD2%)
   (  segid "    " and resid 44   and name HG2%)
      3.200     1.300     1.300 peak  2136 spectrum    1 weight  0.10000E+01 volume  0.16689E-02 ppm1      0.731 ppm2      0.993 CV     1
 ASSI { 2137}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 36   and name HG  ))
      2.300     0.700     0.700 peak  2137 spectrum    1 weight  0.10000E+01 volume  0.54466E-02 ppm1      0.732 ppm2      1.744 CV     1
 ASSI { 2138}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 40   and name HB1 ))
      3.000     1.200     1.200 peak  2138 spectrum    1 weight  0.10000E+01 volume  0.40183E-02 ppm1      0.731 ppm2      1.883 CV     1
 ASSI { 2140}
   (  segid "    " and resid 36   and name HD1%)
   (  segid "    " and resid 44   and name HG2%)
      3.100     1.200     1.200 peak  2140 spectrum    1 weight  0.10000E+01 volume  0.42405E-02 ppm1      0.701 ppm2      0.996 CV     1
 ASSI { 2141}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HB2 ))
      2.500     0.800     0.800 peak  2141 spectrum    1 weight  0.10000E+01 volume  0.18376E-02 ppm1      0.701 ppm2      1.177 CV     1
 ASSI { 2143}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 41   and name HA2 ))
      3.500     1.500     1.500 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.13354E-02 ppm1      0.700 ppm2      3.490 CV     1
 ASSI { 2145}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 62   and name HD1 ))
      4.400     2.400     1.600 peak  2145 spectrum    1 weight  0.10000E+01 volume  0.52342E-03 ppm1      0.733 ppm2      3.154 CV     1
 ASSI { 2146}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 41   and name HA2 ))
      3.000     1.200     1.200 peak  2146 spectrum    1 weight  0.10000E+01 volume  0.26001E-02 ppm1      0.732 ppm2      3.493 CV     1
 ASSI { 2148}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 41   and name HA1 ))
      3.300     1.400     1.400 peak  2148 spectrum    1 weight  0.10000E+01 volume  0.20139E-02 ppm1      0.731 ppm2      3.787 CV     1
 ASSI { 2149}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 62   and name HA  ))
      2.500     0.800     0.800 peak  2149 spectrum    1 weight  0.10000E+01 volume  0.40279E-02 ppm1      0.732 ppm2      3.705 CV     1
 ASSI { 2150}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 36   and name HA  ))
      4.400     2.500     1.600 peak  2150 spectrum    1 weight  0.10000E+01 volume  0.91841E-03 ppm1      0.731 ppm2      4.150 CV     1
 ASSI { 2151}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
      4.300     2.300     1.700 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.95812E-03 ppm1      0.731 ppm2      4.083 CV     1
 ASSI { 2156}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 31   and name HN  ))
      4.900     3.000     1.100 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.38110E-03 ppm1      0.733 ppm2      8.571 CV     1
 ASSI { 2157}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 32   and name HN  ))
      3.800     1.800     1.800 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.55962E-03 ppm1      0.731 ppm2      8.474 CV     1
 ASSI { 2158}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 38   and name HN  ))
      4.500     2.600     1.500 peak  2158 spectrum    1 weight  0.10000E+01 volume  0.11258E-02 ppm1      0.732 ppm2      8.367 CV     1
 ASSI { 2159}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 37   and name HN  ))
      4.500     2.500     1.500 peak  2159 spectrum    1 weight  0.10000E+01 volume  0.10353E-02 ppm1      0.732 ppm2      7.845 CV     1
 ASSI { 2160}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 36   and name HN  ))
      3.800     1.800     1.800 peak  2160 spectrum    1 weight  0.10000E+01 volume  0.88560E-03 ppm1      0.731 ppm2      7.702 CV     1
 ASSI { 2161}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 42   and name HN  ))
      5.000     3.100     1.000 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.43770E-03 ppm1      0.731 ppm2      7.383 CV     1
 ASSI { 2162}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 38   and name HN  ))
      3.500     1.500     1.500 peak  2162 spectrum    1 weight  0.10000E+01 volume  0.92858E-03 ppm1      0.699 ppm2      8.376 CV     1
 ASSI { 2164}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 36   and name HN  ))
      4.300     2.300     1.700 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.82093E-03 ppm1      0.699 ppm2      7.702 CV     1
 ASSI { 2165}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 42   and name HN  ))
      4.900     3.000     1.100 peak  2165 spectrum    1 weight  0.10000E+01 volume  0.37540E-03 ppm1      0.700 ppm2      7.383 CV     1
 ASSI { 2166}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 36   and name HA  ))
      3.600     1.600     1.600 peak  2166 spectrum    1 weight  0.10000E+01 volume  0.85080E-03 ppm1      1.733 ppm2      4.152 CV     1
 ASSI { 2168}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 37   and name HN  ))
      3.800     1.800     1.800 peak  2168 spectrum    1 weight  0.10000E+01 volume  0.69046E-03 ppm1      1.734 ppm2      7.871 CV     1
 ASSI { 2169}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 36   and name HN  ))
      4.000     2.000     2.000 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.22016E-03 ppm1      1.737 ppm2      7.700 CV     1
 ASSI { 2170}
   (( segid "    " and resid 36   and name HG  ))
   (( segid "    " and resid 38   and name HN  ))
      4.600     2.700     1.400 peak  2170 spectrum    1 weight  0.10000E+01 volume  0.50468E-03 ppm1      1.727 ppm2      8.360 CV     1
 ASSI { 2172}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.300     1.300     1.300 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.13977E-02 ppm1      2.714 ppm2      7.870 CV     1
 ASSI { 2173}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 38   and name HN  ))
      5.900     4.300     0.100 peak  2173 spectrum    1 weight  0.10000E+01 volume  0.10504E-03 ppm1      2.715 ppm2      8.359 CV     1
 ASSI { 2174}
   (( segid "    " and resid 37   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
      4.700     2.800     1.300 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.36014E-03 ppm1      2.726 ppm2      4.155 CV     1
 ASSI { 2184}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 38   and name HN  ))
      4.500     2.500     1.500 peak  2184 spectrum    1 weight  0.10000E+01 volume  0.23946E-03 ppm1      4.902 ppm2      8.360 CV     1
 ASSI { 2185}
   (( segid "    " and resid 37   and name HA  ))
   (( segid "    " and resid 37   and name HN  ))
      3.100     1.200     1.200 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.10965E-02 ppm1      4.905 ppm2      7.872 CV     1
 ASSI { 2186}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
      3.000     1.100     1.100 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.24631E-02 ppm1      1.862 ppm2      4.174 CV     1
 ASSI { 2188}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      3.700     1.700     1.700 peak  2188 spectrum    1 weight  0.10000E+01 volume  0.54178E-03 ppm1      1.863 ppm2      4.056 CV     1
 ASSI { 2189}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 41   and name HN  ))
      4.400     2.400     1.600 peak  2189 spectrum    1 weight  0.10000E+01 volume  0.34769E-03 ppm1      1.873 ppm2      8.350 CV     1
 ASSI { 2190}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 40   and name HN  ))
      2.900     1.100     1.100 peak  2190 spectrum    1 weight  0.10000E+01 volume  0.12921E-02 ppm1      1.864 ppm2      9.316 CV     1
 ASSI { 2191}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 40   and name HN  ))
      3.700     1.700     1.700 peak  2191 spectrum    1 weight  0.10000E+01 volume  0.13606E-02 ppm1      1.643 ppm2      9.314 CV     1
 ASSI { 2192}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HN  ))
      2.600     0.800     0.800 peak  2192 spectrum    1 weight  0.10000E+01 volume  0.32702E-02 ppm1      1.863 ppm2      7.802 CV     1
 ASSI { 2193}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HN  ))
      2.700     0.900     0.900 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.21643E-02 ppm1      1.644 ppm2      7.803 CV     1
 ASSI { 2194}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HN  ))
      2.700     0.900     0.900 peak  2194 spectrum    1 weight  0.10000E+01 volume  0.23321E-02 ppm1      4.174 ppm2      7.801 CV     1
 ASSI { 2195}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      3.400     1.400     1.400 peak  2195 spectrum    1 weight  0.10000E+01 volume  0.86412E-03 ppm1      4.175 ppm2      9.317 CV     1
 ASSI { 2196}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 41   and name HN  ))
      5.600     3.900     0.400 peak  2196 spectrum    1 weight  0.10000E+01 volume  0.15180E-03 ppm1      1.652 ppm2      8.352 CV     1
 ASSI { 2197}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      5.400     3.700     0.600 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.23001E-03 ppm1      1.655 ppm2      4.055 CV     1
 ASSI { 2199}
   (( segid "    " and resid 39   and name HA  ))
   (( segid "    " and resid 39   and name HB2 ))
      2.300     0.700     0.700 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.48932E-02 ppm1      4.174 ppm2      1.649 CV     1
 ASSI { 2201}
   (( segid "    " and resid 39   and name HA  ))
   (  segid "    " and resid 39   and name HD2%)
      3.500     1.500     1.500 peak  2201 spectrum    1 weight  0.10000E+01 volume  0.15891E-02 ppm1      4.174 ppm2      0.945 CV     1
 ASSI { 2208}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      3.300     1.300     1.300 peak  2208 spectrum    1 weight  0.10000E+01 volume  0.73203E-03 ppm1      4.044 ppm2      8.317 CV     1
 ASSI { 2209}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HA  ))
      2.400     0.700     0.700 peak  2209 spectrum    1 weight  0.10000E+01 volume  0.67867E-02 ppm1      0.862 ppm2      4.175 CV     1
 ASSI { 2210}
   (  segid "    " and resid 39   and name HD1%)
   (( segid "    " and resid 39   and name HG  ))
      2.100     0.600     0.600 peak  2210 spectrum    1 weight  0.10000E+01 volume  0.92726E-02 ppm1      0.863 ppm2      1.651 CV     1
 ASSI { 2211}
   (  segid "    " and resid 39   and name HD2%)
   (( segid "    " and resid 39   and name HB1 ))
      2.700     0.900     0.900 peak  2211 spectrum    1 weight  0.10000E+01 volume  0.30303E-02 ppm1      0.929 ppm2      1.866 CV     1
 ASSI { 2213}
   (  segid "    " and resid 39   and name HD2%)
   (( segid "    " and resid 39   and name HN  ))
      4.200     2.300     1.800 peak  2213 spectrum    1 weight  0.10000E+01 volume  0.82357E-03 ppm1      0.927 ppm2      7.803 CV     1
 ASSI { 2214}
   (  segid "    " and resid 39   and name HD2%)
   (( segid "    " and resid 42   and name HN  ))
      4.700     2.700     1.300 peak  2214 spectrum    1 weight  0.10000E+01 volume  0.43632E-03 ppm1      0.926 ppm2      7.370 CV     1
 ASSI { 2215}
   (  segid "    " and resid 39   and name HD2%)
   (( segid "    " and resid 40   and name HN  ))
      4.900     3.000     1.100 peak  2215 spectrum    1 weight  0.10000E+01 volume  0.23288E-03 ppm1      0.929 ppm2      9.314 CV     1
 ASSI { 2219}
   (  segid "    " and resid 39   and name HD2%)
   (( segid "    " and resid 43   and name HG2 ))
      5.200     3.400     0.800 peak  2219 spectrum    1 weight  0.10000E+01 volume  0.16509E-03 ppm1      0.930 ppm2      2.255 CV     1
 ASSI { 2220}
   (( segid "    " and resid 39   and name HG  ))
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.100     1.100 peak  2220 spectrum    1 weight  0.10000E+01 volume  0.17275E-02 ppm1      1.651 ppm2      4.176 CV     1
 ASSI { 2223}
   (( segid "    " and resid 40   and name HG1 ))
   (  segid "    " and resid 39   and name HD2%)
      3.500     1.500     1.500 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.11393E-02 ppm1      2.917 ppm2      0.906 CV     1
 ASSI { 2224}
   (( segid "    " and resid 40   and name HG2 ))
   (  segid "    " and resid 39   and name HD2%)
      2.300     2.300     3.700 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.21828E-02 ppm1      2.513 ppm2      0.906 CV     1
 ASSI { 2229}
   (( segid "    " and resid 40   and name HG1 ))
   (( segid "    " and resid 40   and name HA  ))
      3.400     1.400     1.400 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.12438E-02 ppm1      2.918 ppm2      4.058 CV     1
 ASSI { 2230}
   (( segid "    " and resid 40   and name HG2 ))
   (( segid "    " and resid 40   and name HA  ))
      2.800     1.000     1.000 peak  2230 spectrum    1 weight  0.10000E+01 volume  0.16827E-02 ppm1      2.512 ppm2      4.059 CV     1
 ASSI { 2231}
   (( segid "    " and resid 40   and name HG1 ))
   (( segid "    " and resid 40   and name HN  ))
      2.400     0.700     0.700 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.21437E-02 ppm1      2.920 ppm2      9.316 CV     1
 ASSI { 2232}
   (( segid "    " and resid 40   and name HG2 ))
   (( segid "    " and resid 40   and name HN  ))
      3.700     1.700     1.700 peak  2232 spectrum    1 weight  0.10000E+01 volume  0.16111E-02 ppm1      2.510 ppm2      9.316 CV     1
 ASSI { 2234}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 45   and name HG2 ))
      2.100     0.600     0.600 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.25577E-02 ppm1      1.953 ppm2      1.667 CV     1
 ASSI { 2236}
   (( segid "    " and resid 45   and name HG1 ))
   (( segid "    " and resid 45   and name HN  ))
      3.900     1.900     1.900 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.49973E-03 ppm1      1.956 ppm2      8.412 CV     1
 ASSI { 2238}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      3.000     1.100     1.100 peak  2238 spectrum    1 weight  0.10000E+01 volume  0.15620E-02 ppm1      3.966 ppm2      3.044 CV     1
 ASSI { 2239}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name HB1 ))
      3.700     1.700     1.700 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.95548E-03 ppm1      3.965 ppm2      3.413 CV     1
 ASSI { 2240}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB1 ))
      2.700     0.900     0.900 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.14780E-02 ppm1      3.965 ppm2      2.037 CV     1
 ASSI { 2241}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HG  ))
      3.400     1.400     1.400 peak  2241 spectrum    1 weight  0.10000E+01 volume  0.20320E-02 ppm1      3.967 ppm2      1.813 CV     1
 ASSI { 2242}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HB2 ))
      3.000     1.100     1.100 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.20693E-02 ppm1      3.965 ppm2      1.591 CV     1
 ASSI { 2243}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      3.300     1.300     1.300 peak  2243 spectrum    1 weight  0.10000E+01 volume  0.65236E-03 ppm1      3.964 ppm2      7.138 CV     1
 ASSI { 2246}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      4.300     2.300     1.700 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.94208E-03 ppm1      3.967 ppm2      7.932 CV     1
 ASSI { 2247}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      2.700     0.900     0.900 peak  2247 spectrum    1 weight  0.10000E+01 volume  0.20793E-02 ppm1      3.965 ppm2      8.141 CV     1
 ASSI { 2248}
   (( segid "    " and resid 48   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      3.800     1.800     1.800 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.38356E-03 ppm1      3.967 ppm2      8.557 CV     1
 ASSI { 2249}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 47   and name HG2%)
      3.300     1.300     1.300 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.10651E-02 ppm1      3.966 ppm2      0.865 CV     1
 ASSI { 2250}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 48   and name HD1%)
      2.300     0.700     0.700 peak  2250 spectrum    1 weight  0.10000E+01 volume  0.65572E-02 ppm1      3.967 ppm2      0.678 CV     1
 ASSI { 2253}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 45   and name HA  ))
      4.200     2.200     1.800 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.88053E-03 ppm1      2.036 ppm2      3.825 CV     1
 ASSI { 2255}
   (( segid "    " and resid 48   and name HB1 ))
   (  segid "    " and resid 48   and name HD1%)
      2.500     0.800     0.800 peak  2255 spectrum    1 weight  0.10000E+01 volume  0.36751E-02 ppm1      2.034 ppm2      0.702 CV     1
 ASSI { 2256}
   (( segid "    " and resid 48   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      3.400     1.500     1.500 peak  2256 spectrum    1 weight  0.10000E+01 volume  0.20291E-02 ppm1      2.035 ppm2      8.138 CV     1
 ASSI { 2261}
   (( segid "    " and resid 48   and name HG  ))
   (( segid "    " and resid 48   and name HN  ))
      3.500     1.500     1.500 peak  2261 spectrum    1 weight  0.10000E+01 volume  0.16156E-02 ppm1      1.807 ppm2      8.139 CV     1
 ASSI { 2262}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 52   and name HB1 ))
      3.700     1.700     1.700 peak  2262 spectrum    1 weight  0.10000E+01 volume  0.96487E-03 ppm1      0.671 ppm2      3.417 CV     1
 ASSI { 2263}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 52   and name HB2 ))
      3.300     1.400     1.400 peak  2263 spectrum    1 weight  0.10000E+01 volume  0.11015E-02 ppm1      0.670 ppm2      3.043 CV     1
 ASSI { 2265}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 48   and name HN  ))
      3.500     1.500     1.500 peak  2265 spectrum    1 weight  0.10000E+01 volume  0.18704E-02 ppm1      0.671 ppm2      8.138 CV     1
 ASSI { 2266}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 47   and name HN  ))
      4.800     2.900     1.200 peak  2266 spectrum    1 weight  0.10000E+01 volume  0.69835E-03 ppm1      0.673 ppm2      7.930 CV     1
 ASSI { 2267}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 52   and name HN  ))
      4.600     2.600     1.400 peak  2267 spectrum    1 weight  0.10000E+01 volume  0.29362E-03 ppm1      0.673 ppm2      7.138 CV     1
 ASSI { 2269}
   (  segid "    " and resid 48   and name HD1%)
   (( segid "    " and resid 48   and name HG  ))
      2.200     0.600     0.600 peak  2269 spectrum    1 weight  0.10000E+01 volume  0.81037E-02 ppm1      0.671 ppm2      1.814 CV     1
 ASSI { 2272}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 37   and name HN  ))
      3.100     1.200     1.200 peak  2272 spectrum    1 weight  0.10000E+01 volume  0.11844E-02 ppm1      0.701 ppm2      7.876 CV     1
 ASSI { 2279}
   (( segid "    " and resid 49   and name HB2 ))
   (( segid "    " and resid 46   and name HA  ))
      2.900     1.100     1.100 peak  2279 spectrum    1 weight  0.10000E+01 volume  0.18499E-02 ppm1      2.081 ppm2      4.237 CV     1
 OR { 2279}
   (( segid "    " and resid 49   and name HB1 ))
   (( segid "    " and resid 46   and name HA  ))
 ASSI { 2280}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HN  ))
      3.500     1.600     1.600 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.11931E-02 ppm1      1.779 ppm2      8.483 CV     1
 ASSI { 2281}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HN  ))
      3.900     1.900     1.900 peak  2281 spectrum    1 weight  0.10000E+01 volume  0.91142E-03 ppm1      1.603 ppm2      8.485 CV     1
 ASSI { 2286}
   (( segid "    " and resid 50   and name HD1 ))
   (( segid "    " and resid 50   and name HG2 ))
      2.500     0.800     0.800 peak  2286 spectrum    1 weight  0.10000E+01 volume  0.36709E-02 ppm1      3.182 ppm2      1.611 CV     1
 OR { 2286}
   (( segid "    " and resid 50   and name HD2 ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI { 2288}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      2.000     0.500     0.500 peak  2288 spectrum    1 weight  0.10000E+01 volume  0.13402E-01 ppm1      4.499 ppm2      7.634 CV     1
 ASSI { 2290}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      2.500     0.800     0.800 peak  2290 spectrum    1 weight  0.10000E+01 volume  0.52021E-02 ppm1      4.499 ppm2      3.002 CV     1
 ASSI { 2291}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.700     0.900     0.900 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.47552E-02 ppm1      4.499 ppm2      2.530 CV     1
 ASSI { 2298}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HN  ))
      3.500     1.500     1.500 peak  2298 spectrum    1 weight  0.10000E+01 volume  0.18964E-02 ppm1      2.999 ppm2      7.632 CV     1
 ASSI { 2299}
   (( segid "    " and resid 53   and name HB2 ))
   (( segid "    " and resid 53   and name HN  ))
      3.100     1.200     1.200 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.22483E-02 ppm1      2.528 ppm2      7.634 CV     1
 ASSI { 2300}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HD1%)
      2.600     0.800     0.800 peak  2300 spectrum    1 weight  0.10000E+01 volume  0.36250E-02 ppm1      4.585 ppm2      0.845 CV     1
 OR { 2300}
   (( segid "    " and resid 54   and name HA  ))
   (  segid "    " and resid 54   and name HD2%)
 ASSI { 2301}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HN  ))
      3.700     1.700     1.700 peak  2301 spectrum    1 weight  0.10000E+01 volume  0.18859E-02 ppm1      1.350 ppm2      7.632 CV     1
 ASSI { 2302}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HN  ))
      2.400     0.700     0.700 peak  2302 spectrum    1 weight  0.10000E+01 volume  0.21364E-02 ppm1      1.271 ppm2      7.633 CV     1
 ASSI { 2303}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 55   and name HN  ))
      3.800     1.800     1.800 peak  2303 spectrum    1 weight  0.10000E+01 volume  0.56904E-03 ppm1      1.352 ppm2      8.541 CV     1
 ASSI { 2304}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name HN  ))
      4.400     2.400     1.600 peak  2304 spectrum    1 weight  0.10000E+01 volume  0.66901E-03 ppm1      1.273 ppm2      8.543 CV     1
 ASSI { 2305}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      2.900     1.100     1.100 peak  2305 spectrum    1 weight  0.10000E+01 volume  0.18747E-02 ppm1      1.272 ppm2      4.587 CV     1
 ASSI { 2306}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HA  ))
      2.700     0.900     0.900 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.18106E-02 ppm1      1.352 ppm2      4.587 CV     1
 ASSI { 2308}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 52   and name HB1 ))
      3.400     1.400     1.400 peak  2308 spectrum    1 weight  0.10000E+01 volume  0.51574E-03 ppm1      1.271 ppm2      3.415 CV     1
 ASSI { 2310}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 52   and name HB2 ))
      3.600     1.600     1.600 peak  2310 spectrum    1 weight  0.10000E+01 volume  0.45615E-03 ppm1      1.275 ppm2      3.044 CV     1
 ASSI { 2312}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 48   and name HB1 ))
      3.400     1.400     1.400 peak  2312 spectrum    1 weight  0.10000E+01 volume  0.31107E-03 ppm1      1.274 ppm2      2.037 CV     1
 ASSI { 2313}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 48   and name HG  ))
      4.600     2.700     1.400 peak  2313 spectrum    1 weight  0.10000E+01 volume  0.34862E-03 ppm1      1.271 ppm2      1.821 CV     1
 ASSI { 2314}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 48   and name HG  ))
      4.200     2.200     1.800 peak  2314 spectrum    1 weight  0.10000E+01 volume  0.49298E-03 ppm1      1.355 ppm2      1.817 CV     1
 ASSI { 2316}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 48   and name HB2 ))
      4.500     2.500     1.500 peak  2316 spectrum    1 weight  0.10000E+01 volume  0.56925E-03 ppm1      1.272 ppm2      1.588 CV     1
 ASSI { 2317}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 49   and name HA  ))
      4.600     2.700     1.400 peak  2317 spectrum    1 weight  0.10000E+01 volume  0.26036E-03 ppm1      1.359 ppm2      3.837 CV     1
 ASSI { 2318}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
      4.200     2.200     1.800 peak  2318 spectrum    1 weight  0.10000E+01 volume  0.34157E-03 ppm1      1.272 ppm2      3.840 CV     1
 ASSI { 2319}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 48   and name HD1%)
      3.900     1.900     1.900 peak  2319 spectrum    1 weight  0.10000E+01 volume  0.49844E-03 ppm1      1.358 ppm2      0.699 CV     1
 ASSI { 2320}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 48   and name HD1%)
      3.500     1.500     1.500 peak  2320 spectrum    1 weight  0.10000E+01 volume  0.63161E-03 ppm1      1.271 ppm2      0.691 CV     1
 ASSI { 2321}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 54   and name HD2%)
      2.700     0.900     0.900 peak  2321 spectrum    1 weight  0.10000E+01 volume  0.45420E-02 ppm1      1.353 ppm2      0.849 CV     1
 OR { 2321}
   (( segid "    " and resid 54   and name HB1 ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 2322}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 54   and name HD2%)
      2.400     0.700     0.700 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.50237E-02 ppm1      1.271 ppm2      0.848 CV     1
 OR { 2322}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 54   and name HD1%)
 ASSI { 2327}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 48   and name HB2 ))
      5.100     3.200     0.900 peak  2327 spectrum    1 weight  0.10000E+01 volume  0.24439E-03 ppm1      1.354 ppm2      1.588 CV     1
 ASSI { 2328}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 48   and name HB1 ))
      3.300     1.300     1.300 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.45186E-03 ppm1      1.353 ppm2      2.042 CV     1
 ASSI { 2331}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.100     0.500     0.500 peak  2331 spectrum    1 weight  0.10000E+01 volume  0.71454E-02 ppm1      4.585 ppm2      8.546 CV     1
 ASSI { 2333}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HA  ))
      2.800     0.900     0.900 peak  2333 spectrum    1 weight  0.10000E+01 volume  0.20186E-02 ppm1      0.839 ppm2      4.587 CV     1
 ASSI { 2334}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 52   and name HB1 ))
      3.700     1.700     1.700 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.27818E-03 ppm1      0.838 ppm2      3.423 CV     1
 ASSI { 2335}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 52   and name HB2 ))
      4.900     2.900     1.100 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.24144E-03 ppm1      0.837 ppm2      3.033 CV     1
 ASSI { 2336}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 51   and name HB2 ))
      2.100     2.100     3.900 peak  2336 spectrum    1 weight  0.10000E+01 volume  0.30570E-02 ppm1      0.841 ppm2      1.819 CV     1
 ASSI { 2337}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 48   and name HB1 ))
      4.500     2.600     1.500 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.48425E-03 ppm1      0.844 ppm2      2.029 CV     1
 ASSI { 2339}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HB1 ))
      3.200     1.300     1.300 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.27972E-02 ppm1      0.841 ppm2      1.361 CV     1
 ASSI { 2340}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HB2 ))
      3.000     1.100     1.100 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.13398E-02 ppm1      0.841 ppm2      1.268 CV     1
 ASSI { 2341}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 55   and name HN  ))
      4.800     2.800     1.200 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.75122E-03 ppm1      0.839 ppm2      8.548 CV     1
 ASSI { 2344}
   (( segid "    " and resid 54   and name HG  ))
   (  segid "    " and resid 56   and name HD2%)
      2.800     1.000     1.000 peak  2344 spectrum    1 weight  0.10000E+01 volume  0.30780E-02 ppm1      1.379 ppm2      0.848 CV     1
 ASSI { 2345}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 54   and name HN  ))
      4.300     2.400     1.700 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.79628E-03 ppm1      1.377 ppm2      7.632 CV     1
 ASSI { 2346}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 55   and name HN  ))
      4.800     2.900     1.200 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.35546E-03 ppm1      1.380 ppm2      8.547 CV     1
 ASSI { 2347}
   (( segid "    " and resid 54   and name HG  ))
   (( segid "    " and resid 54   and name HA  ))
      3.500     1.500     1.500 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.47936E-03 ppm1      1.384 ppm2      4.592 CV     1
 ASSI { 2369}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 57   and name HG1 ))
      3.800     1.800     1.800 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.94648E-03 ppm1      3.990 ppm2      2.088 CV     1
 ASSI { 2370}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB  ))
      3.000     1.100     1.100 peak  2370 spectrum    1 weight  0.10000E+01 volume  0.16599E-02 ppm1      3.993 ppm2      1.942 CV     1
 ASSI { 2371}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HB1 ))
      5.000     3.100     1.000 peak  2371 spectrum    1 weight  0.10000E+01 volume  0.70024E-03 ppm1      3.993 ppm2      1.387 CV     1
 ASSI { 2378}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 54   and name HA  ))
      4.600     2.700     1.400 peak  2378 spectrum    1 weight  0.10000E+01 volume  0.80881E-03 ppm1      1.939 ppm2      4.587 CV     1
 ASSI { 2379}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.200     0.600     0.600 peak  2379 spectrum    1 weight  0.10000E+01 volume  0.65281E-02 ppm1      3.991 ppm2      8.239 CV     1
 ASSI { 2380}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.900     1.100     1.100 peak  2380 spectrum    1 weight  0.10000E+01 volume  0.14270E-02 ppm1      3.991 ppm2      8.543 CV     1
 ASSI { 2381}
   (( segid "    " and resid 55   and name HB  ))
   (( segid "    " and resid 56   and name HN  ))
      4.700     2.700     1.300 peak  2381 spectrum    1 weight  0.10000E+01 volume  0.34910E-03 ppm1      1.938 ppm2      8.240 CV     1
 ASSI { 2382}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 56   and name HB1 ))
      5.600     4.000     0.400 peak  2382 spectrum    1 weight  0.10000E+01 volume  0.19339E-03 ppm1      0.750 ppm2      1.390 CV     1
 ASSI { 2383}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 53   and name HA  ))
      2.900     2.900     3.100 peak  2383 spectrum    1 weight  0.10000E+01 volume  0.44415E-03 ppm1      0.797 ppm2      4.500 CV     1
 ASSI { 2385}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 57   and name HD1 ))
      4.600     2.600     1.400 peak  2385 spectrum    1 weight  0.10000E+01 volume  0.27754E-03 ppm1      3.995 ppm2      3.849 CV     1
 ASSI { 2387}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 57   and name HG2 ))
      4.300     2.300     1.700 peak  2387 spectrum    1 weight  0.10000E+01 volume  0.11086E-02 ppm1      1.381 ppm2      1.924 CV     1
 OR { 2387}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 2388}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name HB2 ))
      4.800     2.900     1.200 peak  2388 spectrum    1 weight  0.10000E+01 volume  0.71445E-03 ppm1      1.341 ppm2      1.927 CV     1
 OR { 2388}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 57   and name HG2 ))
 ASSI { 2389}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 57   and name HG1 ))
      4.900     3.000     1.100 peak  2389 spectrum    1 weight  0.10000E+01 volume  0.69457E-03 ppm1      1.386 ppm2      2.088 CV     1
 ASSI { 2390}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 57   and name HD2 ))
      3.900     1.900     1.900 peak  2390 spectrum    1 weight  0.10000E+01 volume  0.85785E-03 ppm1      1.383 ppm2      3.548 CV     1
 ASSI { 2394}
   (( segid "    " and resid 56   and name HB1 ))
   (( segid "    " and resid 56   and name HA  ))
      2.600     0.800     0.800 peak  2394 spectrum    1 weight  0.10000E+01 volume  0.12738E-02 ppm1      1.389 ppm2      4.919 CV     1
 ASSI { 2399}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HG2 ))
      4.400     2.400     1.600 peak  2399 spectrum    1 weight  0.10000E+01 volume  0.10306E-02 ppm1      4.916 ppm2      1.933 CV     1
 OR { 2399}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 57   and name HB2 ))
 ASSI { 2400}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HB2 ))
      3.100     1.200     1.200 peak  2400 spectrum    1 weight  0.10000E+01 volume  0.16020E-02 ppm1      4.916 ppm2      1.349 CV     1
 ASSI { 2401}
   (( segid "    " and resid 56   and name HA  ))
   (  segid "    " and resid 56   and name HD1%)
      3.800     1.800     1.800 peak  2401 spectrum    1 weight  0.10000E+01 volume  0.12674E-02 ppm1      4.919 ppm2      0.752 CV     1
 ASSI { 2403}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 56   and name HN  ))
      2.900     1.000     1.000 peak  2403 spectrum    1 weight  0.10000E+01 volume  0.12238E-02 ppm1      4.919 ppm2      8.238 CV     1
 ASSI { 2404}
   (( segid "    " and resid 56   and name HB2 ))
   (( segid "    " and resid 56   and name HN  ))
      2.900     1.000     1.000 peak  2404 spectrum    1 weight  0.10000E+01 volume  0.11089E-02 ppm1      1.337 ppm2      8.239 CV     1
 ASSI { 2405}
   (( segid "    " and resid 56   and name HB1 ))
   (  segid "    " and resid 56   and name HD1%)
      2.900     1.000     1.000 peak  2405 spectrum    1 weight  0.10000E+01 volume  0.17100E-02 ppm1      1.392 ppm2      0.743 CV     1
 ASSI { 2406}
   (( segid "    " and resid 56   and name HB2 ))
   (  segid "    " and resid 56   and name HD1%)
      3.100     1.200     1.200 peak  2406 spectrum    1 weight  0.10000E+01 volume  0.13143E-02 ppm1      1.343 ppm2      0.741 CV     1
 ASSI { 2408}
   (( segid "    " and resid 56   and name HG  ))
   (( segid "    " and resid 56   and name HA  ))
      3.400     1.400     1.400 peak  2408 spectrum    1 weight  0.10000E+01 volume  0.92243E-03 ppm1      1.437 ppm2      4.917 CV     1
 ASSI { 2410}
   (( segid "    " and resid 56   and name HG  ))
   (( segid "    " and resid 56   and name HN  ))
      3.200     1.200     1.200 peak  2410 spectrum    1 weight  0.10000E+01 volume  0.81073E-03 ppm1      1.444 ppm2      8.239 CV     1
 ASSI { 2415}
   (  segid "    " and resid 56   and name HD2%)
   (( segid "    " and resid 56   and name HA  ))
      2.300     0.600     0.600 peak  2415 spectrum    1 weight  0.10000E+01 volume  0.55324E-02 ppm1      0.843 ppm2      4.915 CV     1
 ASSI { 2420}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 64   and name HN  ))
      5.300     3.500     0.700 peak  2420 spectrum    1 weight  0.10000E+01 volume  0.41493E-03 ppm1      0.853 ppm2      7.386 CV     1
 ASSI { 2421}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      3.200     1.300     1.300 peak  2421 spectrum    1 weight  0.10000E+01 volume  0.15798E-02 ppm1      0.845 ppm2      7.163 CV     1
 ASSI { 2422}
   (  segid "    " and resid 56   and name HD2%)
   (( segid "    " and resid 56   and name HN  ))
      3.400     1.400     1.400 peak  2422 spectrum    1 weight  0.10000E+01 volume  0.12793E-02 ppm1      0.845 ppm2      8.239 CV     1
 ASSI { 2424}
   (  segid "    " and resid 56   and name HD2%)
   (( segid "    " and resid 55   and name HN  ))
      3.600     1.600     1.600 peak  2424 spectrum    1 weight  0.10000E+01 volume  0.62480E-03 ppm1      0.845 ppm2      8.550 CV     1
 ASSI { 2426}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
      2.300     0.700     0.700 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.59544E-02 ppm1      0.845 ppm2      7.892 CV     1
 ASSI { 2429}
   (  segid "    " and resid 56   and name HD2%)
   (( segid "    " and resid 55   and name HB  ))
      2.700     2.700     3.300 peak  2429 spectrum    1 weight  0.10000E+01 volume  0.40504E-02 ppm1      0.844 ppm2      1.934 CV     1
 ASSI { 2431}
   (  segid "    " and resid 56   and name HD2%)
   (( segid "    " and resid 54   and name HA  ))
      4.000     2.000     2.000 peak  2431 spectrum    1 weight  0.10000E+01 volume  0.51328E-03 ppm1      0.846 ppm2      4.595 CV     1
 ASSI { 2433}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
      2.200     0.600     0.600 peak  2433 spectrum    1 weight  0.10000E+01 volume  0.43167E-02 ppm1      3.693 ppm2      2.198 CV     1
 ASSI { 2434}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HB  ))
      2.600     0.900     0.900 peak  2434 spectrum    1 weight  0.10000E+01 volume  0.31269E-02 ppm1      3.692 ppm2      1.895 CV     1
 ASSI { 2437}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 58   and name HG2%)
      2.500     0.800     0.800 peak  2437 spectrum    1 weight  0.10000E+01 volume  0.38938E-02 ppm1      3.693 ppm2      0.863 CV     1
 ASSI { 2438}
   (( segid "    " and resid 58   and name HA  ))
   (  segid "    " and resid 58   and name HD1%)
      2.600     0.900     0.900 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.54676E-02 ppm1      3.692 ppm2      0.795 CV     1
 ASSI { 2439}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HN  ))
      3.500     1.500     1.500 peak  2439 spectrum    1 weight  0.10000E+01 volume  0.34886E-03 ppm1      3.690 ppm2      8.947 CV     1
 ASSI { 2440}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HN  ))
      3.200     1.300     1.300 peak  2440 spectrum    1 weight  0.10000E+01 volume  0.57411E-03 ppm1      3.694 ppm2      8.588 CV     1
 ASSI { 2441}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      2.800     1.000     1.000 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.18083E-02 ppm1      3.693 ppm2      7.891 CV     1
 ASSI { 2442}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      3.600     1.600     1.600 peak  2442 spectrum    1 weight  0.10000E+01 volume  0.48746E-03 ppm1      3.691 ppm2      7.823 CV     1
 ASSI { 2443}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      3.700     1.700     1.700 peak  2443 spectrum    1 weight  0.10000E+01 volume  0.55995E-03 ppm1      3.691 ppm2      7.164 CV     1
 ASSI { 2447}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 59   and name HD2 ))
      3.200     1.300     1.300 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.83992E-03 ppm1      1.890 ppm2      3.155 CV     1
 OR { 2447}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 59   and name HD1 ))
 ASSI { 2448}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 58   and name HN  ))
      2.800     1.000     1.000 peak  2448 spectrum    1 weight  0.10000E+01 volume  0.11681E-02 ppm1      1.894 ppm2      8.947 CV     1
 ASSI { 2449}
   (( segid "    " and resid 58   and name HB  ))
   (( segid "    " and resid 59   and name HN  ))
      2.800     1.000     1.000 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.13633E-02 ppm1      1.893 ppm2      8.588 CV     1
 ASSI { 2454}
   (( segid "    " and resid 58   and name HB  ))
   (  segid "    " and resid 58   and name HD1%)
      2.900     1.000     1.000 peak  2454 spectrum    1 weight  0.10000E+01 volume  0.23498E-02 ppm1      1.894 ppm2      0.790 CV     1
 ASSI { 2456}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
      5.100     3.200     0.900 peak  2456 spectrum    1 weight  0.10000E+01 volume  0.29060E-03 ppm1      3.694 ppm2      3.401 CV     1
 ASSI { 2457}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HD2 ))
      4.000     2.000     2.000 peak  2457 spectrum    1 weight  0.10000E+01 volume  0.88269E-03 ppm1      3.694 ppm2      3.152 CV     1
 OR { 2457}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 59   and name HD1 ))
 ASSI { 2478}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 59   and name HD2 ))
      3.300     1.400     1.400 peak  2478 spectrum    1 weight  0.10000E+01 volume  0.22967E-02 ppm1      0.879 ppm2      3.156 CV     1
 OR { 2478}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 59   and name HD1 ))
 ASSI { 2479}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 62   and name HD2 ))
      2.900     1.000     1.000 peak  2479 spectrum    1 weight  0.10000E+01 volume  0.11546E-02 ppm1      0.878 ppm2      3.060 CV     1
 ASSI { 2480}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 57   and name HB1 ))
      5.400     3.600     0.600 peak  2480 spectrum    1 weight  0.10000E+01 volume  0.41514E-03 ppm1      0.878 ppm2      2.401 CV     1
 ASSI { 2481}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 63   and name HE22))
      4.400     2.400     1.600 peak  2481 spectrum    1 weight  0.10000E+01 volume  0.36958E-03 ppm1      0.879 ppm2      7.382 CV     1
 ASSI { 2482}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      4.700     2.800     1.300 peak  2482 spectrum    1 weight  0.10000E+01 volume  0.29351E-03 ppm1      0.878 ppm2      7.164 CV     1
 ASSI { 2483}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 62   and name HN  ))
      3.700     1.700     1.700 peak  2483 spectrum    1 weight  0.10000E+01 volume  0.59205E-03 ppm1      0.878 ppm2      7.824 CV     1
 ASSI { 2484}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      4.200     2.200     1.800 peak  2484 spectrum    1 weight  0.10000E+01 volume  0.91010E-03 ppm1      0.878 ppm2      8.947 CV     1
 ASSI { 2485}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 59   and name HN  ))
      2.900     1.000     1.000 peak  2485 spectrum    1 weight  0.10000E+01 volume  0.25923E-02 ppm1      0.879 ppm2      8.589 CV     1
 ASSI { 2486}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 58   and name HB  ))
      2.300     0.600     0.600 peak  2486 spectrum    1 weight  0.10000E+01 volume  0.54805E-02 ppm1      0.881 ppm2      1.895 CV     1
 ASSI { 2487}
   (  segid "    " and resid 58   and name HG2%)
   (  segid "    " and resid 58   and name HD1%)
      4.100     2.100     1.900 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.97297E-03 ppm1      0.881 ppm2      0.786 CV     1
 ASSI { 2490}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
      2.400     0.700     0.700 peak  2490 spectrum    1 weight  0.10000E+01 volume  0.36637E-02 ppm1      4.186 ppm2      2.090 CV     1
 ASSI { 2491}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG2 ))
      2.600     0.800     0.800 peak  2491 spectrum    1 weight  0.10000E+01 volume  0.41190E-02 ppm1      4.184 ppm2      2.234 CV     1
 OR { 2491}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HG1 ))
 ASSI { 2492}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 63   and name HE21))
      3.000     1.100     1.100 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.12797E-02 ppm1      4.186 ppm2      6.837 CV     1
 ASSI { 2493}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HN  ))
      2.800     1.000     1.000 peak  2493 spectrum    1 weight  0.10000E+01 volume  0.18754E-02 ppm1      4.187 ppm2      7.164 CV     1
 ASSI { 2494}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
      3.100     1.200     1.200 peak  2494 spectrum    1 weight  0.10000E+01 volume  0.20241E-02 ppm1      1.913 ppm2      4.202 CV     1
 ASSI { 2495}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 57   and name HD2 ))
      2.800     1.000     1.000 peak  2495 spectrum    1 weight  0.10000E+01 volume  0.10221E-02 ppm1      1.913 ppm2      3.547 CV     1
 ASSI { 2496}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 57   and name HD1 ))
      3.800     1.900     1.900 peak  2496 spectrum    1 weight  0.10000E+01 volume  0.79703E-03 ppm1      1.910 ppm2      3.825 CV     1
 ASSI { 2497}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      2.400     0.700     0.700 peak  2497 spectrum    1 weight  0.10000E+01 volume  0.27268E-02 ppm1      1.915 ppm2      7.161 CV     1
 ASSI { 2498}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 56   and name HA  ))
      5.000     3.100     1.000 peak  2498 spectrum    1 weight  0.10000E+01 volume  0.27130E-03 ppm1      2.088 ppm2      4.915 CV     1
 ASSI { 2499}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 56   and name HA  ))
      3.800     1.800     1.800 peak  2499 spectrum    1 weight  0.10000E+01 volume  0.26068E-03 ppm1      1.910 ppm2      4.914 CV     1
 ASSI { 2500}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.700     2.800     1.300 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.91016E-03 ppm1      2.087 ppm2      1.345 CV     1
 ASSI { 2501}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 56   and name HB2 ))
      4.200     2.200     1.800 peak  2501 spectrum    1 weight  0.10000E+01 volume  0.93227E-03 ppm1      1.914 ppm2      1.345 CV     1
 ASSI { 2502}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
      2.800     1.000     1.000 peak  2502 spectrum    1 weight  0.10000E+01 volume  0.18788E-02 ppm1      1.917 ppm2      0.852 CV     1
 ASSI { 2503}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HN  ))
      3.400     1.500     1.500 peak  2503 spectrum    1 weight  0.10000E+01 volume  0.20101E-02 ppm1      2.087 ppm2      7.164 CV     1
 ASSI { 2504}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      3.300     1.300     1.300 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.96460E-03 ppm1      4.186 ppm2      7.893 CV     1
 ASSI { 2505}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      3.400     1.400     1.400 peak  2505 spectrum    1 weight  0.10000E+01 volume  0.99001E-03 ppm1      1.915 ppm2      7.891 CV     1
 ASSI { 2510}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
      3.000     1.100     1.100 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.13202E-02 ppm1      3.398 ppm2      2.199 CV     1
 ASSI { 2511}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 64   and name HG  ))
      2.300     0.700     0.700 peak  2511 spectrum    1 weight  0.10000E+01 volume  0.32492E-02 ppm1      3.397 ppm2      2.022 CV     1
 ASSI { 2512}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name HB2 ))
      3.800     1.800     1.800 peak  2512 spectrum    1 weight  0.10000E+01 volume  0.51622E-03 ppm1      3.398 ppm2      1.926 CV     1
 ASSI { 2513}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HB1 ))
      5.000     3.200     1.000 peak  2513 spectrum    1 weight  0.10000E+01 volume  0.30099E-03 ppm1      3.399 ppm2      1.845 CV     1
 ASSI { 2514}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 61   and name HG1%)
      2.200     0.600     0.600 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.85722E-02 ppm1      3.397 ppm2      0.803 CV     1
 ASSI { 2515}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      4.800     2.800     1.200 peak  2515 spectrum    1 weight  0.10000E+01 volume  0.39316E-03 ppm1      3.398 ppm2      1.126 CV     1
 ASSI { 2516}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      4.100     2.100     1.900 peak  2516 spectrum    1 weight  0.10000E+01 volume  0.20768E-03 ppm1      3.397 ppm2      6.840 CV     1
 ASSI { 2517}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 63   and name HE22))
      3.800     1.800     1.800 peak  2517 spectrum    1 weight  0.10000E+01 volume  0.85707E-03 ppm1      3.397 ppm2      7.391 CV     1
 ASSI { 2518}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      2.700     0.900     0.900 peak  2518 spectrum    1 weight  0.10000E+01 volume  0.16638E-02 ppm1      3.398 ppm2      7.889 CV     1
 ASSI { 2519}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      3.800     1.800     1.800 peak  2519 spectrum    1 weight  0.10000E+01 volume  0.40984E-03 ppm1      3.397 ppm2      7.823 CV     1
 ASSI { 2522}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 60   and name HN  ))
      4.300     2.300     1.700 peak  2522 spectrum    1 weight  0.10000E+01 volume  0.55590E-03 ppm1      2.195 ppm2      7.162 CV     1
 ASSI { 2523}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HN  ))
      2.300     0.700     0.700 peak  2523 spectrum    1 weight  0.10000E+01 volume  0.30897E-02 ppm1      2.194 ppm2      7.892 CV     1
 ASSI { 2524}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
      2.800     1.000     1.000 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.19796E-02 ppm1      2.193 ppm2      7.827 CV     1
 ASSI { 2525}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 61   and name HG2%)
      2.100     0.600     0.600 peak  2525 spectrum    1 weight  0.10000E+01 volume  0.78773E-02 ppm1      2.193 ppm2      0.829 CV     1
 ASSI { 2527}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 41   and name HA2 ))
      2.900     1.100     1.100 peak  2527 spectrum    1 weight  0.10000E+01 volume  0.11632E-02 ppm1      0.811 ppm2      3.489 CV     1
 ASSI { 2528}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 41   and name HA1 ))
      3.800     1.800     1.800 peak  2528 spectrum    1 weight  0.10000E+01 volume  0.10300E-02 ppm1      0.812 ppm2      3.797 CV     1
 ASSI { 2529}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 58   and name HA  ))
      3.600     1.600     1.600 peak  2529 spectrum    1 weight  0.10000E+01 volume  0.22410E-02 ppm1      0.810 ppm2      3.700 CV     1
 ASSI { 2530}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 61   and name HB  ))
      2.200     0.600     0.600 peak  2530 spectrum    1 weight  0.10000E+01 volume  0.51964E-02 ppm1      0.811 ppm2      2.196 CV     1
 ASSI { 2532}
   (  segid "    " and resid 61   and name HG1%)
   (( segid "    " and resid 62   and name HB1 ))
      3.800     1.800     1.800 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.13764E-02 ppm1      0.810 ppm2      1.872 CV     1
 ASSI { 2535}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
      2.400     0.700     0.700 peak  2535 spectrum    1 weight  0.10000E+01 volume  0.50204E-02 ppm1      0.845 ppm2      3.400 CV     1
 ASSI { 2536}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
      3.200     1.200     1.200 peak  2536 spectrum    1 weight  0.10000E+01 volume  0.31143E-02 ppm1      0.845 ppm2      3.697 CV     1
 ASSI { 2537}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 63   and name HN  ))
      5.200     3.400     0.800 peak  2537 spectrum    1 weight  0.10000E+01 volume  0.24886E-03 ppm1      0.847 ppm2      6.836 CV     1
 ASSI { 2543}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
      3.100     1.200     1.200 peak  2543 spectrum    1 weight  0.10000E+01 volume  0.33836E-02 ppm1      0.844 ppm2      2.089 CV     1
 ASSI { 2546}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 57   and name HD1 ))
      2.000     2.000     4.000 peak  2546 spectrum    1 weight  0.10000E+01 volume  0.43014E-02 ppm1      0.844 ppm2      3.830 CV     1
 ASSI { 2548}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HG1 ))
      2.600     0.800     0.800 peak  2548 spectrum    1 weight  0.10000E+01 volume  0.26750E-02 ppm1      3.703 ppm2      1.759 CV     1
 OR { 2548}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HB2 ))
 ASSI { 2549}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HG2 ))
      2.700     0.900     0.900 peak  2549 spectrum    1 weight  0.10000E+01 volume  0.20223E-02 ppm1      3.703 ppm2      1.476 CV     1
 ASSI { 2550}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 58   and name HG12))
      2.500     2.500     3.500 peak  2550 spectrum    1 weight  0.10000E+01 volume  0.10966E-02 ppm1      3.704 ppm2      1.383 CV     1
 ASSI { 2551}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 31   and name HB2 ))
      3.600     1.600     1.600 peak  2551 spectrum    1 weight  0.10000E+01 volume  0.64733E-03 ppm1      3.701 ppm2      1.287 CV     1
 ASSI { 2554}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      2.600     0.900     0.900 peak  2554 spectrum    1 weight  0.10000E+01 volume  0.19573E-02 ppm1      3.703 ppm2      7.824 CV     1
 ASSI { 2555}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HE22))
      4.600     2.700     1.400 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.42306E-03 ppm1      3.703 ppm2      7.392 CV     1
 ASSI { 2556}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 32   and name HN  ))
      3.300     1.400     1.400 peak  2556 spectrum    1 weight  0.10000E+01 volume  0.80020E-03 ppm1      3.704 ppm2      8.474 CV     1
 ASSI { 2559}
   (( segid "    " and resid 62   and name HB1 ))
   (  segid "    " and resid 32   and name HB% )
      3.500     1.500     1.500 peak  2559 spectrum    1 weight  0.10000E+01 volume  0.74718E-03 ppm1      1.864 ppm2      1.381 CV     1
 ASSI { 2563}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.400     1.400     1.400 peak  2563 spectrum    1 weight  0.10000E+01 volume  0.67366E-03 ppm1      1.859 ppm2      3.703 CV     1
 ASSI { 2569}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 62   and name HN  ))
      3.400     1.500     1.500 peak  2569 spectrum    1 weight  0.10000E+01 volume  0.70191E-03 ppm1      1.860 ppm2      7.825 CV     1
 ASSI { 2571}
   (( segid "    " and resid 62   and name HB1 ))
   (( segid "    " and resid 63   and name HN  ))
      3.900     1.900     1.900 peak  2571 spectrum    1 weight  0.10000E+01 volume  0.29243E-03 ppm1      1.863 ppm2      6.834 CV     1
 ASSI { 2575}
   (( segid "    " and resid 62   and name HB2 ))
   (  segid "    " and resid 36   and name HD2%)
      4.300     2.300     1.700 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.34691E-03 ppm1      1.766 ppm2      0.736 CV     1
 ASSI { 2576}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 63   and name HN  ))
      3.200     1.300     1.300 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.68125E-03 ppm1      3.705 ppm2      6.835 CV     1
 ASSI { 2577}
   (( segid "    " and resid 62   and name HD1 ))
   (( segid "    " and resid 62   and name HN  ))
      4.700     2.700     1.300 peak  2577 spectrum    1 weight  0.10000E+01 volume  0.57930E-03 ppm1      3.146 ppm2      7.827 CV     1
 ASSI { 2578}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HN  ))
      4.400     2.400     1.600 peak  2578 spectrum    1 weight  0.10000E+01 volume  0.52915E-03 ppm1      3.061 ppm2      7.826 CV     1
 ASSI { 2581}
   (( segid "    " and resid 62   and name HD2 ))
   (( segid "    " and resid 62   and name HA  ))
      5.100     3.200     0.900 peak  2581 spectrum    1 weight  0.10000E+01 volume  0.31676E-03 ppm1      3.061 ppm2      3.719 CV     1
 ASSI { 2583}
   (( segid "    " and resid 62   and name HD2 ))
   (  segid "    " and resid 32   and name HB% )
      4.800     2.900     1.200 peak  2583 spectrum    1 weight  0.10000E+01 volume  0.29796E-03 ppm1      3.066 ppm2      1.383 CV     1
 ASSI { 2585}
   (( segid "    " and resid 62   and name HD2 ))
   (  segid "    " and resid 36   and name HD2%)
      4.400     2.400     1.600 peak  2585 spectrum    1 weight  0.10000E+01 volume  0.41044E-03 ppm1      3.068 ppm2      0.735 CV     1
 ASSI { 2586}
   (( segid "    " and resid 62   and name HD1 ))
   (  segid "    " and resid 58   and name HG2%)
      4.100     2.100     1.900 peak  2586 spectrum    1 weight  0.10000E+01 volume  0.68599E-03 ppm1      3.143 ppm2      0.879 CV     1
 ASSI { 2589}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HA  ))
      3.000     1.100     1.100 peak  2589 spectrum    1 weight  0.10000E+01 volume  0.11016E-02 ppm1      1.748 ppm2      3.703 CV     1
 ASSI { 2591}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD1 ))
      3.500     1.500     1.500 peak  2591 spectrum    1 weight  0.10000E+01 volume  0.78665E-03 ppm1      1.749 ppm2      3.149 CV     1
 ASSI { 2592}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HD2 ))
      3.000     1.100     1.100 peak  2592 spectrum    1 weight  0.10000E+01 volume  0.82465E-03 ppm1      1.749 ppm2      3.058 CV     1
 ASSI { 2593}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD1 ))
      2.800     1.000     1.000 peak  2593 spectrum    1 weight  0.10000E+01 volume  0.91868E-03 ppm1      1.470 ppm2      3.152 CV     1
 ASSI { 2594}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HD2 ))
      3.500     1.500     1.500 peak  2594 spectrum    1 weight  0.10000E+01 volume  0.80839E-03 ppm1      1.476 ppm2      3.063 CV     1
 ASSI { 2595}
   (( segid "    " and resid 62   and name HG1 ))
   (( segid "    " and resid 62   and name HN  ))
      3.300     1.400     1.400 peak  2595 spectrum    1 weight  0.10000E+01 volume  0.13871E-02 ppm1      1.748 ppm2      7.826 CV     1
 ASSI { 2596}
   (( segid "    " and resid 62   and name HG2 ))
   (( segid "    " and resid 62   and name HN  ))
      3.800     1.800     1.800 peak  2596 spectrum    1 weight  0.10000E+01 volume  0.10859E-02 ppm1      1.474 ppm2      7.827 CV     1
 ASSI { 2597}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 65   and name HG2%)
      4.500     2.600     1.500 peak  2597 spectrum    1 weight  0.10000E+01 volume  0.18487E-03 ppm1      4.371 ppm2      0.968 CV     1
 ASSI { 2598}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 32   and name HB% )
      3.600     1.600     1.600 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.13512E-03 ppm1      4.377 ppm2      1.392 CV     1
 ASSI { 2599}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 64   and name HD2%)
      5.700     4.100     0.300 peak  2599 spectrum    1 weight  0.10000E+01 volume  0.14801E-03 ppm1      4.371 ppm2      0.789 CV     1
 OR { 2599}
   (( segid "    " and resid 63   and name HA  ))
   (  segid "    " and resid 64   and name HD1%)
 ASSI { 2602}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 65   and name HN  ))
      2.900     1.100     1.100 peak  2602 spectrum    1 weight  0.10000E+01 volume  0.72945E-03 ppm1      2.027 ppm2      6.391 CV     1
 ASSI { 2603}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 65   and name HN  ))
      3.500     1.500     1.500 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.13128E-02 ppm1      1.121 ppm2      6.392 CV     1
 ASSI { 2604}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
      3.200     1.300     1.300 peak  2604 spectrum    1 weight  0.10000E+01 volume  0.23747E-02 ppm1      2.026 ppm2      7.390 CV     1
 ASSI { 2605}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
      2.700     0.900     0.900 peak  2605 spectrum    1 weight  0.10000E+01 volume  0.13717E-02 ppm1      1.119 ppm2      7.389 CV     1
 ASSI { 2609}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 31   and name HB1 ))
      4.400     2.400     1.600 peak  2609 spectrum    1 weight  0.10000E+01 volume  0.12538E-02 ppm1      2.024 ppm2      1.881 CV     1
 ASSI { 2613}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 31   and name HB1 ))
      3.500     1.500     1.500 peak  2613 spectrum    1 weight  0.10000E+01 volume  0.10953E-02 ppm1      1.123 ppm2      1.880 CV     1
 ASSI { 2615}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 64   and name HD1%)
      2.500     0.800     0.800 peak  2615 spectrum    1 weight  0.10000E+01 volume  0.43326E-02 ppm1      1.118 ppm2      0.791 CV     1
 OR { 2615}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 64   and name HD2%)
 ASSI { 2617}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 61   and name HA  ))
      5.500     3.700     0.500 peak  2617 spectrum    1 weight  0.10000E+01 volume  0.31865E-03 ppm1      2.020 ppm2      3.403 CV     1
 ASSI { 2619}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      2.100     0.500     0.500 peak  2619 spectrum    1 weight  0.10000E+01 volume  0.55078E-02 ppm1      4.172 ppm2      6.391 CV     1
 ASSI { 2620}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HN  ))
      2.600     0.900     0.900 peak  2620 spectrum    1 weight  0.10000E+01 volume  0.18676E-02 ppm1      4.172 ppm2      7.387 CV     1
 ASSI { 2621}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 63   and name HE21))
      4.900     3.000     1.100 peak  2621 spectrum    1 weight  0.10000E+01 volume  0.26077E-03 ppm1      4.174 ppm2      6.838 CV     1
 ASSI { 2622}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 64   and name HD2%)
      2.100     0.500     0.500 peak  2622 spectrum    1 weight  0.10000E+01 volume  0.91388E-02 ppm1      4.171 ppm2      0.792 CV     1
 OR { 2622}
   (( segid "    " and resid 64   and name HA  ))
   (  segid "    " and resid 64   and name HD1%)
 ASSI { 2623}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.800     1.000     1.000 peak  2623 spectrum    1 weight  0.10000E+01 volume  0.23706E-02 ppm1      4.173 ppm2      1.123 CV     1
 ASSI { 2626}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 68   and name HD1 ))
      3.000     1.100     1.100 peak  2626 spectrum    1 weight  0.10000E+01 volume  0.88632E-03 ppm1      4.174 ppm2      1.697 CV     1
 OR { 2626}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 68   and name HD2 ))
 ASSI { 2628}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
      2.200     0.600     0.600 peak  2628 spectrum    1 weight  0.10000E+01 volume  0.32804E-02 ppm1      4.170 ppm2      2.024 CV     1
 ASSI { 2631}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 61   and name HA  ))
      3.200     1.300     1.300 peak  2631 spectrum    1 weight  0.10000E+01 volume  0.13049E-02 ppm1      0.789 ppm2      3.398 CV     1
 OR { 2631}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 2633}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 68   and name HD1 ))
      2.900     1.000     1.000 peak  2633 spectrum    1 weight  0.10000E+01 volume  0.23717E-02 ppm1      0.789 ppm2      1.701 CV     1
 OR { 2633}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 68   and name HD2 ))
 ASSI { 2635}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 64   and name HB1 ))
      2.100     0.500     0.500 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.83749E-02 ppm1      0.789 ppm2      2.023 CV     1
 OR { 2635}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 64   and name HB1 ))
 ASSI { 2637}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 68   and name HB1 ))
      2.700     0.900     0.900 peak  2637 spectrum    1 weight  0.10000E+01 volume  0.57543E-02 ppm1      0.789 ppm2      1.834 CV     1
 OR { 2637}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 2637}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 2640}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 64   and name HN  ))
      3.400     1.500     1.500 peak  2640 spectrum    1 weight  0.10000E+01 volume  0.20757E-02 ppm1      0.789 ppm2      7.391 CV     1
 OR { 2640}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 2641}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 65   and name HN  ))
      3.600     1.600     1.600 peak  2641 spectrum    1 weight  0.10000E+01 volume  0.20742E-02 ppm1      0.789 ppm2      6.391 CV     1
 OR { 2641}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 2642}
   (  segid "    " and resid 64   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
      4.300     2.300     1.700 peak  2642 spectrum    1 weight  0.10000E+01 volume  0.77309E-03 ppm1      0.788 ppm2      7.912 CV     1
 OR { 2642}
   (  segid "    " and resid 64   and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 2643}
   (( segid "    " and resid 64   and name HG  ))
   (( segid "    " and resid 64   and name HA  ))
      3.600     1.600     1.600 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.55707E-03 ppm1      2.018 ppm2      4.170 CV     1
 ASSI { 2646}
   (( segid "    " and resid 64   and name HG  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.800     1.000     1.000 peak  2646 spectrum    1 weight  0.10000E+01 volume  0.87363E-03 ppm1      2.021 ppm2      1.121 CV     1
 ASSI { 2647}
   (( segid "    " and resid 64   and name HG  ))
   (  segid "    " and resid 64   and name HD1%)
      1.900     0.400     0.400 peak  2647 spectrum    1 weight  0.10000E+01 volume  0.12201E-01 ppm1      2.020 ppm2      0.790 CV     1
 OR { 2647}
   (( segid "    " and resid 64   and name HG  ))
   (  segid "    " and resid 64   and name HD2%)
 ASSI { 2648}
   (( segid "    " and resid 64   and name HG  ))
   (( segid "    " and resid 64   and name HN  ))
      2.500     0.800     0.800 peak  2648 spectrum    1 weight  0.10000E+01 volume  0.13824E-02 ppm1      2.020 ppm2      7.392 CV     1
 ASSI { 2649}
   (  segid "    " and resid 66   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
      4.700     2.700     1.300 peak  2649 spectrum    1 weight  0.10000E+01 volume  0.42729E-03 ppm1      0.735 ppm2      7.902 CV     1
 ASSI { 2650}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 67   and name HA  ))
      4.200     2.200     1.800 peak  2650 spectrum    1 weight  0.10000E+01 volume  0.20986E-03 ppm1      2.988 ppm2      3.805 CV     1
 ASSI { 2652}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 68   and name HA  ))
      3.800     1.800     1.800 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.19257E-02 ppm1      1.698 ppm2      4.049 CV     1
 OR { 2652}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 68   and name HA  ))
 ASSI { 2653}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.800     2.900     1.200 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.54841E-03 ppm1      1.703 ppm2      2.126 CV     1
 OR { 2653}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI { 2657}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 65   and name HN  ))
      3.500     1.500     1.500 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.84606E-03 ppm1      1.696 ppm2      6.390 CV     1
 OR { 2657}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 2658}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 69   and name HN  ))
      3.700     1.700     1.700 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.76133E-03 ppm1      1.697 ppm2      7.913 CV     1
 ASSI { 2661}
   (( segid "    " and resid 68   and name HG1 ))
   (( segid "    " and resid 71   and name HB2 ))
      4.000     2.000     2.000 peak  2661 spectrum    1 weight  0.10000E+01 volume  0.39451E-03 ppm1      1.502 ppm2      2.130 CV     1
 OR { 2661}
   (( segid "    " and resid 68   and name HG2 ))
   (( segid "    " and resid 71   and name HB2 ))
 ASSI { 2663}
   (( segid "    " and resid 68   and name HG2 ))
   (  segid "    " and resid 64   and name HD2%)
      3.000     1.100     1.100 peak  2663 spectrum    1 weight  0.10000E+01 volume  0.27878E-02 ppm1      1.503 ppm2      0.794 CV     1
 OR { 2663}
   (( segid "    " and resid 68   and name HG1 ))
   (  segid "    " and resid 64   and name HD2%)
 ASSI { 2669}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 69   and name HN  ))
      4.800     2.900     1.200 peak  2669 spectrum    1 weight  0.10000E+01 volume  0.36661E-03 ppm1      2.929 ppm2      7.909 CV     1
 OR { 2669}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI { 2670}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 64   and name HA  ))
      4.700     2.800     1.300 peak  2670 spectrum    1 weight  0.10000E+01 volume  0.28254E-03 ppm1      2.920 ppm2      4.162 CV     1
 OR { 2670}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 64   and name HA  ))
 ASSI { 2671}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HB2 ))
      3.600     1.600     1.600 peak  2671 spectrum    1 weight  0.10000E+01 volume  0.12724E-02 ppm1      2.929 ppm2      1.837 CV     1
 OR { 2671}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HB1 ))
 OR { 2671}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HB2 ))
 OR { 2671}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 2672}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HG1 ))
      2.500     0.800     0.800 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.43320E-02 ppm1      2.931 ppm2      1.505 CV     1
 OR { 2672}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HG2 ))
 OR { 2672}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HG1 ))
 OR { 2672}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI { 2673}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HD1 ))
      2.200     0.600     0.600 peak  2673 spectrum    1 weight  0.10000E+01 volume  0.67972E-02 ppm1      2.927 ppm2      1.700 CV     1
 OR { 2673}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HD2 ))
 OR { 2673}
   (( segid "    " and resid 68   and name HE2 ))
   (( segid "    " and resid 68   and name HD1 ))
 OR { 2673}
   (( segid "    " and resid 68   and name HE1 ))
   (( segid "    " and resid 68   and name HD2 ))
 ASSI { 2674}
   (( segid "    " and resid 68   and name HE1 ))
   (  segid "    " and resid 64   and name HD2%)
      3.700     1.700     1.700 peak  2674 spectrum    1 weight  0.10000E+01 volume  0.97747E-03 ppm1      2.926 ppm2      0.807 CV     1
 OR { 2674}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 64   and name HD2%)
 ASSI { 2675}
   (( segid "    " and resid 68   and name HE2 ))
   (  segid "    " and resid 65   and name HG2%)
      2.700     2.700     3.300 peak  2675 spectrum    1 weight  0.10000E+01 volume  0.68569E-03 ppm1      2.929 ppm2      0.961 CV     1
 OR { 2675}
   (( segid "    " and resid 68   and name HE1 ))
   (  segid "    " and resid 65   and name HG2%)
 ASSI { 2677}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      2.700     0.900     0.900 peak  2677 spectrum    1 weight  0.10000E+01 volume  0.23526E-02 ppm1      4.044 ppm2      1.148 CV     1
 ASSI { 2678}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.300     0.700     0.700 peak  2678 spectrum    1 weight  0.10000E+01 volume  0.35609E-02 ppm1      4.043 ppm2      2.027 CV     1
 ASSI { 2679}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 69   and name HD1%)
      2.000     0.500     0.500 peak  2679 spectrum    1 weight  0.10000E+01 volume  0.83998E-02 ppm1      4.044 ppm2      0.811 CV     1
 ASSI { 2680}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 72   and name HN  ))
      3.300     1.300     1.300 peak  2680 spectrum    1 weight  0.10000E+01 volume  0.55872E-03 ppm1      4.048 ppm2      8.001 CV     1
 ASSI { 2681}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HN  ))
      2.600     0.900     0.900 peak  2681 spectrum    1 weight  0.10000E+01 volume  0.20186E-02 ppm1      4.045 ppm2      7.914 CV     1
 ASSI { 2682}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
      3.000     1.100     1.100 peak  2682 spectrum    1 weight  0.10000E+01 volume  0.11264E-02 ppm1      2.033 ppm2      8.326 CV     1
 ASSI { 2683}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
      2.400     0.700     0.700 peak  2683 spectrum    1 weight  0.10000E+01 volume  0.17838E-02 ppm1      1.144 ppm2      7.918 CV     1
 ASSI { 2684}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
      2.800     1.000     1.000 peak  2684 spectrum    1 weight  0.10000E+01 volume  0.81034E-03 ppm1      1.146 ppm2      8.325 CV     1
 ASSI { 2688}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 69   and name HG  ))
      2.700     0.900     0.900 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.99885E-03 ppm1      1.146 ppm2      1.858 CV     1
 ASSI { 2691}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HG  ))
      2.600     0.800     0.800 peak  2691 spectrum    1 weight  0.10000E+01 volume  0.13812E-02 ppm1      2.033 ppm2      1.859 CV     1
 ASSI { 2694}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 69   and name HD2%)
      2.200     0.600     0.600 peak  2694 spectrum    1 weight  0.10000E+01 volume  0.51106E-02 ppm1      1.147 ppm2      0.816 CV     1
 ASSI { 2696}
   (( segid "    " and resid 69   and name HG  ))
   (( segid "    " and resid 69   and name HA  ))
      3.500     1.500     1.500 peak  2696 spectrum    1 weight  0.10000E+01 volume  0.16899E-02 ppm1      1.856 ppm2      4.040 CV     1
 ASSI { 2697}
   (( segid "    " and resid 69   and name HG  ))
   (( segid "    " and resid 69   and name HN  ))
      3.600     1.600     1.600 peak  2697 spectrum    1 weight  0.10000E+01 volume  0.16280E-02 ppm1      1.857 ppm2      7.921 CV     1
 ASSI { 2699}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HN  ))
      3.500     1.500     1.500 peak  2699 spectrum    1 weight  0.10000E+01 volume  0.16189E-02 ppm1      2.037 ppm2      7.917 CV     1
 ASSI { 2701}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HA  ))
      2.300     0.700     0.700 peak  2701 spectrum    1 weight  0.10000E+01 volume  0.52318E-02 ppm1      0.816 ppm2      4.038 CV     1
 ASSI { 2702}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 67   and name HD1 ))
      4.000     2.000     2.000 peak  2702 spectrum    1 weight  0.10000E+01 volume  0.85122E-03 ppm1      0.816 ppm2      3.320 CV     1
 ASSI { 2703}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HG  ))
      1.900     0.400     0.400 peak  2703 spectrum    1 weight  0.10000E+01 volume  0.10401E-01 ppm1      0.816 ppm2      1.863 CV     1
 ASSI { 2704}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HB1 ))
      2.900     1.000     1.000 peak  2704 spectrum    1 weight  0.10000E+01 volume  0.48050E-02 ppm1      0.815 ppm2      2.027 CV     1
 ASSI { 2705}
   (  segid "    " and resid 69   and name HD2%)
   (  segid "    " and resid 13   and name HG2%)
      3.300     1.300     1.300 peak  2705 spectrum    1 weight  0.10000E+01 volume  0.24849E-02 ppm1      0.821 ppm2      0.989 CV     1
 ASSI { 2708}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
      2.300     0.700     0.700 peak  2708 spectrum    1 weight  0.10000E+01 volume  0.34949E-02 ppm1      0.816 ppm2      7.921 CV     1
 ASSI { 2709}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 70   and name HN  ))
      4.200     2.200     1.800 peak  2709 spectrum    1 weight  0.10000E+01 volume  0.70830E-03 ppm1      0.816 ppm2      8.322 CV     1
 ASSI { 2711}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 65   and name HN  ))
      4.000     2.000     2.000 peak  2711 spectrum    1 weight  0.10000E+01 volume  0.40411E-03 ppm1      0.818 ppm2      6.400 CV     1
 ASSI { 2713}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HG  ))
      2.100     0.600     0.600 peak  2713 spectrum    1 weight  0.10000E+01 volume  0.53275E-02 ppm1      0.810 ppm2      1.843 CV     1
 ASSI { 2714}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 70   and name HN  ))
      4.900     3.000     1.100 peak  2714 spectrum    1 weight  0.10000E+01 volume  0.37966E-03 ppm1      0.809 ppm2      8.325 CV     1
 ASSI { 2715}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
      3.800     1.800     1.800 peak  2715 spectrum    1 weight  0.10000E+01 volume  0.19206E-02 ppm1      0.810 ppm2      7.918 CV     1
 ASSI { 2716}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HB1 ))
      2.500     0.800     0.800 peak  2716 spectrum    1 weight  0.10000E+01 volume  0.27382E-02 ppm1      0.812 ppm2      2.029 CV     1
 ASSI { 2717}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      4.100     2.100     1.900 peak  2717 spectrum    1 weight  0.10000E+01 volume  0.21690E-03 ppm1      3.888 ppm2      2.041 CV     1
 ASSI { 2718}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      3.900     1.900     1.900 peak  2718 spectrum    1 weight  0.10000E+01 volume  0.45944E-03 ppm1      4.093 ppm2      8.551 CV     1
 ASSI { 2720}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 68   and name HG2 ))
      4.800     2.900     1.200 peak  2720 spectrum    1 weight  0.10000E+01 volume  0.46457E-03 ppm1      4.041 ppm2      1.508 CV     1
 OR { 2720}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI { 2723}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 71   and name HA  ))
      3.200     1.300     1.300 peak  2723 spectrum    1 weight  0.10000E+01 volume  0.20324E-02 ppm1      2.197 ppm2      4.039 CV     1
 ASSI { 2724}
   (( segid "    " and resid 71   and name HG2 ))
   (( segid "    " and resid 72   and name HN  ))
      3.300     1.400     1.400 peak  2724 spectrum    1 weight  0.10000E+01 volume  0.22915E-02 ppm1      2.199 ppm2      7.986 CV     1
 ASSI { 2725}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 72   and name HN  ))
      3.200     3.200     2.800 peak  2725 spectrum    1 weight  0.10000E+01 volume  0.30699E-02 ppm1      2.454 ppm2      7.985 CV     1
 ASSI { 2726}
   (( segid "    " and resid 71   and name HG1 ))
   (( segid "    " and resid 71   and name HA  ))
      2.900     1.000     1.000 peak  2726 spectrum    1 weight  0.10000E+01 volume  0.24638E-02 ppm1      2.455 ppm2      4.039 CV     1
 ASSI { 2728}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      5.000     3.100     1.000 peak  2728 spectrum    1 weight  0.10000E+01 volume  0.30450E-03 ppm1      4.036 ppm2      8.325 CV     1
 ASSI { 2731}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      3.500     1.600     1.600 peak  2731 spectrum    1 weight  0.10000E+01 volume  0.98089E-03 ppm1      4.101 ppm2      8.036 CV     1
 ASSI { 2732}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 13   and name HA  ))
      4.000     2.000     2.000 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.60617E-03 ppm1      1.473 ppm2      3.558 CV     1
 ASSI { 2733}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 15   and name HB1 ))
      4.300     2.300     1.700 peak  2733 spectrum    1 weight  0.10000E+01 volume  0.70125E-03 ppm1      1.474 ppm2      3.263 CV     1
 OR { 2733}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 15   and name HB2 ))
 ASSI { 2734}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 7    and name HD2 ))
      2.900     1.000     1.000 peak  2734 spectrum    1 weight  0.10000E+01 volume  0.10104E-02 ppm1      1.474 ppm2      3.118 CV     1
 ASSI { 2735}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 12   and name HA  ))
      2.200     0.600     0.600 peak  2735 spectrum    1 weight  0.10000E+01 volume  0.11408E-01 ppm1      1.473 ppm2      4.101 CV     1
 ASSI { 2736}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 9    and name HA  ))
      2.400     0.700     0.700 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.50339E-02 ppm1      1.473 ppm2      4.024 CV     1
 ASSI { 2737}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 12   and name HN  ))
      2.200     0.600     0.600 peak  2737 spectrum    1 weight  0.10000E+01 volume  0.89702E-02 ppm1      1.474 ppm2      8.151 CV     1
 ASSI { 2738}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 13   and name HN  ))
      2.700     0.900     0.900 peak  2738 spectrum    1 weight  0.10000E+01 volume  0.50591E-02 ppm1      1.474 ppm2      8.257 CV     1
 ASSI { 2739}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 10   and name HN  ))
      4.500     2.500     1.500 peak  2739 spectrum    1 weight  0.10000E+01 volume  0.29577E-03 ppm1      1.472 ppm2      7.900 CV     1
 ASSI { 2740}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 11   and name HN  ))
      3.800     1.800     1.800 peak  2740 spectrum    1 weight  0.10000E+01 volume  0.89768E-03 ppm1      1.475 ppm2      7.783 CV     1
 ASSI { 2741}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 14   and name HN  ))
      4.700     2.800     1.300 peak  2741 spectrum    1 weight  0.10000E+01 volume  0.72576E-03 ppm1      1.475 ppm2      8.819 CV     1
 ASSI { 2742}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      3.000     1.100     1.100 peak  2742 spectrum    1 weight  0.10000E+01 volume  0.15681E-02 ppm1      4.100 ppm2      8.153 CV     1
 ASSI { 2744}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
      5.000     3.100     1.000 peak  2744 spectrum    1 weight  0.10000E+01 volume  0.25205E-03 ppm1      4.103 ppm2      7.785 CV     1
 ASSI { 2745}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 11   and name HA  ))
      4.700     2.700     1.300 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.36430E-03 ppm1      1.474 ppm2      3.795 CV     1
 ASSI { 2751}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 7    and name HB2 ))
      2.500     2.500     3.500 peak  2751 spectrum    1 weight  0.10000E+01 volume  0.12243E-02 ppm1      1.473 ppm2      1.749 CV     1
 ASSI { 2752}
   (  segid "    " and resid 12   and name HB% )
   (  segid "    " and resid 9    and name HD1%)
      4.100     2.200     1.900 peak  2752 spectrum    1 weight  0.10000E+01 volume  0.84103E-03 ppm1      1.473 ppm2      0.578 CV     1
 ASSI { 2757}
   (  segid "    " and resid 12   and name HB% )
   (  segid "    " and resid 9    and name HD2%)
      3.300     1.400     1.400 peak  2757 spectrum    1 weight  0.10000E+01 volume  0.22795E-02 ppm1      1.474 ppm2      0.702 CV     1
 ASSI { 2761}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 15   and name HN  ))
      5.000     3.200     1.000 peak  2761 spectrum    1 weight  0.10000E+01 volume  0.27863E-03 ppm1      1.476 ppm2      8.044 CV     1
 ASSI { 2762}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 9    and name HN  ))
      5.200     3.400     0.800 peak  2762 spectrum    1 weight  0.10000E+01 volume  0.17167E-03 ppm1      1.475 ppm2      8.481 CV     1
 ASSI { 2763}
   (( segid "    " and resid 44   and name HB  ))
   (( segid "    " and resid 44   and name HA  ))
      2.900     1.100     1.100 peak  2763 spectrum    1 weight  0.10000E+01 volume  0.19783E-02 ppm1      1.979 ppm2      3.467 CV     1
 ASSI { 2767}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 48   and name HG  ))
      4.000     2.000     2.000 peak  2767 spectrum    1 weight  0.10000E+01 volume  0.79433E-03 ppm1      3.454 ppm2      1.808 CV     1
 ASSI { 2768}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 44   and name HG1%)
      2.400     0.700     0.700 peak  2768 spectrum    1 weight  0.10000E+01 volume  0.43122E-02 ppm1      3.454 ppm2      0.725 CV     1
 ASSI { 2769}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 44   and name HG2%)
      2.500     0.800     0.800 peak  2769 spectrum    1 weight  0.10000E+01 volume  0.49790E-02 ppm1      3.454 ppm2      0.991 CV     1
 ASSI { 2772}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      4.100     2.100     1.900 peak  2772 spectrum    1 weight  0.10000E+01 volume  0.50687E-03 ppm1      3.452 ppm2      8.118 CV     1
 ASSI { 2773}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      3.200     1.300     1.300 peak  2773 spectrum    1 weight  0.10000E+01 volume  0.10626E-02 ppm1      3.454 ppm2      7.948 CV     1
 ASSI { 2774}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.700     0.900     0.900 peak  2774 spectrum    1 weight  0.10000E+01 volume  0.24429E-02 ppm1      3.453 ppm2      8.414 CV     1
 ASSI { 2775}
   (( segid "    " and resid 44   and name HB  ))
   (( segid "    " and resid 44   and name HN  ))
      2.300     0.700     0.700 peak  2775 spectrum    1 weight  0.10000E+01 volume  0.54454E-02 ppm1      1.979 ppm2      8.414 CV     1
 ASSI { 2776}
   (( segid "    " and resid 44   and name HB  ))
   (( segid "    " and resid 45   and name HE  ))
      4.100     2.100     1.900 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.39337E-03 ppm1      1.983 ppm2      7.366 CV     1
 ASSI { 2777}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB  ))
      2.900     1.100     1.100 peak  2777 spectrum    1 weight  0.10000E+01 volume  0.20358E-02 ppm1      3.564 ppm2      2.258 CV     1
 ASSI { 2778}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      3.100     1.200     1.200 peak  2778 spectrum    1 weight  0.10000E+01 volume  0.20243E-02 ppm1      3.565 ppm2      2.102 CV     1
 ASSI { 2781}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 39   and name HA  ))
      2.800     1.000     1.000 peak  2781 spectrum    1 weight  0.10000E+01 volume  0.14123E-02 ppm1      2.256 ppm2      4.179 CV     1
 ASSI { 2782}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HN  ))
      2.100     0.500     0.500 peak  2782 spectrum    1 weight  0.10000E+01 volume  0.76757E-02 ppm1      2.257 ppm2      7.376 CV     1
 ASSI { 2783}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 44   and name HN  ))
      4.600     2.600     1.400 peak  2783 spectrum    1 weight  0.10000E+01 volume  0.37564E-03 ppm1      2.255 ppm2      8.409 CV     1
 ASSI { 2786}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      2.500     0.800     0.800 peak  2786 spectrum    1 weight  0.10000E+01 volume  0.32702E-02 ppm1      3.564 ppm2      7.378 CV     1
 ASSI { 2787}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      3.100     1.200     1.200 peak  2787 spectrum    1 weight  0.10000E+01 volume  0.15221E-02 ppm1      3.563 ppm2      8.413 CV     1
 ASSI { 2788}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG1%)
      2.200     0.600     0.600 peak  2788 spectrum    1 weight  0.10000E+01 volume  0.68641E-02 ppm1      2.258 ppm2      0.944 CV     1
 ASSI { 2790}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 42   and name HA  ))
      2.800     1.000     1.000 peak  2790 spectrum    1 weight  0.10000E+01 volume  0.27806E-02 ppm1      0.939 ppm2      3.565 CV     1
 ASSI { 2791}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 46   and name HG1 ))
      3.100     1.200     1.200 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.10998E-02 ppm1      0.938 ppm2      2.579 CV     1
 ASSI { 2792}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 43   and name HG1 ))
      4.200     2.200     1.800 peak  2792 spectrum    1 weight  0.10000E+01 volume  0.89313E-03 ppm1      0.937 ppm2      2.392 CV     1
 ASSI { 2794}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 43   and name HB2 ))
      4.100     2.100     1.900 peak  2794 spectrum    1 weight  0.10000E+01 volume  0.71946E-03 ppm1      0.939 ppm2      2.113 CV     1
 ASSI { 2795}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 43   and name HA  ))
      3.400     1.400     1.400 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.98140E-03 ppm1      0.938 ppm2      4.086 CV     1
 ASSI { 2796}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 42   and name HN  ))
      3.600     1.600     1.600 peak  2796 spectrum    1 weight  0.10000E+01 volume  0.25661E-02 ppm1      0.939 ppm2      7.371 CV     1
 ASSI { 2797}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 46   and name HE21))
      3.800     1.800     1.800 peak  2797 spectrum    1 weight  0.10000E+01 volume  0.47738E-03 ppm1      0.939 ppm2      6.846 CV     1
 ASSI { 2798}
   (  segid "    " and resid 42   and name HG1%)
   (( segid "    " and resid 39   and name HG  ))
      4.700     2.800     1.300 peak  2798 spectrum    1 weight  0.10000E+01 volume  0.24856E-03 ppm1      0.941 ppm2      1.660 CV     1
 ASSI { 2799}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HB  ))
      2.100     0.500     0.500 peak  2799 spectrum    1 weight  0.10000E+01 volume  0.10253E-01 ppm1      1.138 ppm2      2.258 CV     1
 ASSI { 2800}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
      2.300     0.700     0.700 peak  2800 spectrum    1 weight  0.10000E+01 volume  0.84472E-02 ppm1      1.138 ppm2      3.565 CV     1
 ASSI { 2801}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HA1 ))
      3.900     1.900     1.900 peak  2801 spectrum    1 weight  0.10000E+01 volume  0.62324E-03 ppm1      1.137 ppm2      3.787 CV     1
 ASSI { 2802}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 45   and name HD1 ))
      4.100     2.200     1.900 peak  2802 spectrum    1 weight  0.10000E+01 volume  0.54616E-03 ppm1      1.136 ppm2      3.144 CV     1
 OR { 2802}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 45   and name HD2 ))
 ASSI { 2803}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HB2 ))
      4.900     3.000     1.100 peak  2803 spectrum    1 weight  0.10000E+01 volume  0.69655E-03 ppm1      1.137 ppm2      2.108 CV     1
 ASSI { 2804}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 39   and name HB1 ))
      4.200     2.200     1.800 peak  2804 spectrum    1 weight  0.10000E+01 volume  0.82240E-03 ppm1      1.137 ppm2      1.861 CV     1
 ASSI { 2805}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 39   and name HG  ))
      3.800     1.800     1.800 peak  2805 spectrum    1 weight  0.10000E+01 volume  0.71700E-03 ppm1      1.138 ppm2      1.653 CV     1
 ASSI { 2807}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
      2.800     1.000     1.000 peak  2807 spectrum    1 weight  0.10000E+01 volume  0.33947E-02 ppm1      1.137 ppm2      4.175 CV     1
 ASSI { 2808}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HA  ))
      4.600     2.700     1.400 peak  2808 spectrum    1 weight  0.10000E+01 volume  0.85776E-03 ppm1      1.137 ppm2      4.082 CV     1
 ASSI { 2809}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 38   and name HN  ))
      2.700     2.700     3.300 peak  2809 spectrum    1 weight  0.10000E+01 volume  0.79990E-03 ppm1      1.137 ppm2      8.375 CV     1
 ASSI { 2811}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HN  ))
      2.000     0.500     0.500 peak  2811 spectrum    1 weight  0.10000E+01 volume  0.10930E-01 ppm1      1.137 ppm2      7.380 CV     1
 ASSI { 2812}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 46   and name HN  ))
      5.300     3.500     0.700 peak  2812 spectrum    1 weight  0.10000E+01 volume  0.23054E-03 ppm1      1.139 ppm2      8.110 CV     1
 ASSI { 2813}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 39   and name HN  ))
      3.300     1.300     1.300 peak  2813 spectrum    1 weight  0.10000E+01 volume  0.23452E-03 ppm1      1.136 ppm2      7.800 CV     1
 ASSI { 2816}
   (  segid "    " and resid 42   and name HG2%)
   (  segid "    " and resid 39   and name HD1%)
      4.300     2.300     1.700 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.73632E-03 ppm1      1.139 ppm2      0.864 CV     1
 ASSI { 2817}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 14   and name HN  ))
      2.700     0.900     0.900 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.12206E-02 ppm1      1.997 ppm2      8.820 CV     1
 ASSI { 2818}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HA  ))
      3.300     1.400     1.400 peak  2818 spectrum    1 weight  0.10000E+01 volume  0.80569E-03 ppm1      1.998 ppm2      3.556 CV     1
 ASSI { 2820}
   (( segid "    " and resid 13   and name HB  ))
   (( segid "    " and resid 13   and name HN  ))
      2.400     0.700     0.700 peak  2820 spectrum    1 weight  0.10000E+01 volume  0.27149E-02 ppm1      1.998 ppm2      8.258 CV     1
 ASSI { 2822}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name HA  ))
      2.500     0.800     0.800 peak  2822 spectrum    1 weight  0.10000E+01 volume  0.42747E-02 ppm1      0.766 ppm2      3.556 CV     1
 ASSI { 2824}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 9    and name HA  ))
      5.200     3.400     0.800 peak  2824 spectrum    1 weight  0.10000E+01 volume  0.31613E-03 ppm1      0.768 ppm2      4.042 CV     1
 ASSI { 2825}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name HN  ))
      3.600     1.600     1.600 peak  2825 spectrum    1 weight  0.10000E+01 volume  0.20991E-02 ppm1      0.767 ppm2      8.259 CV     1
 ASSI { 2826}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 14   and name HN  ))
      3.300     1.300     1.300 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.17004E-02 ppm1      0.767 ppm2      8.819 CV     1
 ASSI { 2827}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 47   and name HN  ))
      4.100     2.100     1.900 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.54217E-03 ppm1      0.721 ppm2      7.939 CV     1
 ASSI { 2828}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 48   and name HN  ))
      3.800     1.800     1.800 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.71550E-03 ppm1      0.721 ppm2      8.136 CV     1
 ASSI { 2829}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 44   and name HN  ))
      3.600     1.600     1.600 peak  2829 spectrum    1 weight  0.10000E+01 volume  0.31374E-02 ppm1      0.721 ppm2      8.412 CV     1
 ASSI { 2830}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 17   and name HN  ))
      4.200     2.200     1.800 peak  2830 spectrum    1 weight  0.10000E+01 volume  0.37168E-03 ppm1      0.769 ppm2      7.701 CV     1
 ASSI { 2831}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 16   and name HN  ))
      4.300     2.300     1.700 peak  2831 spectrum    1 weight  0.10000E+01 volume  0.46646E-03 ppm1      0.766 ppm2      7.597 CV     1
 ASSI { 2833}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 43   and name HB1 ))
      4.800     2.800     1.200 peak  2833 spectrum    1 weight  0.10000E+01 volume  0.37549E-03 ppm1      0.726 ppm2      2.204 CV     1
 ASSI { 2835}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 44   and name HB  ))
      2.200     0.600     0.600 peak  2835 spectrum    1 weight  0.10000E+01 volume  0.69166E-02 ppm1      0.721 ppm2      1.983 CV     1
 ASSI { 2836}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 47   and name HG11))
      3.500     1.600     1.600 peak  2836 spectrum    1 weight  0.10000E+01 volume  0.20252E-02 ppm1      0.721 ppm2      1.816 CV     1
 ASSI { 2837}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 13   and name HB  ))
      2.100     0.600     0.600 peak  2837 spectrum    1 weight  0.10000E+01 volume  0.84388E-02 ppm1      0.767 ppm2      1.999 CV     1
 ASSI { 2841}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 17   and name HG  ))
      3.000     1.100     1.100 peak  2841 spectrum    1 weight  0.10000E+01 volume  0.13959E-02 ppm1      0.767 ppm2      1.656 CV     1
 ASSI { 2842}
   (  segid "    " and resid 13   and name HG1%)
   (( segid "    " and resid 17   and name HB2 ))
      4.700     2.800     1.300 peak  2842 spectrum    1 weight  0.10000E+01 volume  0.20500E-03 ppm1      0.771 ppm2      1.548 CV     1
 ASSI { 2843}
   (  segid "    " and resid 13   and name HG1%)
   (  segid "    " and resid 12   and name HB% )
      4.700     2.700     1.300 peak  2843 spectrum    1 weight  0.10000E+01 volume  0.67096E-03 ppm1      0.767 ppm2      1.463 CV     1
 ASSI { 2853}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 48   and name HB2 ))
      4.100     2.200     1.900 peak  2853 spectrum    1 weight  0.10000E+01 volume  0.28728E-03 ppm1      0.723 ppm2      1.592 CV     1
 ASSI { 2854}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HA  ))
      2.500     0.800     0.800 peak  2854 spectrum    1 weight  0.10000E+01 volume  0.40831E-02 ppm1      1.728 ppm2      3.791 CV     1
 OR { 2854}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 2856}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HG1 ))
      2.300     0.700     0.700 peak  2856 spectrum    1 weight  0.10000E+01 volume  0.52894E-02 ppm1      1.729 ppm2      1.483 CV     1
 OR { 2856}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HG1 ))
 ASSI { 2857}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 10   and name HB  ))
      4.900     3.000     1.100 peak  2857 spectrum    1 weight  0.10000E+01 volume  0.38431E-03 ppm1      1.726 ppm2      2.143 CV     1
 OR { 2857}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 10   and name HB  ))
 ASSI { 2858}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 11   and name HN  ))
      2.400     0.700     0.700 peak  2858 spectrum    1 weight  0.10000E+01 volume  0.43173E-02 ppm1      1.725 ppm2      7.783 CV     1
 OR { 2858}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 2861}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 12   and name HN  ))
      3.000     1.200     1.200 peak  2861 spectrum    1 weight  0.10000E+01 volume  0.16934E-02 ppm1      1.725 ppm2      8.149 CV     1
 OR { 2861}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2864}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 10   and name HN  ))
      4.700     2.800     1.300 peak  2864 spectrum    1 weight  0.10000E+01 volume  0.47288E-03 ppm1      1.729 ppm2      7.903 CV     1
 OR { 2864}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
 ASSI { 2865}
   (( segid "    " and resid 11   and name HE2 ))
   (( segid "    " and resid 11   and name HG2 ))
      2.800     1.000     1.000 peak  2865 spectrum    1 weight  0.10000E+01 volume  0.25986E-02 ppm1      2.940 ppm2      1.257 CV     1
 OR { 2865}
   (( segid "    " and resid 11   and name HE1 ))
   (( segid "    " and resid 11   and name HG2 ))
 ASSI { 2867}
   (  segid "    " and resid 12   and name HB% )
   (( segid "    " and resid 13   and name HB  ))
      4.000     2.000     2.000 peak  2867 spectrum    1 weight  0.10000E+01 volume  0.98689E-03 ppm1      1.473 ppm2      1.997 CV     1
 ASSI { 2872}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 14   and name HA  ))
      2.000     0.500     0.500 peak  2872 spectrum    1 weight  0.10000E+01 volume  0.10572E-01 ppm1      1.420 ppm2      3.837 CV     1
 ASSI { 2873}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HA  ))
      3.500     1.500     1.500 peak  2873 spectrum    1 weight  0.10000E+01 volume  0.97321E-03 ppm1      1.420 ppm2      4.292 CV     1
 ASSI { 2874}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HB2 ))
      3.900     1.900     1.900 peak  2874 spectrum    1 weight  0.10000E+01 volume  0.99016E-03 ppm1      1.421 ppm2      3.262 CV     1
 OR { 2874}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HB1 ))
 ASSI { 2876}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name HB1 ))
      3.900     1.900     1.900 peak  2876 spectrum    1 weight  0.10000E+01 volume  0.18281E-02 ppm1      3.844 ppm2      1.815 CV     1
 ASSI { 2877}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 19   and name HB  ))
      3.500     1.500     1.500 peak  2877 spectrum    1 weight  0.10000E+01 volume  0.19851E-02 ppm1      3.845 ppm2      1.569 CV     1
 ASSI { 2878}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 19   and name HG12))
      4.500     2.500     1.500 peak  2878 spectrum    1 weight  0.10000E+01 volume  0.49706E-03 ppm1      3.849 ppm2      1.009 CV     1
 ASSI { 2880}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 13   and name HG1%)
      2.500     0.800     0.800 peak  2880 spectrum    1 weight  0.10000E+01 volume  0.43395E-02 ppm1      3.844 ppm2      0.760 CV     1
 ASSI { 2881}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 19   and name HG2%)
      4.400     2.400     1.600 peak  2881 spectrum    1 weight  0.10000E+01 volume  0.13845E-02 ppm1      3.843 ppm2      0.683 CV     1
 ASSI { 2882}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.500     0.800     0.800 peak  2882 spectrum    1 weight  0.10000E+01 volume  0.28638E-02 ppm1      3.845 ppm2      8.822 CV     1
 ASSI { 2883}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      3.100     1.200     1.200 peak  2883 spectrum    1 weight  0.10000E+01 volume  0.12949E-02 ppm1      3.846 ppm2      8.040 CV     1
 ASSI { 2884}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.000     1.100     1.100 peak  2884 spectrum    1 weight  0.10000E+01 volume  0.11371E-02 ppm1      3.846 ppm2      7.708 CV     1
 ASSI { 2885}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      3.900     1.900     1.900 peak  2885 spectrum    1 weight  0.10000E+01 volume  0.24452E-03 ppm1      3.844 ppm2      7.594 CV     1
 ASSI { 2886}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 11   and name HN  ))
      2.700     2.700     3.300 peak  2886 spectrum    1 weight  0.10000E+01 volume  0.70947E-03 ppm1      1.419 ppm2      7.778 CV     1
 ASSI { 2887}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 17   and name HN  ))
      4.300     2.300     1.700 peak  2887 spectrum    1 weight  0.10000E+01 volume  0.49304E-03 ppm1      1.420 ppm2      7.709 CV     1
 ASSI { 2888}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 16   and name HN  ))
      4.100     2.100     1.900 peak  2888 spectrum    1 weight  0.10000E+01 volume  0.55555E-03 ppm1      1.419 ppm2      7.595 CV     1
 ASSI { 2889}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 13   and name HN  ))
      3.900     1.900     1.900 peak  2889 spectrum    1 weight  0.10000E+01 volume  0.10680E-02 ppm1      1.420 ppm2      8.258 CV     1
 ASSI { 2890}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 12   and name HN  ))
      4.900     3.000     1.100 peak  2890 spectrum    1 weight  0.10000E+01 volume  0.34478E-03 ppm1      1.420 ppm2      8.154 CV     1
 ASSI { 2891}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HN  ))
      2.300     0.700     0.700 peak  2891 spectrum    1 weight  0.10000E+01 volume  0.51271E-02 ppm1      1.420 ppm2      8.036 CV     1
 ASSI { 2892}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 14   and name HN  ))
      2.000     0.500     0.500 peak  2892 spectrum    1 weight  0.10000E+01 volume  0.10256E-01 ppm1      1.420 ppm2      8.821 CV     1
 ASSI { 2895}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 12   and name HA  ))
      5.100     3.200     0.900 peak  2895 spectrum    1 weight  0.10000E+01 volume  0.24290E-03 ppm1      1.419 ppm2      4.102 CV     1
 ASSI { 2899}
   (  segid "    " and resid 14   and name HB% )
   (  segid "    " and resid 10   and name HG2%)
      3.500     1.600     1.600 peak  2899 spectrum    1 weight  0.10000E+01 volume  0.24073E-02 ppm1      1.419 ppm2      0.963 CV     1
 ASSI { 2901}
   (  segid "    " and resid 14   and name HB% )
   (  segid "    " and resid 19   and name HD1%)
      2.700     0.900     0.900 peak  2901 spectrum    1 weight  0.10000E+01 volume  0.58338E-02 ppm1      1.420 ppm2      0.850 CV     1
 ASSI { 2902}
   (  segid "    " and resid 14   and name HB% )
   (  segid "    " and resid 13   and name HG1%)
      2.800     1.000     1.000 peak  2902 spectrum    1 weight  0.10000E+01 volume  0.69250E-02 ppm1      1.420 ppm2      0.748 CV     1
 ASSI { 2906}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 13   and name HB  ))
      4.000     2.000     2.000 peak  2906 spectrum    1 weight  0.10000E+01 volume  0.81403E-03 ppm1      1.419 ppm2      2.000 CV     1
 ASSI { 2908}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 11   and name HB1 ))
      3.400     3.400     2.600 peak  2908 spectrum    1 weight  0.10000E+01 volume  0.11434E-02 ppm1      1.420 ppm2      1.731 CV     1
 ASSI { 2909}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 19   and name HB  ))
      2.200     0.600     0.600 peak  2909 spectrum    1 weight  0.10000E+01 volume  0.66220E-02 ppm1      1.420 ppm2      1.561 CV     1
 ASSI { 2913}
   (( segid "    " and resid 41   and name HA1 ))
   (( segid "    " and resid 36   and name HG  ))
      5.600     3.900     0.400 peak  2913 spectrum    1 weight  0.10000E+01 volume  0.22985E-03 ppm1      3.782 ppm2      1.738 CV     1
 ASSI { 2916}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      4.400     2.400     1.600 peak  2916 spectrum    1 weight  0.10000E+01 volume  0.23157E-03 ppm1      3.563 ppm2      8.110 CV     1
 ASSI { 2917}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HA  ))
      4.300     2.300     1.700 peak  2917 spectrum    1 weight  0.10000E+01 volume  0.35930E-03 ppm1      3.559 ppm2      4.088 CV     1
 ASSI { 2918}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HA  ))
      5.000     3.200     1.000 peak  2918 spectrum    1 weight  0.10000E+01 volume  0.29514E-03 ppm1      3.570 ppm2      3.826 CV     1
 ASSI { 2921}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.900     1.100     1.100 peak  2921 spectrum    1 weight  0.10000E+01 volume  0.11867E-02 ppm1      3.562 ppm2      1.848 CV     1
 ASSI { 2923}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 41   and name HA2 ))
      5.400     3.700     0.600 peak  2923 spectrum    1 weight  0.10000E+01 volume  0.24751E-03 ppm1      1.136 ppm2      3.484 CV     1
 ASSI { 2924}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 46   and name HG2 ))
      5.200     3.400     0.800 peak  2924 spectrum    1 weight  0.10000E+01 volume  0.32759E-03 ppm1      1.137 ppm2      2.391 CV     1
 ASSI { 2929}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
      4.700     2.800     1.300 peak  2929 spectrum    1 weight  0.10000E+01 volume  0.29375E-03 ppm1      2.384 ppm2      4.096 CV     1
 ASSI { 2930}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 50   and name HD1 ))
      4.800     2.900     1.200 peak  2930 spectrum    1 weight  0.10000E+01 volume  0.25797E-03 ppm1      2.572 ppm2      3.181 CV     1
 OR { 2930}
   (( segid "    " and resid 46   and name HG1 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 2931}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 50   and name HD1 ))
      4.300     2.300     1.700 peak  2931 spectrum    1 weight  0.10000E+01 volume  0.28826E-03 ppm1      2.389 ppm2      3.182 CV     1
 OR { 2931}
   (( segid "    " and resid 46   and name HG2 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 2932}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 28   and name HN  ))
      3.300     3.300     2.700 peak  2932 spectrum    1 weight  0.10000E+01 volume  0.22519E-03 ppm1      0.965 ppm2      8.352 CV     1
 ASSI { 2935}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 64   and name HB1 ))
      4.500     2.500     1.500 peak  2935 spectrum    1 weight  0.10000E+01 volume  0.42084E-03 ppm1      0.964 ppm2      2.026 CV     1
 ASSI { 2936}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
      3.900     1.900     1.900 peak  2936 spectrum    1 weight  0.10000E+01 volume  0.38629E-03 ppm1      0.963 ppm2      1.943 CV     1
 ASSI { 2938}
   (( segid "    " and resid 67   and name HD2 ))
   (( segid "    " and resid 69   and name HN  ))
      5.300     3.500     0.700 peak  2938 spectrum    1 weight  0.10000E+01 volume  0.15038E-03 ppm1      2.991 ppm2      7.911 CV     1
 ASSI { 2944}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 60   and name HG1 ))
      4.300     2.400     1.700 peak  2944 spectrum    1 weight  0.10000E+01 volume  0.43020E-03 ppm1      1.936 ppm2      2.230 CV     1
 OR { 2944}
   (( segid "    " and resid 57   and name HG2 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 2948}
   (  segid "    " and resid 31   and name HD1%)
   (( segid "    " and resid 32   and name HN  ))
      5.000     3.100     1.000 peak  2948 spectrum    1 weight  0.10000E+01 volume  0.28012E-03 ppm1      0.585 ppm2      8.482 CV     1
 ASSI { 2950}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      5.300     3.400     0.700 peak  2950 spectrum    1 weight  0.10000E+01 volume  0.19933E-03 ppm1      3.835 ppm2      3.017 CV     1
 ASSI { 2951}
   (( segid "    " and resid 49   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      5.800     4.200     0.200 peak  2951 spectrum    1 weight  0.10000E+01 volume  0.14096E-03 ppm1      3.837 ppm2      2.526 CV     1
 ASSI { 2954}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 49   and name HN  ))
      5.400     3.600     0.600 peak  2954 spectrum    1 weight  0.10000E+01 volume  0.18070E-03 ppm1      0.747 ppm2      7.923 CV     1
 ASSI { 2955}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 57   and name HD1 ))
      3.400     1.400     1.400 peak  2955 spectrum    1 weight  0.10000E+01 volume  0.52441E-03 ppm1      0.747 ppm2      3.830 CV     1
 ASSI { 2956}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 59   and name HD1 ))
      5.500     3.700     0.500 peak  2956 spectrum    1 weight  0.10000E+01 volume  0.27870E-03 ppm1      0.749 ppm2      3.160 CV     1
 OR { 2956}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 59   and name HD2 ))
 ASSI { 2957}
   (( segid "    " and resid 15   and name HB1 ))
   (( segid "    " and resid 14   and name HN  ))
      4.900     3.000     1.100 peak  2957 spectrum    1 weight  0.10000E+01 volume  0.33434E-03 ppm1      3.263 ppm2      8.818 CV     1
 OR { 2957}
   (( segid "    " and resid 15   and name HB2 ))
   (( segid "    " and resid 14   and name HN  ))
 ASSI { 2959}
   (( segid "    " and resid 66   and name HB2 ))
   (( segid "    " and resid 66   and name HB1 ))
      1.800     0.400     0.400 peak  2959 spectrum    1 weight  0.10000E+01 volume  0.45453E-02 ppm1      1.298 ppm2      1.953 CV     1
 ASSI { 2964}
   (( segid "    " and resid 72   and name HG1 ))
   (  segid "    " and resid 9    and name HD1%)
      5.000     3.200     1.000 peak  2964 spectrum    1 weight  0.10000E+01 volume  0.15743E-03 ppm1      2.609 ppm2      0.582 CV     1
 ASSI { 2965}
   (( segid "    " and resid 72   and name HG2 ))
   (  segid "    " and resid 9    and name HD1%)
      5.200     3.400     0.800 peak  2965 spectrum    1 weight  0.10000E+01 volume  0.14127E-03 ppm1      2.483 ppm2      0.577 CV     1
 ASSI { 2968}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 68   and name HG2 ))
      4.300     2.300     1.700 peak  2968 spectrum    1 weight  0.10000E+01 volume  0.20346E-03 ppm1      2.612 ppm2      1.511 CV     1
 OR { 2968}
   (( segid "    " and resid 72   and name HG1 ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI { 2969}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 68   and name HG2 ))
      3.800     1.800     1.800 peak  2969 spectrum    1 weight  0.10000E+01 volume  0.23386E-03 ppm1      2.488 ppm2      1.497 CV     1
 OR { 2969}
   (( segid "    " and resid 72   and name HG2 ))
   (( segid "    " and resid 68   and name HG1 ))
 ASSI { 2973}
   (  segid "    " and resid 55   and name HG2%)
   (( segid "    " and resid 56   and name HA  ))
      3.400     3.400     2.600 peak  2973 spectrum    1 weight  0.10000E+01 volume  0.20001E-03 ppm1      0.796 ppm2      4.919 CV     1
 ASSI { 2979}
   (  segid "    " and resid 17   and name HD1%)
   (( segid "    " and resid 19   and name HN  ))
      5.600     4.000     0.400 peak  2979 spectrum    1 weight  0.10000E+01 volume  0.19591E-03 ppm1      0.774 ppm2      8.052 CV     1
 ASSI { 2982}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 29   and name HB2 ))
      4.000     2.000     2.000 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.33629E-03 ppm1      3.143 ppm2      3.759 CV     1
 ASSI { 2983}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 29   and name HB2 ))
      4.200     2.200     1.800 peak  2983 spectrum    1 weight  0.10000E+01 volume  0.20552E-03 ppm1      2.727 ppm2      3.765 CV     1
 ASSI { 2985}
   (  segid "    " and resid 32   and name HB% )
   (( segid "    " and resid 30   and name HN  ))
      5.000     3.100     1.000 peak  2985 spectrum    1 weight  0.10000E+01 volume  0.28537E-03 ppm1      1.375 ppm2      9.194 CV     1
 ASSI { 2986}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      5.500     3.800     0.500 peak  2986 spectrum    1 weight  0.10000E+01 volume  0.22551E-03 ppm1      2.770 ppm2      4.280 CV     1
 ASSI { 2987}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 7    and name HA  ))
      4.600     2.700     1.400 peak  2987 spectrum    1 weight  0.10000E+01 volume  0.25578E-03 ppm1      2.640 ppm2      4.271 CV     1
 ASSI { 2990}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 73   and name HN  ))
      2.600     0.800     0.800 peak  2990 spectrum    1 weight  0.10000E+01 volume  0.28784E-02 ppm1      4.414 ppm2      7.733 CV     1
 ASSI { 2991}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      3.000     1.100     1.100 peak  2991 spectrum    1 weight  0.10000E+01 volume  0.17957E-02 ppm1      4.416 ppm2      7.937 CV     1
 ASSI { 2996}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 9    and name HD1%)
      3.200     1.300     1.300 peak  2996 spectrum    1 weight  0.10000E+01 volume  0.76001E-03 ppm1      4.414 ppm2      0.575 CV     1
 ASSI { 2999}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 9    and name HB1 ))
      4.900     3.000     1.100 peak  2999 spectrum    1 weight  0.10000E+01 volume  0.32957E-03 ppm1      4.420 ppm2      1.597 CV     1
 ASSI { 3000}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      3.400     3.400     2.600 peak  3000 spectrum    1 weight  0.10000E+01 volume  0.18051E-03 ppm1      4.414 ppm2      8.317 CV     1
 ASSI { 3002}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 9    and name HN  ))
      5.600     4.000     0.400 peak  3002 spectrum    1 weight  0.10000E+01 volume  0.84349E-04 ppm1      4.417 ppm2      8.482 CV     1
 ASSI { 3003}
   (( segid "    " and resid 73   and name HA  ))
   (  segid "    " and resid 9    and name HD2%)
      4.000     2.000     2.000 peak  3003 spectrum    1 weight  0.10000E+01 volume  0.48119E-03 ppm1      4.411 ppm2      0.692 CV     1
 ASSI { 3011}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 12   and name HN  ))
      5.100     3.300     0.900 peak  3011 spectrum    1 weight  0.10000E+01 volume  0.17860E-03 ppm1      0.845 ppm2      8.154 CV     1
 ASSI { 3012}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 9    and name HN  ))
      4.600     2.600     1.400 peak  3012 spectrum    1 weight  0.10000E+01 volume  0.36427E-03 ppm1      0.941 ppm2      8.482 CV     1
 ASSI { 3013}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 70   and name HN  ))
      5.600     3.900     0.400 peak  3013 spectrum    1 weight  0.10000E+01 volume  0.18169E-03 ppm1      0.845 ppm2      8.330 CV     1
 ASSI { 3014}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 14   and name HN  ))
      4.600     2.600     1.400 peak  3014 spectrum    1 weight  0.10000E+01 volume  0.49460E-03 ppm1      0.943 ppm2      8.817 CV     1
 ASSI { 3015}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
      5.200     3.400     0.800 peak  3015 spectrum    1 weight  0.10000E+01 volume  0.24705E-03 ppm1      0.942 ppm2      8.156 CV     1
 ASSI { 3016}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 72   and name HN  ))
      5.000     3.200     1.000 peak  3016 spectrum    1 weight  0.10000E+01 volume  0.33317E-03 ppm1      0.942 ppm2      7.999 CV     1
 ASSI { 3017}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HE22))
      4.700     2.700     1.300 peak  3017 spectrum    1 weight  0.10000E+01 volume  0.41097E-03 ppm1      0.940 ppm2      7.338 CV     1
 ASSI { 3018}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 70   and name HE22))
      5.200     3.400     0.800 peak  3018 spectrum    1 weight  0.10000E+01 volume  0.25077E-03 ppm1      0.845 ppm2      7.339 CV     1
 ASSI { 3019}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 70   and name HE21))
      5.600     3.900     0.400 peak  3019 spectrum    1 weight  0.10000E+01 volume  0.18218E-03 ppm1      0.846 ppm2      6.602 CV     1
 ASSI { 3020}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HE21))
      5.200     3.400     0.800 peak  3020 spectrum    1 weight  0.10000E+01 volume  0.19944E-03 ppm1      0.940 ppm2      6.606 CV     1
 ASSI { 3021}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 70   and name HG2 ))
      4.500     2.500     1.500 peak  3021 spectrum    1 weight  0.10000E+01 volume  0.38053E-03 ppm1      0.848 ppm2      2.290 CV     1
 ASSI { 3022}
   (  segid "    " and resid 10   and name HG1%)
   (( segid "    " and resid 70   and name HG1 ))
      5.800     4.200     0.200 peak  3022 spectrum    1 weight  0.10000E+01 volume  0.22894E-03 ppm1      0.846 ppm2      2.438 CV     1
 ASSI { 3023}
   (  segid "    " and resid 44   and name HG1%)
   (  segid "    " and resid 44   and name HG2%)
      2.000     0.500     0.500 peak  3023 spectrum    1 weight  0.10000E+01 volume  0.16234E-01 ppm1      0.721 ppm2      0.993 CV     1
 ASSI { 3024}
   (( segid "    " and resid 44   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
      5.000     3.100     1.000 peak  3024 spectrum    1 weight  0.10000E+01 volume  0.19763E-03 ppm1      1.982 ppm2      8.127 CV     1
 ASSI { 3026}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 40   and name HA  ))
      3.400     1.500     1.500 peak  3026 spectrum    1 weight  0.10000E+01 volume  0.58044E-03 ppm1      0.994 ppm2      4.068 CV     1
 ASSI { 3030}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 40   and name HB1 ))
      2.600     2.600     3.400 peak  3030 spectrum    1 weight  0.10000E+01 volume  0.10534E-02 ppm1      0.993 ppm2      1.884 CV     1
 ASSI { 3031}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 40   and name HB2 ))
      2.500     2.500     3.500 peak  3031 spectrum    1 weight  0.10000E+01 volume  0.11996E-02 ppm1      0.992 ppm2      1.794 CV     1
 ASSI { 3032}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 16   and name HG12))
      4.800     2.900     1.200 peak  3032 spectrum    1 weight  0.10000E+01 volume  0.28541E-03 ppm1      0.992 ppm2      1.221 CV     1
 ASSI { 3034}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 44   and name HN  ))
      2.100     0.600     0.600 peak  3034 spectrum    1 weight  0.10000E+01 volume  0.69595E-02 ppm1      0.993 ppm2      8.416 CV     1
 ASSI { 3037}
   (  segid "    " and resid 44   and name HG2%)
   (( segid "    " and resid 45   and name HE  ))
      4.300     2.300     1.700 peak  3037 spectrum    1 weight  0.10000E+01 volume  0.69088E-03 ppm1      0.992 ppm2      7.365 CV     1
 ASSI { 3039}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 42   and name HA  ))
      4.500     2.500     1.500 peak  3039 spectrum    1 weight  0.10000E+01 volume  0.64841E-03 ppm1      0.727 ppm2      3.551 CV     1
 ASSI { 3040}
   (  segid "    " and resid 44   and name HG1%)
   (( segid "    " and resid 40   and name HA  ))
      5.100     3.200     0.900 peak  3040 spectrum    1 weight  0.10000E+01 volume  0.22494E-03 ppm1      0.720 ppm2      4.060 CV     1
 ASSI { 3041}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 21   and name HB2 ))
      5.600     3.900     0.400 peak  3041 spectrum    1 weight  0.10000E+01 volume  0.14794E-03 ppm1      0.698 ppm2      2.488 CV     1
 ASSI { 3044}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 25   and name HA  ))
      6.000     5.000     0.000 peak  3044 spectrum    1 weight  0.10000E+01 volume  0.15399E-03 ppm1      0.697 ppm2      4.080 CV     1
 ASSI { 3045}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      6.000     5.000     0.000 peak  3045 spectrum    1 weight  0.10000E+01 volume  0.14671E-03 ppm1      0.695 ppm2      7.345 CV     1
 ASSI { 3046}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 17   and name HN  ))
      3.400     3.400     2.600 peak  3046 spectrum    1 weight  0.10000E+01 volume  0.20614E-03 ppm1      0.692 ppm2      7.713 CV     1
 ASSI { 3047}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
      5.500     3.800     0.500 peak  3047 spectrum    1 weight  0.10000E+01 volume  0.20000E-03 ppm1      0.696 ppm2      8.221 CV     1
 ASSI { 3048}
   (  segid "    " and resid 19   and name HG2%)
   (( segid "    " and resid 26   and name HN  ))
      6.000     6.000     0.000 peak  3048 spectrum    1 weight  0.10000E+01 volume  0.11847E-03 ppm1      0.698 ppm2      8.448 CV     1
 ASSI { 3050}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 26   and name HB1 ))
      3.300     3.300     2.700 peak  3050 spectrum    1 weight  0.10000E+01 volume  0.22959E-03 ppm1      0.859 ppm2      3.148 CV     1
 ASSI { 3051}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 33   and name HB1 ))
      3.400     1.400     1.400 peak  3051 spectrum    1 weight  0.10000E+01 volume  0.20403E-03 ppm1      0.857 ppm2      3.031 CV     1
 ASSI { 3052}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 55   and name HA  ))
      4.400     2.400     1.600 peak  3052 spectrum    1 weight  0.10000E+01 volume  0.20875E-03 ppm1      1.358 ppm2      3.979 CV     1
 ASSI { 3053}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
      5.500     3.700     0.500 peak  3053 spectrum    1 weight  0.10000E+01 volume  0.10709E-03 ppm1      1.271 ppm2      3.981 CV     1
 ASSI { 3058}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HB  ))
      4.200     2.200     1.800 peak  3058 spectrum    1 weight  0.10000E+01 volume  0.38785E-03 ppm1      3.842 ppm2      2.008 CV     1
 ASSI { 3059}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      5.200     3.400     0.800 peak  3059 spectrum    1 weight  0.10000E+01 volume  0.19903E-03 ppm1      3.849 ppm2      8.264 CV     1
 ASSI { 3065}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 67   and name HA  ))
      3.900     1.900     1.900 peak  3065 spectrum    1 weight  0.10000E+01 volume  0.11439E-02 ppm1      0.745 ppm2      3.796 CV     1
 ASSI { 3067}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 23   and name HA  ))
      5.100     3.300     0.900 peak  3067 spectrum    1 weight  0.10000E+01 volume  0.27488E-03 ppm1      0.742 ppm2      4.050 CV     1
 ASSI { 3068}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 25   and name HN  ))
      5.700     4.100     0.300 peak  3068 spectrum    1 weight  0.10000E+01 volume  0.22829E-03 ppm1      0.745 ppm2      7.337 CV     1
 ASSI { 3069}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 23   and name HN  ))
      5.500     3.800     0.500 peak  3069 spectrum    1 weight  0.10000E+01 volume  0.18575E-03 ppm1      0.743 ppm2      8.214 CV     1
 ASSI { 3071}
   (  segid "    " and resid 27   and name HD1%)
   (( segid "    " and resid 26   and name HA  ))
      3.100     3.100     2.900 peak  3071 spectrum    1 weight  0.10000E+01 volume  0.31817E-03 ppm1      0.706 ppm2      4.607 CV     1
 ASSI { 3072}
   (  segid "    " and resid 65   and name HG2%)
   (( segid "    " and resid 28   and name HB2 ))
      3.300     3.300     2.700 peak  3072 spectrum    1 weight  0.10000E+01 volume  0.20891E-03 ppm1      0.960 ppm2      2.511 CV     1
 ASSI { 3076}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 64   and name HN  ))
      3.600     1.600     1.600 peak  3076 spectrum    1 weight  0.10000E+01 volume  0.13419E-03 ppm1      1.697 ppm2      7.377 CV     1
 OR { 3076}
   (( segid "    " and resid 68   and name HD1 ))
   (( segid "    " and resid 64   and name HN  ))
 OR { 3076}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 64   and name HN  ))
 OR { 3076}
   (( segid "    " and resid 68   and name HD2 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 3079}
   (  segid "    " and resid 55   and name HG1%)
   (( segid "    " and resid 57   and name HB1 ))
      5.300     3.500     0.700 peak  3079 spectrum    1 weight  0.10000E+01 volume  0.11988E-03 ppm1      0.749 ppm2      2.401 CV     1
 ASSI { 3082}
   (  segid "    " and resid 54   and name HD1%)
   (( segid "    " and resid 54   and name HN  ))
      3.800     1.800     1.800 peak  3082 spectrum    1 weight  0.10000E+01 volume  0.53386E-03 ppm1      0.838 ppm2      7.632 CV     1
 ASSI { 3085}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HB1 ))
      2.400     0.700     0.700 peak  3085 spectrum    1 weight  0.10000E+01 volume  0.48512E-02 ppm1      0.938 ppm2      2.237 CV     1
 OR { 3085}
   (  segid "    " and resid 10   and name HG2%)
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 3089}
   (( segid "    " and resid 69   and name HB1 ))
   (  segid "    " and resid 9    and name HD1%)
      4.000     2.000     2.000 peak  3089 spectrum    1 weight  0.10000E+01 volume  0.47144E-03 ppm1      2.034 ppm2      0.578 CV     1
 ASSI { 3090}
   (  segid "    " and resid 58   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
      5.400     3.600     0.600 peak  3090 spectrum    1 weight  0.10000E+01 volume  0.35597E-03 ppm1      0.881 ppm2      4.591 CV     1
 ASSI { 3092}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 15   and name HB1 ))
      5.800     4.300     0.200 peak  3092 spectrum    1 weight  0.10000E+01 volume  0.19734E-03 ppm1      0.902 ppm2      3.260 CV     1
 OR { 3092}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 15   and name HB2 ))
 ASSI { 3093}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 40   and name HG1 ))
      3.100     1.200     1.200 peak  3093 spectrum    1 weight  0.10000E+01 volume  0.20150E-02 ppm1      0.902 ppm2      2.923 CV     1
 ASSI { 3094}
   (  segid "    " and resid 16   and name HG2%)
   (( segid "    " and resid 40   and name HG2 ))
      2.600     0.800     0.800 peak  3094 spectrum    1 weight  0.10000E+01 volume  0.32090E-02 ppm1      0.903 ppm2      2.514 CV     1
 ASSI { 3099}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 13   and name HN  ))
      5.000     3.100     1.000 peak  3099 spectrum    1 weight  0.10000E+01 volume  0.28583E-03 ppm1      0.679 ppm2      8.262 CV     1
 ASSI { 3100}
   (  segid "    " and resid 66   and name HD1%)
   (( segid "    " and resid 65   and name HA  ))
      5.100     3.300     0.900 peak  3100 spectrum    1 weight  0.10000E+01 volume  0.23471E-03 ppm1      0.680 ppm2      5.032 CV     1
 ASSI { 3102}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 20   and name HA  ))
      3.900     1.900     1.900 peak  3102 spectrum    1 weight  0.10000E+01 volume  0.22456E-03 ppm1      1.420 ppm2      4.195 CV     1
 ASSI { 3103}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      5.000     3.200     1.000 peak  3103 spectrum    1 weight  0.10000E+01 volume  0.28339E-03 ppm1      1.418 ppm2      3.961 CV     1
 ASSI { 3104}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 11   and name HE2 ))
      6.000     4.800     0.000 peak  3104 spectrum    1 weight  0.10000E+01 volume  0.55689E-04 ppm1      1.416 ppm2      2.959 CV     1
 OR { 3104}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 11   and name HE1 ))
 ASSI { 3105}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 20   and name HD2 ))
      6.000     4.900     0.000 peak  3105 spectrum    1 weight  0.10000E+01 volume  0.54922E-04 ppm1      1.421 ppm2      3.141 CV     1
 OR { 3105}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 20   and name HD1 ))
 ASSI { 3106}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 70   and name HG1 ))
      6.000     5.000     0.000 peak  3106 spectrum    1 weight  0.10000E+01 volume  0.13247E-03 ppm1      1.419 ppm2      2.419 CV     1
 ASSI { 3112}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 60   and name HN  ))
      4.700     2.800     1.300 peak  3112 spectrum    1 weight  0.10000E+01 volume  0.36230E-03 ppm1      1.584 ppm2      7.162 CV     1
 ASSI { 3113}
   (( segid "    " and resid 59   and name HG2 ))
   (( segid "    " and resid 60   and name HN  ))
      4.600     2.700     1.400 peak  3113 spectrum    1 weight  0.10000E+01 volume  0.52639E-03 ppm1      1.483 ppm2      7.164 CV     1
 ASSI { 3115}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 58   and name HN  ))
      4.600     2.600     1.400 peak  3115 spectrum    1 weight  0.10000E+01 volume  0.67282E-03 ppm1      1.599 ppm2      8.925 CV     1
 ASSI { 3122}
   (( segid "    " and resid 59   and name HG1 ))
   (( segid "    " and resid 57   and name HB1 ))
      6.000     4.400     0.000 peak  3122 spectrum    1 weight  0.10000E+01 volume  0.23545E-03 ppm1      1.592 ppm2      2.417 CV     1
 ASSI { 3124}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 75   and name HE2 ))
      3.600     1.600     1.600 peak  3124 spectrum    1 weight  0.10000E+01 volume  0.11392E-02 ppm1      1.599 ppm2      3.005 CV     1
 OR { 3124}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 75   and name HE1 ))
 OR { 3124}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 75   and name HE1 ))
 OR { 3124}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 75   and name HE2 ))
 ASSI { 3125}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 75   and name HE2 ))
      3.200     3.200     2.800 peak  3125 spectrum    1 weight  0.10000E+01 volume  0.13842E-02 ppm1      1.471 ppm2      2.995 CV     1
 OR { 3125}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 75   and name HE1 ))
 ASSI { 3130}
   (( segid "    " and resid 7    and name HG1 ))
   (( segid "    " and resid 12   and name HN  ))
      3.500     1.500     1.500 peak  3130 spectrum    1 weight  0.10000E+01 volume  0.73914E-03 ppm1      1.599 ppm2      8.118 CV     1
 OR { 3130}
   (( segid "    " and resid 7    and name HG2 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 3135}
   (( segid "    " and resid 20   and name HG1 ))
   (( segid "    " and resid 67   and name HE  ))
      5.700     4.100     0.300 peak  3135 spectrum    1 weight  0.10000E+01 volume  0.86247E-04 ppm1      1.600 ppm2      8.681 CV     1
 ASSI { 3146}
   (  segid "    " and resid 36   and name HD2%)
   (( segid "    " and resid 61   and name HB  ))
      3.800     1.800     1.800 peak  3146 spectrum    1 weight  0.10000E+01 volume  0.45900E-03 ppm1      0.733 ppm2      2.189 CV     1
 ASSI { 3148}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 40   and name HA  ))
      3.900     1.900     1.900 peak  3148 spectrum    1 weight  0.10000E+01 volume  0.10421E-02 ppm1      0.705 ppm2      4.056 CV     1
 ASSI { 3151}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 30   and name HN  ))
      3.500     1.500     1.500 peak  3151 spectrum    1 weight  0.10000E+01 volume  0.15509E-03 ppm1      0.859 ppm2      9.188 CV     1
 ASSI { 3152}
   (  segid "    " and resid 34   and name HD2%)
   (( segid "    " and resid 29   and name HA  ))
      3.400     1.400     1.400 peak  3152 spectrum    1 weight  0.10000E+01 volume  0.19180E-03 ppm1      0.863 ppm2      4.524 CV     1
 ASSI { 3157}
   (  segid "    " and resid 22   and name HD2%)
   (( segid "    " and resid 10   and name HB  ))
      4.900     3.100     1.100 peak  3157 spectrum    1 weight  0.10000E+01 volume  0.22665E-03 ppm1      0.747 ppm2      2.139 CV     1
 ASSI { 3160}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
      3.500     1.500     1.500 peak  3160 spectrum    1 weight  0.10000E+01 volume  0.16971E-03 ppm1      1.839 ppm2      7.397 CV     1
 OR { 3160}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HN  ))
 OR { 3160}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
 OR { 3160}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 64   and name HN  ))
 ASSI { 3163}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 7    and name HD1 ))
      3.700     1.700     1.700 peak  3163 spectrum    1 weight  0.10000E+01 volume  0.31350E-03 ppm1      4.104 ppm2      3.121 CV     1
 OR { 3163}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 7    and name HD2 ))
 ASSI { 3167}
   (( segid "    " and resid 27   and name HB2 ))
   (( segid "    " and resid 27   and name HN  ))
      2.700     0.900     0.900 peak  3167 spectrum    1 weight  0.10000E+01 volume  0.17973E-02 ppm1      1.303 ppm2      8.905 CV     1
 ASSI { 3172}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 9    and name HD2%)
      4.600     2.600     1.400 peak  3172 spectrum    1 weight  0.10000E+01 volume  0.39691E-03 ppm1      2.232 ppm2      0.710 CV     1
 OR { 3172}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 9    and name HD2%)
 ASSI { 3173}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 40   and name HG2 ))
      5.100     3.200     0.900 peak  3173 spectrum    1 weight  0.10000E+01 volume  0.40423E-03 ppm1      0.698 ppm2      2.515 CV     1
 ASSI { 3174}
   (  segid "    " and resid 36   and name HD1%)
   (( segid "    " and resid 40   and name HG1 ))
      5.000     3.100     1.000 peak  3174 spectrum    1 weight  0.10000E+01 volume  0.34007E-03 ppm1      0.698 ppm2      2.930 CV     1
 ASSI { 3175}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 14   and name HN  ))
      3.900     1.900     1.900 peak  3175 spectrum    1 weight  0.10000E+01 volume  0.15920E-02 ppm1      0.986 ppm2      8.820 CV     1
 ASSI { 3176}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 13   and name HN  ))
      2.200     0.600     0.600 peak  3176 spectrum    1 weight  0.10000E+01 volume  0.75503E-02 ppm1      0.986 ppm2      8.258 CV     1
 ASSI { 3177}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 12   and name HN  ))
      4.100     2.100     1.900 peak  3177 spectrum    1 weight  0.10000E+01 volume  0.84052E-03 ppm1      0.988 ppm2      8.155 CV     1
 ASSI { 3179}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 11   and name HN  ))
      5.200     3.400     0.800 peak  3179 spectrum    1 weight  0.10000E+01 volume  0.23587E-03 ppm1      0.986 ppm2      7.787 CV     1
 ASSI { 3180}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 16   and name HN  ))
      5.500     3.800     0.500 peak  3180 spectrum    1 weight  0.10000E+01 volume  0.21474E-03 ppm1      0.983 ppm2      7.595 CV     1
 ASSI { 3181}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 9    and name HA  ))
      3.200     1.300     1.300 peak  3181 spectrum    1 weight  0.10000E+01 volume  0.11214E-02 ppm1      0.986 ppm2      4.025 CV     1
 ASSI { 3182}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 10   and name HA  ))
      3.600     1.600     1.600 peak  3182 spectrum    1 weight  0.10000E+01 volume  0.14713E-02 ppm1      0.986 ppm2      3.321 CV     1
 ASSI { 3183}
   (  segid "    " and resid 13   and name HG2%)
   (  segid "    " and resid 12   and name HB% )
      2.600     0.800     0.800 peak  3183 spectrum    1 weight  0.10000E+01 volume  0.41628E-02 ppm1      0.986 ppm2      1.471 CV     1
 ASSI { 3184}
   (  segid "    " and resid 13   and name HG2%)
   (( segid "    " and resid 9    and name HB1 ))
      3.300     1.300     1.300 peak  3184 spectrum    1 weight  0.10000E+01 volume  0.58488E-03 ppm1      0.986 ppm2      1.580 CV     1
 ASSI { 3185}
   (  segid "    " and resid 13   and name HG2%)
   (  segid "    " and resid 9    and name HD1%)
      3.300     1.300     1.300 peak  3185 spectrum    1 weight  0.10000E+01 volume  0.23284E-02 ppm1      0.986 ppm2      0.581 CV     1
 ASSI { 3186}
   (( segid "    " and resid 58   and name HA  ))
   (( segid "    " and resid 58   and name HG12))
      3.600     1.600     1.600 peak  3186 spectrum    1 weight  0.10000E+01 volume  0.14969E-02 ppm1      3.693 ppm2      1.395 CV     1
 ASSI { 3187}
   (( segid "    " and resid 58   and name HG11))
   (( segid "    " and resid 58   and name HN  ))
      4.100     2.100     1.900 peak  3187 spectrum    1 weight  0.10000E+01 volume  0.43479E-03 ppm1      1.429 ppm2      8.953 CV     1
 ASSI { 3188}
   (( segid "    " and resid 58   and name HG12))
   (( segid "    " and resid 58   and name HN  ))
      4.900     3.000     1.100 peak  3188 spectrum    1 weight  0.10000E+01 volume  0.23446E-03 ppm1      1.377 ppm2      8.947 CV     1
 ASSI { 3192}
   (( segid "    " and resid 58   and name HG12))
   (( segid "    " and resid 58   and name HB  ))
      2.600     0.900     0.900 peak  3192 spectrum    1 weight  0.10000E+01 volume  0.22607E-02 ppm1      1.376 ppm2      1.892 CV     1
 ASSI { 3193}
   (( segid "    " and resid 58   and name HG11))
   (( segid "    " and resid 58   and name HB  ))
      2.800     0.900     0.900 peak  3193 spectrum    1 weight  0.10000E+01 volume  0.22755E-02 ppm1      1.425 ppm2      1.892 CV     1
 OR { 3193}
   (( segid "    " and resid 58   and name HG12))
   (( segid "    " and resid 58   and name HB  ))
 ASSI { 3194}
   (( segid "    " and resid 58   and name HG11))
   (  segid "    " and resid 58   and name HG2%)
      2.900     1.000     1.000 peak  3194 spectrum    1 weight  0.10000E+01 volume  0.22918E-02 ppm1      1.426 ppm2      0.878 CV     1
 ASSI { 3195}
   (( segid "    " and resid 58   and name HG12))
   (  segid "    " and resid 58   and name HG2%)
      2.600     0.800     0.800 peak  3195 spectrum    1 weight  0.10000E+01 volume  0.31712E-02 ppm1      1.375 ppm2      0.877 CV     1
 ASSI { 3196}
   (( segid "    " and resid 58   and name HG12))
   (( segid "    " and resid 59   and name HD2 ))
      4.400     2.400     1.600 peak  3196 spectrum    1 weight  0.10000E+01 volume  0.83668E-03 ppm1      1.378 ppm2      3.153 CV     1
 OR { 3196}
   (( segid "    " and resid 58   and name HG12))
   (( segid "    " and resid 59   and name HD1 ))
 ASSI { 3197}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 61   and name HN  ))
      4.600     2.600     1.400 peak  3197 spectrum    1 weight  0.10000E+01 volume  0.55842E-03 ppm1      0.783 ppm2      7.889 CV     1
 ASSI { 3198}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 62   and name HN  ))
      5.300     3.500     0.700 peak  3198 spectrum    1 weight  0.10000E+01 volume  0.29242E-03 ppm1      0.782 ppm2      7.829 CV     1
 ASSI { 3201}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 58   and name HN  ))
      3.500     3.500     2.500 peak  3201 spectrum    1 weight  0.10000E+01 volume  0.26369E-03 ppm1      0.781 ppm2      8.944 CV     1
 ASSI { 3202}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 59   and name HN  ))
      5.300     3.600     0.700 peak  3202 spectrum    1 weight  0.10000E+01 volume  0.23208E-03 ppm1      0.784 ppm2      8.590 CV     1
 ASSI { 3204}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 59   and name HD2 ))
      3.600     1.600     1.600 peak  3204 spectrum    1 weight  0.10000E+01 volume  0.33614E-02 ppm1      0.783 ppm2      3.152 CV     1
 OR { 3204}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 59   and name HD1 ))
 ASSI { 3205}
   (  segid "    " and resid 58   and name HD1%)
   (( segid "    " and resid 57   and name HD2 ))
      3.700     3.700     2.300 peak  3205 spectrum    1 weight  0.10000E+01 volume  0.25934E-02 ppm1      0.783 ppm2      3.565 CV     1
 ASSI { 3208}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HN  ))
      2.500     0.800     0.800 peak  3208 spectrum    1 weight  0.10000E+01 volume  0.20726E-02 ppm1      4.090 ppm2      7.733 CV     1
 ASSI { 3209}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HN  ))
      3.100     1.200     1.200 peak  3209 spectrum    1 weight  0.10000E+01 volume  0.24607E-02 ppm1      3.965 ppm2      7.734 CV     1
 ASSI { 3210}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 9    and name HD1%)
      4.000     2.000     2.000 peak  3210 spectrum    1 weight  0.10000E+01 volume  0.73086E-03 ppm1      4.089 ppm2      0.576 CV     1
 ASSI { 3211}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 9    and name HD1%)
      3.900     1.900     1.900 peak  3211 spectrum    1 weight  0.10000E+01 volume  0.72717E-03 ppm1      3.964 ppm2      0.577 CV     1
 ASSI { 3213}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 9    and name HD2%)
      4.100     2.100     1.900 peak  3213 spectrum    1 weight  0.10000E+01 volume  0.39097E-03 ppm1      3.962 ppm2      0.694 CV     1
 ASSI { 3214}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 10   and name HG2%)
      3.100     3.100     2.900 peak  3214 spectrum    1 weight  0.10000E+01 volume  0.31299E-03 ppm1      4.093 ppm2      0.950 CV     1
 ASSI { 3215}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 10   and name HG2%)
      3.200     3.200     2.800 peak  3215 spectrum    1 weight  0.10000E+01 volume  0.26389E-03 ppm1      3.963 ppm2      0.953 CV     1
 ASSI { 3217}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.800     1.800     1.800 peak  3217 spectrum    1 weight  0.10000E+01 volume  0.35729E-03 ppm1      4.094 ppm2      8.475 CV     1
 ASSI { 3218}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
      3.800     1.800     1.800 peak  3218 spectrum    1 weight  0.10000E+01 volume  0.49442E-03 ppm1      4.088 ppm2      7.935 CV     1
 ASSI { 3221}
   (( segid "    " and resid 57   and name HD1 ))
   (( segid "    " and resid 56   and name HN  ))
      4.200     2.200     1.800 peak  3221 spectrum    1 weight  0.10000E+01 volume  0.31412E-03 ppm1      3.827 ppm2      8.239 CV     1
 ASSI { 3222}
   (( segid "    " and resid 57   and name HD2 ))
   (( segid "    " and resid 56   and name HN  ))
      3.200     3.200     2.800 peak  3222 spectrum    1 weight  0.10000E+01 volume  0.27492E-03 ppm1      3.544 ppm2      8.239 CV     1
 ASSI { 3223}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 58   and name HN  ))
      3.500     1.500     1.500 peak  3223 spectrum    1 weight  0.10000E+01 volume  0.39571E-03 ppm1      2.408 ppm2      8.944 CV     1
 ASSI { 3226}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 56   and name HA  ))
      5.400     3.600     0.600 peak  3226 spectrum    1 weight  0.10000E+01 volume  0.40327E-03 ppm1      2.403 ppm2      4.919 CV     1
 ASSI { 3229}
   (( segid "    " and resid 57   and name HB1 ))
   (( segid "    " and resid 59   and name HB2 ))
      5.400     3.600     0.600 peak  3229 spectrum    1 weight  0.10000E+01 volume  0.27308E-03 ppm1      2.407 ppm2      1.680 CV     1
 ASSI { 3232}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 8    and name HA  ))
      4.800     2.900     1.200 peak  3232 spectrum    1 weight  0.10000E+01 volume  0.26577E-03 ppm1      0.701 ppm2      4.577 CV     1
 ASSI { 3242}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 69   and name HB2 ))
      4.700     2.700     1.300 peak  3242 spectrum    1 weight  0.10000E+01 volume  0.81727E-03 ppm1      0.572 ppm2      1.148 CV     1
 ASSI { 3246}
   (  segid "    " and resid 9    and name HD2%)
   (( segid "    " and resid 73   and name HB1 ))
      4.200     2.200     1.800 peak  3246 spectrum    1 weight  0.10000E+01 volume  0.75044E-03 ppm1      0.701 ppm2      4.094 CV     1
 ASSI { 3247}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 6    and name HE21))
      3.900     1.900     1.900 peak  3247 spectrum    1 weight  0.10000E+01 volume  0.60357E-03 ppm1      0.572 ppm2      6.781 CV     1
 ASSI { 3249}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 72   and name HN  ))
      4.200     2.200     1.800 peak  3249 spectrum    1 weight  0.10000E+01 volume  0.42114E-03 ppm1      0.574 ppm2      7.996 CV     1
 ASSI { 3251}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 73   and name HN  ))
      4.900     3.000     1.100 peak  3251 spectrum    1 weight  0.10000E+01 volume  0.20330E-03 ppm1      0.574 ppm2      7.736 CV     1
 ASSI { 3252}
   (  segid "    " and resid 9    and name HD1%)
   (( segid "    " and resid 9    and name HN  ))
      4.000     2.000     2.000 peak  3252 spectrum    1 weight  0.10000E+01 volume  0.67342E-03 ppm1      0.572 ppm2      8.475 CV     1
 ASSI { 3254}
   (( segid "    " and resid 9    and name HG  ))
   (( segid "    " and resid 9    and name HN  ))
      2.900     1.000     1.000 peak  3254 spectrum    1 weight  0.10000E+01 volume  0.10792E-02 ppm1      1.448 ppm2      8.472 CV     1
 ASSI { 3256}
   (( segid "    " and resid 19   and name HG11))
   (( segid "    " and resid 19   and name HG12))
      1.500     0.300     0.700 peak  3256 spectrum    1 weight  0.10000E+01 volume  0.91631E-02 ppm1      1.462 ppm2      1.013 CV     1
 ASSI { 3260}
   (( segid "    " and resid 74   and name HB1 ))
   (  segid "    " and resid 54   and name HD2%)
      4.100     2.100     1.900 peak  3260 spectrum    1 weight  0.10000E+01 volume  0.22424E-03 ppm1      3.960 ppm2      0.835 CV     1
 ASSI {    9}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      5.100     3.300     0.900 peak     9 spectrum    1 weight  0.10000E+01 volume  0.24599E-03 ppm1      8.553 ppm2      9.165 CV     1
 ASSI {   15}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA  ))
      3.000     1.100     1.100 peak    15 spectrum    1 weight  0.10000E+01 volume  0.15096E-02 ppm1      8.880 ppm2      4.033 CV     1
 ASSI {   26}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      2.300     0.700     0.700 peak    26 spectrum    1 weight  0.10000E+01 volume  0.19569E-02 ppm1      7.132 ppm2      8.588 CV     1
 ASSI {   27}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      4.200     2.200     1.800 peak    27 spectrum    1 weight  0.10000E+01 volume  0.23600E-03 ppm1      7.132 ppm2      8.949 CV     1
 ASSI {   28}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      2.100     0.500     0.500 peak    28 spectrum    1 weight  0.10000E+01 volume  0.34841E-02 ppm1      7.132 ppm2      7.892 CV     1
 ASSI {   50}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      2.300     0.700     0.700 peak    50 spectrum    1 weight  0.10000E+01 volume  0.46820E-02 ppm1      7.367 ppm2      8.337 CV     1
 ASSI {   51}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      4.600     2.700     1.400 peak    51 spectrum    1 weight  0.10000E+01 volume  0.68716E-03 ppm1      7.367 ppm2      8.882 CV     1
 ASSI {   52}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      4.500     2.600     1.500 peak    52 spectrum    1 weight  0.10000E+01 volume  0.56772E-03 ppm1      7.367 ppm2      9.165 CV     1
 ASSI {   55}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      2.700     0.900     0.900 peak    55 spectrum    1 weight  0.10000E+01 volume  0.15987E-02 ppm1      8.834 ppm2      8.049 CV     1
 ASSI {   56}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 17   and name HN  ))
      4.700     2.800     1.300 peak    56 spectrum    1 weight  0.10000E+01 volume  0.18390E-03 ppm1      8.830 ppm2      7.679 CV     1
 ASSI {   62}
   (( segid "    " and resid 9    and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      2.700     0.900     0.900 peak    62 spectrum    1 weight  0.10000E+01 volume  0.15061E-02 ppm1      8.436 ppm2      7.882 CV     1
 ASSI {   65}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      3.500     1.500     1.500 peak    65 spectrum    1 weight  0.10000E+01 volume  0.66247E-03 ppm1      7.881 ppm2      8.134 CV     1
 ASSI {   66}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      4.600     2.600     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.26174E-03 ppm1      7.883 ppm2      8.239 CV     1
 ASSI {   68}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
      2.300     0.700     0.700 peak    68 spectrum    1 weight  0.10000E+01 volume  0.35483E-02 ppm1      7.881 ppm2      7.792 CV     1
 ASSI {   70}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      5.000     3.100     1.000 peak    70 spectrum    1 weight  0.10000E+01 volume  0.16694E-03 ppm1      7.787 ppm2      8.012 CV     1
 ASSI {   71}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      2.400     0.700     0.700 peak    71 spectrum    1 weight  0.10000E+01 volume  0.26649E-02 ppm1      7.787 ppm2      8.135 CV     1
 ASSI {   73}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 9    and name HN  ))
      4.500     2.500     1.500 peak    73 spectrum    1 weight  0.10000E+01 volume  0.29922E-03 ppm1      7.787 ppm2      8.438 CV     1
 ASSI {   74}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      4.500     2.500     1.500 peak    74 spectrum    1 weight  0.10000E+01 volume  0.53791E-03 ppm1      7.787 ppm2      8.251 CV     1
 ASSI {   75}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      2.200     0.600     0.600 peak    75 spectrum    1 weight  0.10000E+01 volume  0.25803E-02 ppm1      8.134 ppm2      8.240 CV     1
 ASSI {   77}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      4.700     2.800     1.300 peak    77 spectrum    1 weight  0.10000E+01 volume  0.36038E-03 ppm1      8.134 ppm2      8.831 CV     1
 ASSI {   80}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      2.300     0.700     0.700 peak    80 spectrum    1 weight  0.10000E+01 volume  0.25894E-02 ppm1      8.242 ppm2      8.834 CV     1
 ASSI {   81}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      3.700     1.700     1.700 peak    81 spectrum    1 weight  0.10000E+01 volume  0.69253E-03 ppm1      8.241 ppm2      4.103 CV     1
 ASSI {   82}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 9    and name HA  ))
      4.200     2.200     1.800 peak    82 spectrum    1 weight  0.10000E+01 volume  0.33617E-03 ppm1      8.241 ppm2      4.000 CV     1
 ASSI {   83}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      2.700     0.900     0.900 peak    83 spectrum    1 weight  0.10000E+01 volume  0.19623E-02 ppm1      8.242 ppm2      3.537 CV     1
 ASSI {   84}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.200     1.300     1.300 peak    84 spectrum    1 weight  0.10000E+01 volume  0.93560E-03 ppm1      8.241 ppm2      3.317 CV     1
 ASSI {   88}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      4.000     2.000     2.000 peak    88 spectrum    1 weight  0.10000E+01 volume  0.43689E-03 ppm1      7.697 ppm2      8.009 CV     1
 ASSI {   97}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      1.800     0.400     0.400 peak    97 spectrum    1 weight  0.10000E+01 volume  0.57300E-02 ppm1      7.566 ppm2      8.564 CV     1
 ASSI {  102}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      6.000     4.800     0.000 peak   102 spectrum    1 weight  0.10000E+01 volume  0.95299E-04 ppm1      8.173 ppm2      7.342 CV     1
 ASSI {  103}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.400     0.700     0.700 peak   103 spectrum    1 weight  0.10000E+01 volume  0.34610E-02 ppm1      8.171 ppm2      8.522 CV     1
 ASSI {  104}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      2.500     0.800     0.800 peak   104 spectrum    1 weight  0.10000E+01 volume  0.31646E-02 ppm1      8.221 ppm2      7.339 CV     1
 ASSI {  105}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      5.000     3.100     1.000 peak   105 spectrum    1 weight  0.10000E+01 volume  0.19285E-03 ppm1      8.220 ppm2      8.521 CV     1
 ASSI {  108}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      4.100     2.100     1.900 peak   108 spectrum    1 weight  0.10000E+01 volume  0.80731E-03 ppm1      7.340 ppm2      8.428 CV     1
 ASSI {  109}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      6.000     4.900     0.000 peak   109 spectrum    1 weight  0.10000E+01 volume  0.10100E-03 ppm1      7.343 ppm2      8.528 CV     1
 ASSI {  110}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD22))
      4.500     2.600     1.500 peak   110 spectrum    1 weight  0.10000E+01 volume  0.37012E-03 ppm1      8.428 ppm2      7.522 CV     1
 ASSI {  112}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD21))
      4.600     2.600     1.400 peak   112 spectrum    1 weight  0.10000E+01 volume  0.21506E-03 ppm1      8.429 ppm2      6.964 CV     1
 ASSI {  113}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      4.300     2.300     1.700 peak   113 spectrum    1 weight  0.10000E+01 volume  0.61193E-03 ppm1      8.429 ppm2      8.880 CV     1
 ASSI {  119}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      2.500     0.800     0.800 peak   119 spectrum    1 weight  0.10000E+01 volume  0.27076E-02 ppm1      8.335 ppm2      8.882 CV     1
 ASSI {  121}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HD21))
      4.800     2.900     1.200 peak   121 spectrum    1 weight  0.10000E+01 volume  0.15135E-03 ppm1      8.328 ppm2      6.972 CV     1
 ASSI {  123}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      4.000     2.000     2.000 peak   123 spectrum    1 weight  0.10000E+01 volume  0.42339E-03 ppm1      9.166 ppm2      8.085 CV     1
 ASSI {  132}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      2.800     1.000     1.000 peak   132 spectrum    1 weight  0.10000E+01 volume  0.15403E-02 ppm1      8.484 ppm2      8.082 CV     1
 ASSI {  133}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      4.700     2.700     1.300 peak   133 spectrum    1 weight  0.10000E+01 volume  0.29918E-03 ppm1      8.484 ppm2      7.586 CV     1
 ASSI {  134}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      5.700     4.100     0.300 peak   134 spectrum    1 weight  0.10000E+01 volume  0.94702E-04 ppm1      8.486 ppm2      7.685 CV     1
 ASSI {  135}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      3.400     1.400     1.400 peak   135 spectrum    1 weight  0.10000E+01 volume  0.24617E-02 ppm1      8.080 ppm2      7.584 CV     1
 ASSI {  136}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      5.300     3.500     0.700 peak   136 spectrum    1 weight  0.10000E+01 volume  0.23425E-03 ppm1      8.078 ppm2      7.696 CV     1
 ASSI {  137}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      4.900     3.000     1.100 peak   137 spectrum    1 weight  0.10000E+01 volume  0.19292E-03 ppm1      8.083 ppm2      8.580 CV     1
 ASSI {  140}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      2.700     0.900     0.900 peak   140 spectrum    1 weight  0.10000E+01 volume  0.19048E-02 ppm1      7.579 ppm2      8.082 CV     1
 ASSI {  141}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      4.200     2.300     1.800 peak   141 spectrum    1 weight  0.10000E+01 volume  0.35591E-03 ppm1      7.575 ppm2      8.479 CV     1
 ASSI {  142}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 30   and name HN  ))
      4.100     2.100     1.900 peak   142 spectrum    1 weight  0.10000E+01 volume  0.63926E-04 ppm1      7.578 ppm2      9.165 CV     1
 ASSI {  143}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
      4.400     2.400     1.600 peak   143 spectrum    1 weight  0.10000E+01 volume  0.80587E-03 ppm1      7.583 ppm2      7.682 CV     1
 ASSI {  145}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      2.600     0.900     0.900 peak   145 spectrum    1 weight  0.10000E+01 volume  0.19196E-02 ppm1      8.369 ppm2      7.779 CV     1
 ASSI {  151}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      3.400     3.400     2.600 peak   151 spectrum    1 weight  0.10000E+01 volume  0.17736E-02 ppm1      8.431 ppm2      8.144 CV     1
 ASSI {  155}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      2.500     0.800     0.800 peak   155 spectrum    1 weight  0.10000E+01 volume  0.25264E-02 ppm1      8.142 ppm2      7.931 CV     1
 ASSI {  157}
   (( segid "    " and resid 47   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      2.000     0.500     0.500 peak   157 spectrum    1 weight  0.10000E+01 volume  0.50126E-02 ppm1      7.934 ppm2      8.156 CV     1
 ASSI {  171}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      4.000     2.000     2.000 peak   171 spectrum    1 weight  0.10000E+01 volume  0.84019E-03 ppm1      7.591 ppm2      8.523 CV     1
 ASSI {  174}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      4.200     2.200     1.800 peak   174 spectrum    1 weight  0.10000E+01 volume  0.50615E-03 ppm1      8.224 ppm2      8.522 CV     1
 ASSI {  175}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      2.600     0.900     0.900 peak   175 spectrum    1 weight  0.10000E+01 volume  0.12900E-02 ppm1      8.586 ppm2      8.941 CV     1
 ASSI {  178}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.700     1.700     1.700 peak   178 spectrum    1 weight  0.10000E+01 volume  0.53794E-03 ppm1      7.893 ppm2      8.588 CV     1
 ASSI {  179}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      4.600     2.700     1.400 peak   179 spectrum    1 weight  0.10000E+01 volume  0.18361E-03 ppm1      7.894 ppm2      8.946 CV     1
 ASSI {  180}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      4.700     2.700     1.300 peak   180 spectrum    1 weight  0.10000E+01 volume  0.21148E-03 ppm1      7.895 ppm2      6.818 CV     1
 ASSI {  182}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HE22))
      3.500     1.500     1.500 peak   182 spectrum    1 weight  0.10000E+01 volume  0.28147E-03 ppm1      7.858 ppm2      7.389 CV     1
 ASSI {  184}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 63   and name HN  ))
      2.600     0.800     0.800 peak   184 spectrum    1 weight  0.10000E+01 volume  0.16453E-02 ppm1      7.858 ppm2      6.815 CV     1
 ASSI {  186}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 64   and name HN  ))
      1.500     0.300     0.700 peak   186 spectrum    1 weight  0.10000E+01 volume  0.28020E-01 ppm1      6.810 ppm2      7.362 CV     1
 ASSI {  191}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      5.000     3.200     1.000 peak   191 spectrum    1 weight  0.10000E+01 volume  0.32996E-03 ppm1      7.400 ppm2      7.878 CV     1
 ASSI {  193}
   (( segid "    " and resid 64   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
      4.500     2.500     1.500 peak   193 spectrum    1 weight  0.10000E+01 volume  0.39730E-03 ppm1      7.400 ppm2      6.372 CV     1
 ASSI {  194}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
      4.600     2.700     1.400 peak   194 spectrum    1 weight  0.10000E+01 volume  0.18859E-03 ppm1      8.822 ppm2      7.915 CV     1
 ASSI {  195}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      3.200     1.300     1.300 peak   195 spectrum    1 weight  0.10000E+01 volume  0.11308E-02 ppm1      8.818 ppm2      8.909 CV     1
 ASSI {  197}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HE  ))
      6.000     4.600     0.000 peak   197 spectrum    1 weight  0.10000E+01 volume  0.99300E-04 ppm1      8.908 ppm2      8.652 CV     1
 ASSI {  198}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      5.500     3.800     0.500 peak   198 spectrum    1 weight  0.10000E+01 volume  0.93494E-04 ppm1      8.909 ppm2      8.328 CV     1
 ASSI {  200}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 68   and name HN  ))
      2.600     0.800     0.800 peak   200 spectrum    1 weight  0.10000E+01 volume  0.14822E-02 ppm1      8.909 ppm2      7.908 CV     1
 ASSI {  202}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      4.200     2.200     1.800 peak   202 spectrum    1 weight  0.10000E+01 volume  0.18713E-03 ppm1      7.905 ppm2      8.805 CV     1
 ASSI {  203}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      2.200     0.600     0.600 peak   203 spectrum    1 weight  0.10000E+01 volume  0.48776E-02 ppm1      8.325 ppm2      7.939 CV     1
 ASSI {  206}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      4.900     3.000     1.100 peak   206 spectrum    1 weight  0.10000E+01 volume  0.19321E-03 ppm1      7.949 ppm2      7.706 CV     1
 ASSI {  216}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      2.900     1.000     1.000 peak   216 spectrum    1 weight  0.10000E+01 volume  0.26554E-02 ppm1      7.916 ppm2      8.139 CV     1
 ASSI {  217}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HN  ))
      2.500     0.800     0.800 peak   217 spectrum    1 weight  0.10000E+01 volume  0.35450E-02 ppm1      7.916 ppm2      7.710 CV     1
 ASSI {  219}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.300     1.400     1.400 peak   219 spectrum    1 weight  0.10000E+01 volume  0.11487E-02 ppm1      8.180 ppm2      8.484 CV     1
 ASSI {  220}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.500     1.500     1.500 peak   220 spectrum    1 weight  0.10000E+01 volume  0.80404E-03 ppm1      8.183 ppm2      8.343 CV     1
 ASSI {  224}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HN  ))
      3.500     1.500     1.500 peak   224 spectrum    1 weight  0.10000E+01 volume  0.13793E-02 ppm1      8.023 ppm2      8.489 CV     1
 ASSI {  225}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      3.000     1.100     1.100 peak   225 spectrum    1 weight  0.10000E+01 volume  0.20237E-02 ppm1      8.024 ppm2      8.290 CV     1
 ASSI {  228}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      2.400     0.700     0.700 peak   228 spectrum    1 weight  0.10000E+01 volume  0.54328E-02 ppm1      8.393 ppm2      4.391 CV     1
 ASSI {  230}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      4.700     2.800     1.300 peak   230 spectrum    1 weight  0.10000E+01 volume  0.34778E-03 ppm1      8.266 ppm2      4.398 CV     1
 ASSI {  231}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.700     0.900     0.900 peak   231 spectrum    1 weight  0.10000E+01 volume  0.35456E-02 ppm1      8.267 ppm2      4.282 CV     1
 ASSI {  234}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      2.800     1.000     1.000 peak   234 spectrum    1 weight  0.10000E+01 volume  0.23072E-02 ppm1      8.324 ppm2      4.397 CV     1
 ASSI {  237}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HN  ))
      4.200     2.200     1.800 peak   237 spectrum    1 weight  0.10000E+01 volume  0.67525E-03 ppm1      8.177 ppm2      8.528 CV     1
 ASSI {  243}
   (( segid "    " and resid 32   and name HN  ))
   (  segid "    " and resid 65   and name HG2%)
      6.000     4.700     0.000 peak   243 spectrum    1 weight  0.10000E+01 volume  0.86061E-04 ppm1      8.483 ppm2      0.975 CV     1

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          HT1       GLY   1  -7.691   3.329  16.872
    2   2H    GLY   1          HT2       GLY   1  -7.950   3.348  18.522
    3   3H    GLY   1          HT3       GLY   1  -9.204   3.773  17.469
    4   1HA   GLY   1          HA1       GLY   1  -7.950   1.113  17.855
    5   2HA   GLY   1          HA2       GLY   1  -9.604   1.555  18.254
    6    H    ASP   2           HN       ASP   2 -10.262   3.006  15.910
    7    HA   ASP   2           HA       ASP   2  -9.866   1.028  13.800
    8   1HB   ASP   2          HB2       ASP   2 -12.069   0.592  14.800
    9   2HB   ASP   2          HB1       ASP   2 -12.502   2.285  14.616
   10    H    GLY   3           HN       GLY   3  -9.773   1.915  11.713
   11   1HA   GLY   3          HA2       GLY   3  -9.086   4.724  11.768
   12   2HA   GLY   3          HA1       GLY   3  -8.721   3.568  10.495
   13    H    GLU   4           HN       GLU   4 -10.499   6.135  11.291
   14    HA   GLU   4           HA       GLU   4 -12.935   5.589   9.813
   15   1HB   GLU   4          HB2       GLU   4 -11.742   8.114  10.967
   16   2HB   GLU   4          HB1       GLU   4 -13.287   8.056  10.131
   17   1HG   GLU   4          HG2       GLU   4 -12.652   6.457  12.587
   18   2HG   GLU   4          HG1       GLU   4 -13.398   8.053  12.621
   19    H    ALA   5           HN       ALA   5  -9.810   6.944   9.346
   20    HA   ALA   5           HA       ALA   5 -10.429   7.471   6.541
   21   1HB   ALA   5          HB1       ALA   5 -10.163   9.590   7.732
   22   2HB   ALA   5          HB2       ALA   5  -8.814   9.320   6.631
   23   3HB   ALA   5          HB3       ALA   5  -8.606   9.054   8.360
   24    H    GLN   6           HN       GLN   6  -8.677   7.018   5.140
   25    HA   GLN   6           HA       GLN   6  -6.347   5.768   6.259
   26   1HB   GLN   6          HB2       GLN   6  -7.854   3.884   6.066
   27   2HB   GLN   6          HB1       GLN   6  -8.291   4.348   4.432
   28   1HG   GLN   6          HG2       GLN   6  -6.114   3.775   3.625
   29   2HG   GLN   6          HG1       GLN   6  -5.532   3.511   5.266
   30   1HE2  GLN   6          HE21      GLN   6  -6.114   1.647   6.352
   31   2HE2  GLN   6          HE22      GLN   6  -6.794   0.320   5.461
   32    H    ARG   7           HN       ARG   7  -4.641   5.836   4.883
   33    HA   ARG   7           HA       ARG   7  -4.972   7.661   2.607
   34   1HB   ARG   7          HB2       ARG   7  -2.600   8.182   2.919
   35   2HB   ARG   7          HB1       ARG   7  -3.527   8.495   4.379
   36   1HG   ARG   7          HG2       ARG   7  -2.727   6.404   5.346
   37   2HG   ARG   7          HG1       ARG   7  -1.815   6.064   3.878
   38   1HD   ARG   7          HD2       ARG   7  -0.360   6.969   5.598
   39   2HD   ARG   7          HD1       ARG   7  -0.486   8.086   4.244
   40    HE   ARG   7           HE       ARG   7  -2.191   9.272   5.670
   41   1HH1  ARG   7          HH11      ARG   7   0.409   7.343   7.130
   42   2HH1  ARG   7          HH12      ARG   7   0.615   8.339   8.476
   43   1HH2  ARG   7          HH21      ARG   7  -2.000  10.621   7.623
   44   2HH2  ARG   7          HH22      ARG   7  -0.835  10.212   8.800
   45    H    ASP   8           HN       ASP   8  -3.316   7.310   0.879
   46    HA   ASP   8           HA       ASP   8  -3.314   4.586  -0.042
   47   1HB   ASP   8          HB2       ASP   8  -1.620   6.908  -1.043
   48   2HB   ASP   8          HB1       ASP   8  -1.840   5.374  -1.847
   49    H    LEU   9           HN       LEU   9  -1.573   3.182   0.013
   50    HA   LEU   9           HA       LEU   9   0.186   3.553   2.181
   51   1HB   LEU   9          HB2       LEU   9   0.244   1.470   0.012
   52   2HB   LEU   9          HB1       LEU   9   1.168   1.407   1.504
   53    HG   LEU   9           HG       LEU   9  -1.840   1.354   1.291
   54   1HD1  LEU   9          HD11      LEU   9   0.122  -0.801   2.025
   55   2HD1  LEU   9          HD12      LEU   9  -0.844  -0.714   0.545
   56   3HD1  LEU   9          HD13      LEU   9  -1.635  -0.919   2.110
   57   1HD2  LEU   9          HD21      LEU   9  -0.037   1.129   3.688
   58   2HD2  LEU   9          HD22      LEU   9  -1.795   0.929   3.690
   59   3HD2  LEU   9          HD23      LEU   9  -1.076   2.496   3.292
   60    H    VAL  10           HN       VAL  10   0.328   4.702  -0.905
   61    HA   VAL  10           HA       VAL  10   3.124   4.705  -1.308
   62    HB   VAL  10           HB       VAL  10   0.960   6.501  -2.458
   63   1HG1  VAL  10          HG11      VAL  10   3.134   7.630  -2.603
   64   2HG1  VAL  10          HG12      VAL  10   2.571   7.123  -4.195
   65   3HG1  VAL  10          HG13      VAL  10   3.828   6.202  -3.370
   66   1HG2  VAL  10          HG21      VAL  10   0.725   4.173  -3.009
   67   2HG2  VAL  10          HG22      VAL  10   2.397   4.110  -3.574
   68   3HG2  VAL  10          HG23      VAL  10   1.207   5.093  -4.432
   69    H    LYS  11           HN       LYS  11   0.898   6.776   0.449
   70    HA   LYS  11           HA       LYS  11   2.952   8.774   0.843
   71   1HB   LYS  11          HB2       LYS  11   0.141   8.560   1.883
   72   2HB   LYS  11          HB1       LYS  11   1.212   9.875   2.355
   73   1HG   LYS  11          HG2       LYS  11  -0.168  10.770   0.658
   74   2HG   LYS  11          HG1       LYS  11   1.352  10.411  -0.152
   75   1HD   LYS  11          HD2       LYS  11   0.376   8.287  -0.962
   76   2HD   LYS  11          HD1       LYS  11  -1.140   8.732  -0.172
   77   1HE   LYS  11          HE2       LYS  11   0.200  10.258  -2.407
   78   2HE   LYS  11          HE1       LYS  11  -1.193   9.195  -2.581
   79   1HZ   LYS  11          HZ1       LYS  11  -2.401  10.795  -1.023
   80   2HZ   LYS  11          HZ2       LYS  11  -2.009  11.342  -2.523
   81   3HZ   LYS  11          HZ3       LYS  11  -1.068  11.838  -1.213
   82    H    ALA  12           HN       ALA  12   2.706   5.882   1.931
   83    HA   ALA  12           HA       ALA  12   3.728   6.535   4.601
   84   1HB   ALA  12          HB1       ALA  12   2.954   4.323   5.343
   85   2HB   ALA  12          HB2       ALA  12   2.291   4.015   3.739
   86   3HB   ALA  12          HB3       ALA  12   1.612   5.298   4.745
   87    H    VAL  13           HN       VAL  13   3.768   3.825   2.285
   88    HA   VAL  13           HA       VAL  13   6.311   2.882   3.089
   89    HB   VAL  13           HB       VAL  13   4.657   2.253   0.633
   90   1HG1  VAL  13          HG11      VAL  13   6.961   1.663   0.246
   91   2HG1  VAL  13          HG12      VAL  13   5.996   0.199   0.466
   92   3HG1  VAL  13          HG13      VAL  13   7.035   0.780   1.775
   93   1HG2  VAL  13          HG21      VAL  13   3.990   0.247   1.880
   94   2HG2  VAL  13          HG22      VAL  13   3.515   1.731   2.712
   95   3HG2  VAL  13          HG23      VAL  13   4.915   0.817   3.271
   96    H    ALA  14           HN       ALA  14   5.181   4.604   0.190
   97    HA   ALA  14           HA       ALA  14   7.764   4.757  -0.953
   98   1HB   ALA  14          HB1       ALA  14   6.788   6.435  -2.509
   99   2HB   ALA  14          HB2       ALA  14   5.336   6.484  -1.489
  100   3HB   ALA  14          HB3       ALA  14   5.757   5.008  -2.333
  101    H    HIS  15           HN       HIS  15   6.043   6.620   1.359
  102    HA   HIS  15           HA       HIS  15   7.730   8.904   1.216
  103   1HB   HIS  15          HB2       HIS  15   5.413   8.981   2.122
  104   2HB   HIS  15          HB1       HIS  15   5.949   8.045   3.510
  105    HD1  HIS  15           HD1      HIS  15   5.751   9.697   5.355
  106    HD2  HIS  15           HD2      HIS  15   7.704  11.290   2.055
  107    HE1  HIS  15           HE1      HIS  15   6.574  11.958   6.076
  108    HE2  HIS  15           HE2      HIS  15   7.977  12.757   4.159
  109    H    ILE  16           HN       ILE  16   8.099   5.797   2.648
  110    HA   ILE  16           HA       ILE  16  10.123   6.500   4.553
  111    HB   ILE  16           HB       ILE  16   9.666   3.832   3.152
  112   1HG1  ILE  16          HG12      ILE  16   7.646   4.474   4.361
  113   2HG1  ILE  16          HG11      ILE  16   8.433   3.129   5.175
  114   1HG2  ILE  16          HG21      ILE  16  11.870   3.940   4.142
  115   2HG2  ILE  16          HG22      ILE  16  10.853   2.819   5.048
  116   3HG2  ILE  16          HG23      ILE  16  11.181   4.428   5.691
  117   1HD1  ILE  16          HD11      ILE  16   7.571   4.740   6.766
  118   2HD1  ILE  16          HD12      ILE  16   8.522   6.020   6.015
  119   3HD1  ILE  16          HD13      ILE  16   9.333   4.689   6.842
  120    H    LEU  17           HN       LEU  17   9.987   5.724   1.186
  121    HA   LEU  17           HA       LEU  17  12.864   5.721   0.772
  122   1HB   LEU  17          HB2       LEU  17  10.513   5.585  -1.107
  123   2HB   LEU  17          HB1       LEU  17  12.188   5.518  -1.620
  124    HG   LEU  17           HG       LEU  17  11.018   3.503   0.285
  125   1HD1  LEU  17          HD11      LEU  17   9.728   3.476  -1.792
  126   2HD1  LEU  17          HD12      LEU  17  10.746   2.042  -1.650
  127   3HD1  LEU  17          HD13      LEU  17  11.223   3.360  -2.722
  128   1HD2  LEU  17          HD21      LEU  17  13.435   3.705   0.220
  129   2HD2  LEU  17          HD22      LEU  17  13.417   3.505  -1.535
  130   3HD2  LEU  17          HD23      LEU  17  12.910   2.178  -0.487
  131    H    GLY  18           HN       GLY  18  10.435   7.960   1.052
  132   1HA   GLY  18          HA2       GLY  18  10.543  10.275   0.925
  133   2HA   GLY  18          HA1       GLY  18  12.120  10.124   0.154
  134    H    ILE  19           HN       ILE  19   9.314   8.417  -1.005
  135    HA   ILE  19           HA       ILE  19   9.176  10.269  -3.243
  136    HB   ILE  19           HB       ILE  19   8.285   8.157  -4.462
  137   1HG1  ILE  19          HG12      ILE  19  10.141   6.914  -2.440
  138   2HG1  ILE  19          HG11      ILE  19   8.434   6.571  -2.688
  139   1HG2  ILE  19          HG21      ILE  19  11.227   8.716  -4.073
  140   2HG2  ILE  19          HG22      ILE  19  10.142   9.478  -5.244
  141   3HG2  ILE  19          HG23      ILE  19  10.554   7.772  -5.404
  142   1HD1  ILE  19          HD11      ILE  19  10.648   5.975  -4.632
  143   2HD1  ILE  19          HD12      ILE  19   8.936   5.623  -4.874
  144   3HD1  ILE  19          HD13      ILE  19   9.833   4.811  -3.589
  145    H    ARG  20           HN       ARG  20   7.173   9.920  -4.517
  146    HA   ARG  20           HA       ARG  20   4.781   8.919  -3.384
  147   1HB   ARG  20          HB2       ARG  20   5.161  10.883  -1.864
  148   2HB   ARG  20          HB1       ARG  20   5.075  11.919  -3.285
  149   1HG   ARG  20          HG2       ARG  20   2.800  10.864  -3.698
  150   2HG   ARG  20          HG1       ARG  20   2.921  10.260  -2.050
  151   1HD   ARG  20          HD2       ARG  20   3.076  13.151  -2.877
  152   2HD   ARG  20          HD1       ARG  20   1.702  12.365  -2.112
  153    HE   ARG  20           HE       ARG  20   3.646  11.931  -0.329
  154   1HH1  ARG  20          HH11      ARG  20   2.954  14.908  -2.128
  155   2HH1  ARG  20          HH12      ARG  20   3.134  15.935  -0.778
  156   1HH2  ARG  20          HH21      ARG  20   3.965  13.385   1.543
  157   2HH2  ARG  20          HH22      ARG  20   3.772  15.044   1.307
  158    H    ASP  21           HN       ASP  21   6.297  11.426  -5.287
  159    HA   ASP  21           HA       ASP  21   4.172  11.425  -7.243
  160   1HB   ASP  21          HB2       ASP  21   5.001  13.563  -6.618
  161   2HB   ASP  21          HB1       ASP  21   6.662  13.073  -6.914
  162    H    LEU  22           HN       LEU  22   7.539  10.463  -6.997
  163    HA   LEU  22           HA       LEU  22   8.772   8.942  -8.172
  164   1HB   LEU  22          HB2       LEU  22   6.058   8.219  -9.277
  165   2HB   LEU  22          HB1       LEU  22   7.508   7.436  -9.851
  166    HG   LEU  22           HG       LEU  22   6.338   6.046  -8.252
  167   1HD1  LEU  22          HD11      LEU  22   8.711   5.861  -8.368
  168   2HD1  LEU  22          HD12      LEU  22   8.155   5.586  -6.713
  169   3HD1  LEU  22          HD13      LEU  22   8.899   7.124  -7.162
  170   1HD2  LEU  22          HD21      LEU  22   6.156   6.650  -5.899
  171   2HD2  LEU  22          HD22      LEU  22   5.240   7.769  -6.917
  172   3HD2  LEU  22          HD23      LEU  22   6.806   8.247  -6.262
  173    H    ALA  23           HN       ALA  23   8.492  11.627  -9.071
  174    HA   ALA  23           HA       ALA  23   8.080  12.149 -11.696
  175   1HB   ALA  23          HB1       ALA  23   9.612  14.009 -11.509
  176   2HB   ALA  23          HB2       ALA  23  10.364  13.272 -10.093
  177   3HB   ALA  23          HB3       ALA  23   8.693  13.834 -10.012
  178    H    GLY  24           HN       GLY  24  10.938  10.870 -10.386
  179   1HA   GLY  24          HA2       GLY  24  11.636   9.890 -13.064
  180   2HA   GLY  24          HA1       GLY  24  12.884  10.742 -12.145
  181    H    ILE  25           HN       ILE  25  10.497   8.540 -10.819
  182    HA   ILE  25           HA       ILE  25  12.694   6.690 -10.289
  183    HB   ILE  25           HB       ILE  25  10.320   7.121  -8.418
  184   1HG1  ILE  25          HG12      ILE  25  12.152   7.864  -6.760
  185   2HG1  ILE  25          HG11      ILE  25  13.183   8.062  -8.163
  186   1HG2  ILE  25          HG21      ILE  25  12.774   5.401  -8.082
  187   2HG2  ILE  25          HG22      ILE  25  11.131   4.840  -8.384
  188   3HG2  ILE  25          HG23      ILE  25  11.519   5.649  -6.865
  189   1HD1  ILE  25          HD11      ILE  25  12.249  10.181  -7.455
  190   2HD1  ILE  25          HD12      ILE  25  10.617   9.540  -7.607
  191   3HD1  ILE  25          HD13      ILE  25  11.621   9.741  -9.045
  192    H    ASN  26           HN       ASN  26  12.370   4.708 -10.919
  193    HA   ASN  26           HA       ASN  26  10.314   4.121 -12.773
  194   1HB   ASN  26          HB2       ASN  26  12.643   3.224 -12.821
  195   2HB   ASN  26          HB1       ASN  26  12.228   2.191 -11.461
  196   1HD2  ASN  26          HD21      ASN  26  11.873   2.758 -14.839
  197   2HD2  ASN  26          HD22      ASN  26  11.110   1.262 -15.204
  198    H    LEU  27           HN       LEU  27   8.504   2.833 -12.671
  199    HA   LEU  27           HA       LEU  27   7.525   2.170  -9.977
  200   1HB   LEU  27          HB2       LEU  27   6.109   2.852 -12.528
  201   2HB   LEU  27          HB1       LEU  27   5.278   2.119 -11.172
  202    HG   LEU  27           HG       LEU  27   6.710   4.777 -11.072
  203   1HD1  LEU  27          HD11      LEU  27   3.768   4.114 -11.240
  204   2HD1  LEU  27          HD12      LEU  27   4.735   4.836 -12.525
  205   3HD1  LEU  27          HD13      LEU  27   4.457   5.724 -11.024
  206   1HD2  LEU  27          HD21      LEU  27   4.871   3.394  -9.121
  207   2HD2  LEU  27          HD22      LEU  27   5.552   5.004  -8.936
  208   3HD2  LEU  27          HD23      LEU  27   6.614   3.593  -8.925
  209    H    ASP  28           HN       ASP  28   8.951   0.559 -12.410
  210    HA   ASP  28           HA       ASP  28   7.168  -1.779 -12.319
  211   1HB   ASP  28          HB2       ASP  28   9.676  -1.251 -13.938
  212   2HB   ASP  28          HB1       ASP  28   8.770  -2.757 -13.974
  213    H    SER  29           HN       SER  29   9.760  -0.437 -10.807
  214    HA   SER  29           HA       SER  29  11.391  -2.644 -10.225
  215   1HB   SER  29          HB2       SER  29  10.982  -0.134  -8.620
  216   2HB   SER  29          HB1       SER  29  12.409  -1.175  -8.643
  217    HG   SER  29           HG       SER  29  12.108  -0.595 -11.106
  218    H    SER  30           HN       SER  30  11.185  -4.168  -8.740
  219    HA   SER  30           HA       SER  30   8.866  -4.613  -7.214
  220   1HB   SER  30          HB2       SER  30  11.651  -5.682  -6.747
  221   2HB   SER  30          HB1       SER  30  10.126  -6.459  -6.312
  222    HG   SER  30           HG       SER  30   9.721  -6.265  -8.725
  223    H    LEU  31           HN       LEU  31   8.680  -4.493  -4.850
  224    HA   LEU  31           HA       LEU  31   9.586  -2.069  -3.769
  225   1HB   LEU  31          HB2       LEU  31   7.495  -3.181  -3.087
  226   2HB   LEU  31          HB1       LEU  31   8.415  -4.474  -2.355
  227    HG   LEU  31           HG       LEU  31   9.246  -2.969  -0.634
  228   1HD1  LEU  31          HD11      LEU  31   7.657  -0.897  -2.097
  229   2HD1  LEU  31          HD12      LEU  31   9.420  -1.002  -1.976
  230   3HD1  LEU  31          HD13      LEU  31   8.452  -0.670  -0.524
  231   1HD2  LEU  31          HD21      LEU  31   6.277  -2.669  -1.038
  232   2HD2  LEU  31          HD22      LEU  31   7.146  -2.437   0.479
  233   3HD2  LEU  31          HD23      LEU  31   7.083  -4.035  -0.268
  234    H    ALA  32           HN       ALA  32  10.855  -5.298  -3.601
  235    HA   ALA  32           HA       ALA  32  12.692  -4.702  -1.513
  236   1HB   ALA  32          HB1       ALA  32  12.853  -6.922  -3.548
  237   2HB   ALA  32          HB2       ALA  32  12.055  -7.016  -1.978
  238   3HB   ALA  32          HB3       ALA  32  13.804  -6.809  -2.067
  239    H    ASP  33           HN       ASP  33  12.685  -4.307  -4.937
  240    HA   ASP  33           HA       ASP  33  15.471  -3.889  -5.331
  241   1HB   ASP  33          HB2       ASP  33  14.030  -4.380  -7.244
  242   2HB   ASP  33          HB1       ASP  33  13.058  -2.953  -6.914
  243    H    LEU  34           HN       LEU  34  12.692  -1.964  -4.583
  244    HA   LEU  34           HA       LEU  34  13.800   0.603  -4.679
  245   1HB   LEU  34          HB2       LEU  34  11.649  -0.366  -2.804
  246   2HB   LEU  34          HB1       LEU  34  11.904   1.279  -3.355
  247    HG   LEU  34           HG       LEU  34  10.986  -1.043  -5.032
  248   1HD1  LEU  34          HD11      LEU  34   9.526   1.387  -4.068
  249   2HD1  LEU  34          HD12      LEU  34   9.319  -0.287  -3.534
  250   3HD1  LEU  34          HD13      LEU  34   8.897   0.164  -5.185
  251   1HD2  LEU  34          HD21      LEU  34  12.346   0.453  -6.327
  252   2HD2  LEU  34          HD22      LEU  34  11.369   1.839  -5.805
  253   3HD2  LEU  34          HD23      LEU  34  10.649   0.547  -6.790
  254    H    GLY  35           HN       GLY  35  13.371  -1.625  -1.958
  255   1HA   GLY  35          HA2       GLY  35  15.840  -1.304  -0.797
  256   2HA   GLY  35          HA1       GLY  35  14.907   0.045  -0.183
  257    H    LEU  36           HN       LEU  36  12.808  -2.549  -0.664
  258    HA   LEU  36           HA       LEU  36  12.498  -2.866   2.079
  259   1HB   LEU  36          HB2       LEU  36  10.526  -3.241   1.177
  260   2HB   LEU  36          HB1       LEU  36  11.105  -3.951  -0.285
  261    HG   LEU  36           HG       LEU  36  11.414  -6.117   1.009
  262   1HD1  LEU  36          HD11      LEU  36  11.614  -5.217   3.250
  263   2HD1  LEU  36          HD12      LEU  36  10.289  -6.379   3.145
  264   3HD1  LEU  36          HD13      LEU  36   9.946  -4.648   3.186
  265   1HD2  LEU  36          HD21      LEU  36   9.467  -5.736  -0.353
  266   2HD2  LEU  36          HD22      LEU  36   8.663  -4.928   0.993
  267   3HD2  LEU  36          HD23      LEU  36   9.047  -6.646   1.096
  268    H    ASP  37           HN       ASP  37  13.590  -3.728   3.387
  269    HA   ASP  37           HA       ASP  37  14.370  -6.506   3.152
  270   1HB   ASP  37          HB2       ASP  37  16.480  -5.462   2.621
  271   2HB   ASP  37          HB1       ASP  37  16.301  -4.311   3.946
  272    H    SER  38           HN       SER  38  14.103  -3.607   5.191
  273    HA   SER  38           HA       SER  38  13.380  -5.409   7.387
  274   1HB   SER  38          HB2       SER  38  14.703  -2.707   7.646
  275   2HB   SER  38          HB1       SER  38  14.345  -3.837   8.949
  276    HG   SER  38           HG       SER  38  15.960  -4.712   6.801
  277    H    LEU  39           HN       LEU  39  13.103  -1.840   7.218
  278    HA   LEU  39           HA       LEU  39  10.633  -1.879   8.593
  279   1HB   LEU  39          HB2       LEU  39  12.219  -0.063   8.836
  280   2HB   LEU  39          HB1       LEU  39  12.037   0.350   7.146
  281    HG   LEU  39           HG       LEU  39   9.642   0.906   7.606
  282   1HD1  LEU  39          HD11      LEU  39   8.958   1.308   9.916
  283   2HD1  LEU  39          HD12      LEU  39  10.472   0.606  10.485
  284   3HD1  LEU  39          HD13      LEU  39   9.309  -0.394   9.616
  285   1HD2  LEU  39          HD21      LEU  39  11.324   2.622   7.429
  286   2HD2  LEU  39          HD22      LEU  39  11.729   2.443   9.138
  287   3HD2  LEU  39          HD23      LEU  39  10.139   3.055   8.661
  288    H    MET  40           HN       MET  40  11.474  -1.707   5.235
  289    HA   MET  40           HA       MET  40   8.939  -0.660   4.369
  290   1HB   MET  40          HB2       MET  40  11.117  -1.962   2.743
  291   2HB   MET  40          HB1       MET  40   9.780  -0.982   2.134
  292   1HG   MET  40          HG2       MET  40  10.590   0.954   3.284
  293   2HG   MET  40          HG1       MET  40  11.870   0.012   4.039
  294   1HE   MET  40          HE1       MET  40  13.841   1.452   3.359
  295   2HE   MET  40          HE2       MET  40  12.664   2.631   2.783
  296   3HE   MET  40          HE3       MET  40  14.030   2.181   1.764
  297    H    GLY  41           HN       GLY  41   9.559  -3.466   5.678
  298   1HA   GLY  41          HA2       GLY  41   7.335  -4.741   4.231
  299   2HA   GLY  41          HA1       GLY  41   8.647  -5.661   4.973
  300    H    VAL  42           HN       VAL  42   8.886  -4.035   7.325
  301    HA   VAL  42           HA       VAL  42   6.922  -5.292   8.948
  302    HB   VAL  42           HB       VAL  42   8.792  -3.014   9.688
  303   1HG1  VAL  42          HG11      VAL  42   6.963  -3.215  11.254
  304   2HG1  VAL  42          HG12      VAL  42   8.468  -3.753  12.004
  305   3HG1  VAL  42          HG13      VAL  42   7.284  -4.938  11.449
  306   1HG2  VAL  42          HG21      VAL  42  10.041  -4.953   8.927
  307   2HG2  VAL  42          HG22      VAL  42   9.160  -5.979  10.062
  308   3HG2  VAL  42          HG23      VAL  42  10.240  -4.719  10.663
  309    H    GLU  43           HN       GLU  43   7.470  -1.948   7.961
  310    HA   GLU  43           HA       GLU  43   5.378  -0.736   9.318
  311   1HB   GLU  43          HB2       GLU  43   7.191   0.441   8.079
  312   2HB   GLU  43          HB1       GLU  43   6.460  -0.068   6.567
  313   1HG   GLU  43          HG2       GLU  43   5.855   2.196   6.946
  314   2HG   GLU  43          HG1       GLU  43   4.429   1.192   7.210
  315    H    VAL  44           HN       VAL  44   5.522  -2.264   6.170
  316    HA   VAL  44           HA       VAL  44   2.920  -1.709   5.273
  317    HB   VAL  44           HB       VAL  44   4.671  -4.093   4.594
  318   1HG1  VAL  44          HG11      VAL  44   3.340  -4.232   2.534
  319   2HG1  VAL  44          HG12      VAL  44   2.291  -2.944   3.153
  320   3HG1  VAL  44          HG13      VAL  44   2.370  -4.497   3.985
  321   1HG2  VAL  44          HG21      VAL  44   4.356  -1.432   3.217
  322   2HG2  VAL  44          HG22      VAL  44   5.302  -2.794   2.616
  323   3HG2  VAL  44          HG23      VAL  44   5.770  -1.986   4.115
  324    H    ARG  45           HN       ARG  45   4.222  -4.637   6.796
  325    HA   ARG  45           HA       ARG  45   1.803  -5.993   7.008
  326   1HB   ARG  45          HB2       ARG  45   4.381  -6.190   8.505
  327   2HB   ARG  45          HB1       ARG  45   3.040  -7.238   8.919
  328   1HG   ARG  45          HG2       ARG  45   3.017  -8.076   6.601
  329   2HG   ARG  45          HG1       ARG  45   4.393  -7.032   6.232
  330   1HD   ARG  45          HD2       ARG  45   4.391  -9.166   8.355
  331   2HD   ARG  45          HD1       ARG  45   5.001  -9.396   6.717
  332    HE   ARG  45           HE       ARG  45   6.610  -7.609   7.222
  333   1HH1  ARG  45          HH11      ARG  45   5.134  -9.278   9.987
  334   2HH1  ARG  45          HH12      ARG  45   6.502  -9.131  10.986
  335   1HH2  ARG  45          HH21      ARG  45   8.536  -7.508   8.567
  336   2HH2  ARG  45          HH22      ARG  45   8.504  -8.107  10.157
  337    H    GLN  46           HN       GLN  46   3.375  -3.831   9.336
  338    HA   GLN  46           HA       GLN  46   1.433  -4.241  11.360
  339   1HB   GLN  46          HB2       GLN  46   3.249  -1.850  10.957
  340   2HB   GLN  46          HB1       GLN  46   2.333  -2.192  12.412
  341   1HG   GLN  46          HG2       GLN  46   4.564  -3.876  11.292
  342   2HG   GLN  46          HG1       GLN  46   4.690  -2.767  12.648
  343   1HE2  GLN  46          HE21      GLN  46   3.550  -5.839  11.559
  344   2HE2  GLN  46          HE22      GLN  46   3.182  -6.506  13.096
  345    H    ILE  47           HN       ILE  47   1.421  -2.266   8.500
  346    HA   ILE  47           HA       ILE  47  -0.778  -0.629   9.373
  347    HB   ILE  47           HB       ILE  47   0.324  -1.112   6.565
  348   1HG1  ILE  47          HG12      ILE  47   0.654   1.274   8.403
  349   2HG1  ILE  47          HG11      ILE  47   1.874   0.059   8.023
  350   1HG2  ILE  47          HG21      ILE  47  -2.019  -0.476   6.432
  351   2HG2  ILE  47          HG22      ILE  47  -0.992   0.832   5.853
  352   3HG2  ILE  47          HG23      ILE  47  -1.713   0.929   7.458
  353   1HD1  ILE  47          HD11      ILE  47   2.236   2.128   6.773
  354   2HD1  ILE  47          HD12      ILE  47   0.642   1.954   6.032
  355   3HD1  ILE  47          HD13      ILE  47   1.902   0.762   5.706
  356    H    LEU  48           HN       LEU  48  -0.375  -3.092   6.882
  357    HA   LEU  48           HA       LEU  48  -3.112  -3.220   6.339
  358   1HB   LEU  48          HB2       LEU  48  -0.886  -5.030   5.519
  359   2HB   LEU  48          HB1       LEU  48  -2.543  -5.402   5.114
  360    HG   LEU  48           HG       LEU  48  -1.561  -4.389   3.222
  361   1HD1  LEU  48          HD11      LEU  48  -3.269  -2.354   4.609
  362   2HD1  LEU  48          HD12      LEU  48  -3.830  -3.714   3.633
  363   3HD1  LEU  48          HD13      LEU  48  -2.924  -2.397   2.880
  364   1HD2  LEU  48          HD21      LEU  48  -0.517  -2.183   3.234
  365   2HD2  LEU  48          HD22      LEU  48   0.342  -3.300   4.299
  366   3HD2  LEU  48          HD23      LEU  48  -0.740  -2.084   4.979
  367    H    GLU  49           HN       GLU  49  -1.223  -5.276   8.496
  368    HA   GLU  49           HA       GLU  49  -3.233  -7.188   8.914
  369   1HB   GLU  49          HB2       GLU  49  -1.038  -6.269  10.774
  370   2HB   GLU  49          HB1       GLU  49  -2.082  -7.640  11.102
  371   1HG   GLU  49          HG2       GLU  49  -1.213  -8.792   9.133
  372   2HG   GLU  49          HG1       GLU  49  -0.210  -7.390   8.755
  373    H    ARG  50           HN       ARG  50  -2.809  -3.992  10.253
  374    HA   ARG  50           HA       ARG  50  -4.936  -4.485  12.196
  375   1HB   ARG  50          HB2       ARG  50  -3.008  -2.200  11.872
  376   2HB   ARG  50          HB1       ARG  50  -4.414  -2.075  12.905
  377   1HG   ARG  50          HG2       ARG  50  -2.489  -2.577  14.237
  378   2HG   ARG  50          HG1       ARG  50  -3.558  -3.976  14.240
  379   1HD   ARG  50          HD2       ARG  50  -2.140  -5.078  12.614
  380   2HD   ARG  50          HD1       ARG  50  -1.117  -3.649  12.506
  381    HE   ARG  50           HE       ARG  50  -1.131  -4.349  15.154
  382   1HH1  ARG  50          HH11      ARG  50  -0.242  -5.997  12.155
  383   2HH1  ARG  50          HH12      ARG  50   1.014  -6.894  12.881
  384   1HH2  ARG  50          HH21      ARG  50   0.650  -5.520  16.097
  385   2HH2  ARG  50          HH22      ARG  50   1.530  -6.636  15.154
  386    H    GLU  51           HN       GLU  51  -4.277  -2.641   9.321
  387    HA   GLU  51           HA       GLU  51  -6.620  -1.052   9.416
  388   1HB   GLU  51          HB2       GLU  51  -4.855  -1.814   7.104
  389   2HB   GLU  51          HB1       GLU  51  -6.174  -0.660   7.029
  390   1HG   GLU  51          HG2       GLU  51  -3.763  -0.387   8.799
  391   2HG   GLU  51          HG1       GLU  51  -3.964   0.369   7.217
  392    H    HIS  52           HN       HIS  52  -5.813  -4.020   7.641
  393    HA   HIS  52           HA       HIS  52  -8.692  -4.337   7.098
  394   1HB   HIS  52          HB2       HIS  52  -7.476  -3.237   5.209
  395   2HB   HIS  52          HB1       HIS  52  -6.484  -4.673   5.064
  396    HD1  HIS  52           HD1      HIS  52 -10.112  -3.616   4.747
  397    HD2  HIS  52           HD2      HIS  52  -7.519  -6.555   3.365
  398    HE1  HIS  52           HE1      HIS  52 -11.352  -4.818   2.937
  399    HE2  HIS  52           HE2      HIS  52  -9.927  -6.797   2.445
  400    H    ASP  53           HN       ASP  53  -6.128  -5.653   8.579
  401    HA   ASP  53           HA       ASP  53  -5.485  -7.676   9.331
  402   1HB   ASP  53          HB2       ASP  53  -7.965  -7.911   9.781
  403   2HB   ASP  53          HB1       ASP  53  -8.120  -8.726   8.229
  404    H    LEU  54           HN       LEU  54  -4.997  -6.811   6.610
  405    HA   LEU  54           HA       LEU  54  -4.862  -9.267   5.054
  406   1HB   LEU  54          HB2       LEU  54  -5.718  -7.200   4.038
  407   2HB   LEU  54          HB1       LEU  54  -4.158  -6.448   4.297
  408    HG   LEU  54           HG       LEU  54  -3.122  -8.065   2.759
  409   1HD1  LEU  54          HD11      LEU  54  -4.673  -9.932   3.108
  410   2HD1  LEU  54          HD12      LEU  54  -4.534  -9.518   1.398
  411   3HD1  LEU  54          HD13      LEU  54  -5.953  -9.012   2.313
  412   1HD2  LEU  54          HD21      LEU  54  -3.930  -5.927   1.965
  413   2HD2  LEU  54          HD22      LEU  54  -5.522  -6.644   1.693
  414   3HD2  LEU  54          HD23      LEU  54  -4.135  -7.180   0.729
  415    H    VAL  55           HN       VAL  55  -3.226 -10.357   6.186
  416    HA   VAL  55           HA       VAL  55  -0.682  -8.998   6.173
  417    HB   VAL  55           HB       VAL  55  -1.086  -9.965   8.303
  418   1HG1  VAL  55          HG11      VAL  55  -1.468 -12.592   6.935
  419   2HG1  VAL  55          HG12      VAL  55  -2.691 -11.587   7.735
  420   3HG1  VAL  55          HG13      VAL  55  -1.401 -12.325   8.689
  421   1HG2  VAL  55          HG21      VAL  55   1.220 -10.043   7.584
  422   2HG2  VAL  55          HG22      VAL  55   0.962 -11.616   6.827
  423   3HG2  VAL  55          HG23      VAL  55   0.857 -11.452   8.582
  424    H    LEU  56           HN       LEU  56  -0.036  -8.880   4.275
  425    HA   LEU  56           HA       LEU  56   0.521 -11.355   2.868
  426   1HB   LEU  56          HB2       LEU  56   0.899  -8.476   1.995
  427   2HB   LEU  56          HB1       LEU  56   1.238  -9.881   1.007
  428    HG   LEU  56           HG       LEU  56  -1.469  -8.939   1.944
  429   1HD1  LEU  56          HD11      LEU  56  -0.553  -7.663   0.105
  430   2HD1  LEU  56          HD12      LEU  56  -1.900  -8.659  -0.438
  431   3HD1  LEU  56          HD13      LEU  56  -0.240  -9.148  -0.788
  432   1HD2  LEU  56          HD21      LEU  56  -2.392 -10.797   0.644
  433   2HD2  LEU  56          HD22      LEU  56  -1.392 -11.376   1.978
  434   3HD2  LEU  56          HD23      LEU  56  -0.760 -11.390   0.330
  435    HA   PRO  57           HA       PRO  57   4.420 -11.031   4.886
  436   1HB   PRO  57          HB2       PRO  57   5.062 -13.439   3.343
  437   2HB   PRO  57          HB1       PRO  57   4.917 -13.251   5.091
  438   1HG   PRO  57          HG2       PRO  57   3.060 -14.611   3.757
  439   2HG   PRO  57          HG1       PRO  57   2.586 -13.465   5.040
  440   1HD   PRO  57          HD2       PRO  57   2.673 -12.978   2.082
  441   2HD   PRO  57          HD1       PRO  57   1.311 -12.753   3.214
  442    H    ILE  58           HN       ILE  58   6.748 -11.413   4.172
  443    HA   ILE  58           HA       ILE  58   7.315  -9.305   2.456
  444    HB   ILE  58           HB       ILE  58   9.125 -11.335   3.764
  445   1HG1  ILE  58          HG12      ILE  58  10.003  -9.170   4.823
  446   2HG1  ILE  58          HG11      ILE  58   8.606  -8.432   4.037
  447   1HG2  ILE  58          HG21      ILE  58  10.085  -9.117   1.973
  448   2HG2  ILE  58          HG22      ILE  58  10.233 -10.846   1.663
  449   3HG2  ILE  58          HG23      ILE  58  11.098 -10.115   3.017
  450   1HD1  ILE  58          HD11      ILE  58   8.208  -8.924   6.414
  451   2HD1  ILE  58          HD12      ILE  58   8.468 -10.637   6.087
  452   3HD1  ILE  58          HD13      ILE  58   7.102  -9.797   5.351
  453    H    ARG  59           HN       ARG  59   7.524 -12.734   1.782
  454    HA   ARG  59           HA       ARG  59   8.686 -12.569  -0.714
  455   1HB   ARG  59          HB2       ARG  59   7.795 -14.763  -1.271
  456   2HB   ARG  59          HB1       ARG  59   8.366 -14.720   0.383
  457   1HG   ARG  59          HG2       ARG  59   5.453 -14.507  -0.368
  458   2HG   ARG  59          HG1       ARG  59   6.279 -16.025  -0.029
  459   1HD   ARG  59          HD2       ARG  59   6.004 -13.714   1.870
  460   2HD   ARG  59          HD1       ARG  59   5.044 -15.197   1.916
  461    HE   ARG  59           HE       ARG  59   7.968 -15.346   2.153
  462   1HH1  ARG  59          HH11      ARG  59   4.780 -16.012   3.597
  463   2HH1  ARG  59          HH12      ARG  59   5.441 -16.558   5.066
  464   1HH2  ARG  59          HH21      ARG  59   8.825 -16.175   4.177
  465   2HH2  ARG  59          HH22      ARG  59   7.746 -16.725   5.371
  466    H    GLU  60           HN       GLU  60   5.471 -11.631   0.095
  467    HA   GLU  60           HA       GLU  60   4.782 -11.448  -2.744
  468   1HB   GLU  60          HB2       GLU  60   3.070 -11.025  -0.292
  469   2HB   GLU  60          HB1       GLU  60   2.505 -10.948  -1.956
  470   1HG   GLU  60          HG2       GLU  60   3.189 -13.311  -2.238
  471   2HG   GLU  60          HG1       GLU  60   3.583 -13.356  -0.522
  472    H    VAL  61           HN       VAL  61   5.062  -9.547   0.203
  473    HA   VAL  61           HA       VAL  61   4.372  -7.042  -0.795
  474    HB   VAL  61           HB       VAL  61   6.240  -7.771   1.496
  475   1HG1  VAL  61          HG11      VAL  61   5.884  -5.506   2.350
  476   2HG1  VAL  61          HG12      VAL  61   4.976  -5.095   0.895
  477   3HG1  VAL  61          HG13      VAL  61   6.697  -5.465   0.785
  478   1HG2  VAL  61          HG21      VAL  61   3.977  -8.555   1.756
  479   2HG2  VAL  61          HG22      VAL  61   3.358  -6.937   1.424
  480   3HG2  VAL  61          HG23      VAL  61   4.305  -7.238   2.881
  481    H    ARG  62           HN       ARG  62   7.342  -8.791  -1.089
  482    HA   ARG  62           HA       ARG  62   9.014  -6.697  -1.758
  483   1HB   ARG  62          HB2       ARG  62   9.143  -9.613  -2.288
  484   2HB   ARG  62          HB1       ARG  62  10.320  -8.539  -3.037
  485   1HG   ARG  62          HG2       ARG  62  10.995  -7.710  -0.912
  486   2HG   ARG  62          HG1       ARG  62   9.728  -8.625  -0.115
  487   1HD   ARG  62          HD2       ARG  62  11.935  -9.734   0.074
  488   2HD   ARG  62          HD1       ARG  62  10.705 -10.720  -0.701
  489    HE   ARG  62           HE       ARG  62  11.880  -9.769  -2.841
  490   1HH1  ARG  62          HH11      ARG  62  13.527 -10.569   0.172
  491   2HH1  ARG  62          HH12      ARG  62  14.873 -11.268  -0.572
  492   1HH2  ARG  62          HH21      ARG  62  13.664 -10.829  -3.895
  493   2HH2  ARG  62          HH22      ARG  62  14.940 -11.454  -2.932
  494    H    GLN  63           HN       GLN  63   6.441  -7.898  -3.642
  495    HA   GLN  63           HA       GLN  63   7.705  -6.815  -6.053
  496   1HB   GLN  63          HB2       GLN  63   5.512  -8.883  -5.866
  497   2HB   GLN  63          HB1       GLN  63   5.984  -8.097  -7.365
  498   1HG   GLN  63          HG2       GLN  63   7.090 -10.163  -7.362
  499   2HG   GLN  63          HG1       GLN  63   8.312  -8.970  -6.938
  500   1HE2  GLN  63          HE21      GLN  63   5.855 -10.211  -4.808
  501   2HE2  GLN  63          HE22      GLN  63   6.916 -11.067  -3.749
  502    H    LEU  64           HN       LEU  64   5.973  -5.712  -3.745
  503    HA   LEU  64           HA       LEU  64   3.813  -4.560  -5.203
  504   1HB   LEU  64          HB2       LEU  64   5.036  -3.607  -2.607
  505   2HB   LEU  64          HB1       LEU  64   3.460  -3.166  -3.234
  506    HG   LEU  64           HG       LEU  64   4.312  -5.861  -2.211
  507   1HD1  LEU  64          HD11      LEU  64   2.345  -3.862  -1.141
  508   2HD1  LEU  64          HD12      LEU  64   3.925  -4.261  -0.465
  509   3HD1  LEU  64          HD13      LEU  64   2.644  -5.472  -0.483
  510   1HD2  LEU  64          HD21      LEU  64   1.988  -6.569  -2.566
  511   2HD2  LEU  64          HD22      LEU  64   2.781  -6.151  -4.085
  512   3HD2  LEU  64          HD23      LEU  64   1.644  -5.026  -3.346
  513    H    THR  65           HN       THR  65   4.325  -3.319  -6.874
  514    HA   THR  65           HA       THR  65   6.829  -2.065  -7.206
  515    HB   THR  65           HB       THR  65   5.631  -1.480  -9.394
  516    HG1  THR  65           HG1      THR  65   3.552  -2.029  -9.446
  517   1HG2  THR  65          HG21      THR  65   7.159  -3.378  -9.059
  518   2HG2  THR  65          HG22      THR  65   5.793  -3.832 -10.108
  519   3HG2  THR  65          HG23      THR  65   5.810  -4.295  -8.395
  520    H    LEU  66           HN       LEU  66   5.803  -0.787  -5.125
  521    HA   LEU  66           HA       LEU  66   5.552   1.236  -4.205
  522   1HB   LEU  66          HB2       LEU  66   7.278   1.738  -6.095
  523   2HB   LEU  66          HB1       LEU  66   5.948   2.563  -6.877
  524    HG   LEU  66           HG       LEU  66   7.437   4.103  -5.656
  525   1HD1  LEU  66          HD11      LEU  66   5.740   5.315  -4.390
  526   2HD1  LEU  66          HD12      LEU  66   4.698   3.892  -4.437
  527   3HD1  LEU  66          HD13      LEU  66   5.106   4.734  -5.935
  528   1HD2  LEU  66          HD21      LEU  66   8.157   2.588  -3.911
  529   2HD2  LEU  66          HD22      LEU  66   6.531   2.573  -3.229
  530   3HD2  LEU  66          HD23      LEU  66   7.478   4.061  -3.213
  531    H    ARG  67           HN       ARG  67   3.986   1.721  -7.407
  532    HA   ARG  67           HA       ARG  67   1.817   3.014  -6.047
  533   1HB   ARG  67          HB2       ARG  67   2.162   2.305  -8.953
  534   2HB   ARG  67          HB1       ARG  67   0.693   3.025  -8.322
  535   1HG   ARG  67          HG2       ARG  67   3.443   4.253  -8.285
  536   2HG   ARG  67          HG1       ARG  67   2.097   4.709  -9.331
  537   1HD   ARG  67          HD2       ARG  67   0.814   5.146  -7.134
  538   2HD   ARG  67          HD1       ARG  67   2.386   5.061  -6.370
  539    HE   ARG  67           HE       ARG  67   2.945   6.856  -8.232
  540   1HH1  ARG  67          HH11      ARG  67   0.143   6.831  -5.989
  541   2HH1  ARG  67          HH12      ARG  67  -0.095   8.490  -6.176
  542   1HH2  ARG  67          HH21      ARG  67   2.517   9.043  -8.433
  543   2HH2  ARG  67          HH22      ARG  67   1.223   9.797  -7.583
  544    H    LYS  68           HN       LYS  68   2.568  -0.177  -6.787
  545    HA   LYS  68           HA       LYS  68  -0.096  -1.160  -6.783
  546   1HB   LYS  68          HB2       LYS  68   1.853  -2.566  -7.492
  547   2HB   LYS  68          HB1       LYS  68   2.359  -2.628  -5.803
  548   1HG   LYS  68          HG2       LYS  68   0.314  -3.754  -5.189
  549   2HG   LYS  68          HG1       LYS  68  -0.273  -3.635  -6.844
  550   1HD   LYS  68          HD2       LYS  68   1.575  -5.051  -7.589
  551   2HD   LYS  68          HD1       LYS  68   2.154  -5.161  -5.925
  552   1HE   LYS  68          HE2       LYS  68   0.853  -7.135  -6.476
  553   2HE   LYS  68          HE1       LYS  68   0.055  -6.145  -5.247
  554   1HZ   LYS  68          HZ1       LYS  68  -1.441  -7.013  -7.060
  555   2HZ   LYS  68          HZ2       LYS  68  -0.638  -5.976  -8.128
  556   3HZ   LYS  68          HZ3       LYS  68  -1.511  -5.339  -6.853
  557    H    LEU  69           HN       LEU  69   2.072  -0.108  -4.380
  558    HA   LEU  69           HA       LEU  69   0.885  -1.114  -2.033
  559   1HB   LEU  69          HB2       LEU  69   2.381   1.442  -2.518
  560   2HB   LEU  69          HB1       LEU  69   1.604   1.180  -0.979
  561    HG   LEU  69           HG       LEU  69   3.908   0.680  -0.767
  562   1HD1  LEU  69          HD11      LEU  69   2.337  -1.866  -0.830
  563   2HD1  LEU  69          HD12      LEU  69   2.445  -0.714   0.502
  564   3HD1  LEU  69          HD13      LEU  69   3.873  -1.624   0.000
  565   1HD2  LEU  69          HD21      LEU  69   3.592  -1.266  -3.046
  566   2HD2  LEU  69          HD22      LEU  69   5.036  -1.078  -2.052
  567   3HD2  LEU  69          HD23      LEU  69   4.496   0.248  -3.081
  568    H    GLN  70           HN       GLN  70  -0.016   1.732  -3.921
  569    HA   GLN  70           HA       GLN  70  -2.144   2.316  -2.067
  570   1HB   GLN  70          HB2       GLN  70  -2.818   4.088  -3.684
  571   2HB   GLN  70          HB1       GLN  70  -1.169   4.230  -3.094
  572   1HG   GLN  70          HG2       GLN  70  -0.293   3.418  -5.106
  573   2HG   GLN  70          HG1       GLN  70  -1.901   3.011  -5.748
  574   1HE2  GLN  70          HE21      GLN  70  -1.588   4.319  -7.535
  575   2HE2  GLN  70          HE22      GLN  70  -1.653   6.032  -7.440
  576    H    GLU  71           HN       GLU  71  -1.750   0.374  -4.793
  577    HA   GLU  71           HA       GLU  71  -4.494   0.272  -5.552
  578   1HB   GLU  71          HB2       GLU  71  -2.753  -0.240  -7.184
  579   2HB   GLU  71          HB1       GLU  71  -2.117  -1.511  -6.168
  580   1HG   GLU  71          HG2       GLU  71  -4.908  -1.773  -7.153
  581   2HG   GLU  71          HG1       GLU  71  -3.594  -1.984  -8.307
  582    H    MET  72           HN       MET  72  -2.440  -1.546  -3.426
  583    HA   MET  72           HA       MET  72  -4.768  -3.101  -2.537
  584   1HB   MET  72          HB2       MET  72  -3.151  -4.492  -1.308
  585   2HB   MET  72          HB1       MET  72  -2.819  -4.454  -3.032
  586   1HG   MET  72          HG2       MET  72  -0.948  -3.071  -2.747
  587   2HG   MET  72          HG1       MET  72  -1.385  -2.665  -1.091
  588   1HE   MET  72          HE1       MET  72  -0.645  -5.925   0.843
  589   2HE   MET  72          HE2       MET  72  -2.190  -5.365   0.204
  590   3HE   MET  72          HE3       MET  72  -1.080  -4.220   0.957
  591    H    SER  73           HN       SER  73  -4.298  -0.245  -1.910
  592    HA   SER  73           HA       SER  73  -3.278   0.036   0.689
  593   1HB   SER  73          HB2       SER  73  -4.336   2.307   0.635
  594   2HB   SER  73          HB1       SER  73  -3.429   1.927  -0.810
  595    HG   SER  73           HG       SER  73  -5.214   1.884  -1.992
  596    H    SER  74           HN       SER  74  -6.341  -0.966  -0.510
  597    HA   SER  74           HA       SER  74  -7.880  -2.245   0.444
  598   1HB   SER  74          HB2       SER  74  -6.594  -1.626   3.108
  599   2HB   SER  74          HB1       SER  74  -7.931  -2.754   2.873
  600    HG   SER  74           HG       SER  74  -5.436  -2.926   1.551
  601    H    LYS  75           HN       LYS  75  -7.786   0.736   0.179
  602    HA   LYS  75           HA       LYS  75 -10.340   1.221   1.524
  603   1HB   LYS  75          HB2       LYS  75  -9.960   3.639   0.955
  604   2HB   LYS  75          HB1       LYS  75  -8.759   2.980   2.051
  605   1HG   LYS  75          HG2       LYS  75  -7.155   2.812   0.273
  606   2HG   LYS  75          HG1       LYS  75  -8.362   3.307  -0.912
  607   1HD   LYS  75          HD2       LYS  75  -8.514   5.486   0.096
  608   2HD   LYS  75          HD1       LYS  75  -7.438   4.996   1.403
  609   1HE   LYS  75          HE2       LYS  75  -6.261   6.324  -0.268
  610   2HE   LYS  75          HE1       LYS  75  -5.626   4.688  -0.177
  611   1HZ   LYS  75          HZ1       LYS  75  -5.811   5.453  -2.415
  612   2HZ   LYS  75          HZ2       LYS  75  -7.478   5.710  -2.293
  613   3HZ   LYS  75          HZ3       LYS  75  -6.858   4.145  -2.230
  614    H    ALA  76           HN       ALA  76 -12.111   1.202   0.365
  615    HA   ALA  76           HA       ALA  76 -13.555   0.961  -1.357
  616   1HB   ALA  76          HB1       ALA  76 -13.272   2.382  -3.325
  617   2HB   ALA  76          HB2       ALA  76 -11.576   2.641  -2.914
  618   3HB   ALA  76          HB3       ALA  76 -12.843   3.277  -1.865
  619    H    GLY  77           HN       GLY  77 -11.265  -0.904  -1.055
  620   1HA   GLY  77          HA2       GLY  77 -10.968  -1.908  -3.800
  621   2HA   GLY  77          HA1       GLY  77  -9.999  -2.406  -2.416
  622    H    SER  78           HN       SER  78 -11.873  -2.971  -0.554
  623    HA   SER  78           HA       SER  78 -13.065  -5.341  -1.733
  624   1HB   SER  78          HB2       SER  78 -11.648  -5.684   0.261
  625   2HB   SER  78          HB1       SER  78 -12.684  -4.593   1.184
  626    HG   SER  78           HG       SER  78 -14.039  -6.163   1.472
  627    H    ASP  79           HN       ASP  79 -14.826  -4.457  -2.722
  628    HA   ASP  79           HA       ASP  79 -16.667  -2.893  -1.133
  629   1HB   ASP  79          HB2       ASP  79 -16.460  -2.444  -3.562
  630   2HB   ASP  79          HB1       ASP  79 -17.032  -4.077  -3.897
  631    H    THR  80           HN       THR  80 -16.438  -6.051  -2.599
  632    HA   THR  80           HA       THR  80 -17.906  -7.197  -0.406
  633    HB   THR  80           HB       THR  80 -18.885  -7.597  -3.269
  634    HG1  THR  80           HG1      THR  80 -19.378  -5.657  -1.646
  635   1HG2  THR  80          HG21      THR  80 -19.970  -8.627  -0.634
  636   2HG2  THR  80          HG22      THR  80 -19.129  -9.597  -1.844
  637   3HG2  THR  80          HG23      THR  80 -20.702  -8.886  -2.216
  638    H    GLU  81           HN       GLU  81 -16.345  -8.538   0.201
  639    HA   GLU  81           HA       GLU  81 -14.922 -10.269   0.270
  640   1HB   GLU  81          HB2       GLU  81 -16.384 -11.060  -2.247
  641   2HB   GLU  81          HB1       GLU  81 -15.196 -12.089  -1.455
  642   1HG   GLU  81          HG2       GLU  81 -17.741 -11.069  -0.207
  643   2HG   GLU  81          HG1       GLU  81 -17.489 -12.691  -0.854
  644    H    LEU  82           HN       LEU  82 -13.882  -7.936  -0.686
  645    HA   LEU  82           HA       LEU  82 -12.110  -6.997  -1.605
  646   1HB   LEU  82          HB2       LEU  82 -10.916  -8.787  -0.423
  647   2HB   LEU  82          HB1       LEU  82 -11.067  -9.827  -1.822
  648    HG   LEU  82           HG       LEU  82  -9.630  -8.257  -3.100
  649   1HD1  LEU  82          HD11      LEU  82 -10.095  -6.212  -1.862
  650   2HD1  LEU  82          HD12      LEU  82  -8.366  -6.542  -1.910
  651   3HD1  LEU  82          HD13      LEU  82  -9.287  -6.876  -0.442
  652   1HD2  LEU  82          HD21      LEU  82  -7.538  -8.867  -1.979
  653   2HD2  LEU  82          HD22      LEU  82  -8.669 -10.219  -2.023
  654   3HD2  LEU  82          HD23      LEU  82  -8.445  -9.305  -0.531
  655    H    ALA  83           HN       ALA  83 -11.721  -9.808  -3.675
  656    HA   ALA  83           HA       ALA  83 -12.377  -8.030  -5.930
  657   1HB   ALA  83          HB1       ALA  83 -10.471 -10.370  -5.898
  658   2HB   ALA  83          HB2       ALA  83 -10.014  -8.665  -5.874
  659   3HB   ALA  83          HB3       ALA  83 -10.827  -9.343  -7.287
  660    H    ALA  84           HN       ALA  84 -13.250 -10.731  -4.194
  661    HA   ALA  84           HA       ALA  84 -14.596 -12.463  -4.383
  662   1HB   ALA  84          HB1       ALA  84 -16.232 -10.653  -4.735
  663   2HB   ALA  84          HB2       ALA  84 -16.698 -12.148  -5.545
  664   3HB   ALA  84          HB3       ALA  84 -16.013 -10.819  -6.478
  665    HA   PRO  85           HA       PRO  85 -12.669 -14.643  -7.859
  666   1HB   PRO  85          HB2       PRO  85 -12.961 -16.928  -6.017
  667   2HB   PRO  85          HB1       PRO  85 -11.499 -16.317  -6.800
  668   1HG   PRO  85          HG2       PRO  85 -11.919 -16.034  -4.154
  669   2HG   PRO  85          HG1       PRO  85 -11.060 -14.812  -5.108
  670   1HD   PRO  85          HD2       PRO  85 -13.891 -14.815  -4.140
  671   2HD   PRO  85          HD1       PRO  85 -12.718 -13.482  -4.190
  672    H    LYS  86           HN       LYS  86 -14.459 -14.545  -9.124
  673    HA   LYS  86           HA       LYS  86 -16.439 -16.648  -8.839
  674   1HB   LYS  86          HB2       LYS  86 -17.298 -14.665  -7.581
  675   2HB   LYS  86          HB1       LYS  86 -17.175 -13.718  -9.050
  676   1HG   LYS  86          HG2       LYS  86 -19.463 -14.351  -8.701
  677   2HG   LYS  86          HG1       LYS  86 -18.840 -15.218 -10.104
  678   1HD   LYS  86          HD2       LYS  86 -18.561 -17.226  -8.800
  679   2HD   LYS  86          HD1       LYS  86 -19.002 -16.372  -7.321
  680   1HE   LYS  86          HE2       LYS  86 -20.873 -17.703  -8.134
  681   2HE   LYS  86          HE1       LYS  86 -21.248 -15.984  -8.221
  682   1HZ   LYS  86          HZ1       LYS  86 -20.770 -16.049 -10.618
  683   2HZ   LYS  86          HZ2       LYS  86 -21.962 -17.169 -10.204
  684   3HZ   LYS  86          HZ3       LYS  86 -20.395 -17.696 -10.495
  685    H    SER  87           HN       SER  87 -16.421 -17.532 -10.752
  686    HA   SER  87           HA       SER  87 -16.688 -15.905 -13.118
  687   1HB   SER  87          HB2       SER  87 -14.245 -16.144 -12.932
  688   2HB   SER  87          HB1       SER  87 -14.414 -17.886 -12.752
  689    HG   SER  87           HG       SER  87 -14.537 -16.311 -15.049
  690    H    LYS  88           HN       LYS  88 -17.925 -16.904 -14.576
  691    HA   LYS  88           HA       LYS  88 -19.631 -18.953 -13.687
  692   1HB   LYS  88          HB2       LYS  88 -20.343 -17.245 -15.268
  693   2HB   LYS  88          HB1       LYS  88 -19.213 -17.854 -16.465
  694   1HG   LYS  88          HG2       LYS  88 -20.477 -19.983 -16.517
  695   2HG   LYS  88          HG1       LYS  88 -21.644 -19.278 -15.394
  696   1HD   LYS  88          HD2       LYS  88 -22.155 -17.526 -16.997
  697   2HD   LYS  88          HD1       LYS  88 -20.945 -18.170 -18.105
  698   1HE   LYS  88          HE2       LYS  88 -22.240 -20.276 -18.222
  699   2HE   LYS  88          HE1       LYS  88 -23.472 -19.543 -17.196
  700   1HZ   LYS  88          HZ1       LYS  88 -23.845 -17.865 -18.879
  701   2HZ   LYS  88          HZ2       LYS  88 -24.018 -19.382 -19.598
  702   3HZ   LYS  88          HZ3       LYS  88 -22.612 -18.495 -19.830
  703    H    ASN  89           HN       ASN  89 -17.368 -19.072 -16.447
  704    HA   ASN  89           HA       ASN  89 -16.897 -21.868 -15.867
  705   1HB   ASN  89          HB2       ASN  89 -18.784 -22.015 -17.365
  706   2HB   ASN  89          HB1       ASN  89 -18.050 -20.874 -18.482
  707   1HD2  ASN  89          HD21      ASN  89 -16.594 -21.603 -19.948
  708   2HD2  ASN  89          HD22      ASN  89 -16.177 -23.265 -20.179
  Start of MODEL    2
    1   1H    GLY   1          HT1       GLY   1 -13.047  10.511   3.241
    2   2H    GLY   1          HT2       GLY   1 -13.232  11.202   4.753
    3   3H    GLY   1          HT3       GLY   1 -13.549   9.543   4.534
    4   1HA   GLY   1          HA1       GLY   1 -10.920  10.893   4.342
    5   2HA   GLY   1          HA2       GLY   1 -11.452   9.830   5.641
    6    H    ASP   2           HN       ASP   2  -9.557   9.940   2.988
    7    HA   ASP   2           HA       ASP   2 -10.137   7.166   2.238
    8   1HB   ASP   2          HB2       ASP   2  -8.584   9.270   0.723
    9   2HB   ASP   2          HB1       ASP   2  -8.621   7.574   0.267
   10    H    GLY   3           HN       GLY   3  -9.091   5.819   3.373
   11   1HA   GLY   3          HA2       GLY   3  -7.328   4.618   4.209
   12   2HA   GLY   3          HA1       GLY   3  -6.275   5.600   3.204
   13    H    GLU   4           HN       GLU   4  -7.932   5.482   6.317
   14    HA   GLU   4           HA       GLU   4  -6.127   7.595   7.189
   15   1HB   GLU   4          HB2       GLU   4  -8.569   6.502   8.587
   16   2HB   GLU   4          HB1       GLU   4  -7.585   7.861   9.128
   17   1HG   GLU   4          HG2       GLU   4  -8.134   8.975   6.935
   18   2HG   GLU   4          HG1       GLU   4  -9.329   7.705   6.694
   19    H    ALA   5           HN       ALA   5  -7.317   4.436   8.157
   20    HA   ALA   5           HA       ALA   5  -5.025   4.104   9.915
   21   1HB   ALA   5          HB1       ALA   5  -7.298   2.216   9.247
   22   2HB   ALA   5          HB2       ALA   5  -7.201   3.247  10.676
   23   3HB   ALA   5          HB3       ALA   5  -6.052   1.924  10.463
   24    H    GLN   6           HN       GLN   6  -6.493   2.037   7.390
   25    HA   GLN   6           HA       GLN   6  -3.800   1.464   6.477
   26   1HB   GLN   6          HB2       GLN   6  -5.391  -0.443   6.936
   27   2HB   GLN   6          HB1       GLN   6  -6.415   0.176   5.649
   28   1HG   GLN   6          HG2       GLN   6  -4.800  -0.291   4.001
   29   2HG   GLN   6          HG1       GLN   6  -3.555  -0.606   5.207
   30   1HE2  GLN   6          HE21      GLN   6  -3.695  -2.478   6.419
   31   2HE2  GLN   6          HE22      GLN   6  -4.553  -3.868   5.832
   32    H    ARG   7           HN       ARG   7  -3.082   2.416   4.720
   33    HA   ARG   7           HA       ARG   7  -4.969   4.093   3.199
   34   1HB   ARG   7          HB2       ARG   7  -3.349   5.901   3.281
   35   2HB   ARG   7          HB1       ARG   7  -3.837   5.429   4.903
   36   1HG   ARG   7          HG2       ARG   7  -1.729   4.064   5.034
   37   2HG   ARG   7          HG1       ARG   7  -1.236   4.801   3.510
   38   1HD   ARG   7          HD2       ARG   7  -0.243   5.991   5.372
   39   2HD   ARG   7          HD1       ARG   7  -1.421   7.023   4.555
   40    HE   ARG   7           HE       ARG   7  -2.929   5.995   6.454
   41   1HH1  ARG   7          HH11      ARG   7   0.356   7.277   6.741
   42   2HH1  ARG   7          HH12      ARG   7   0.156   7.831   8.333
   43   1HH2  ARG   7          HH21      ARG   7  -3.215   6.736   8.656
   44   2HH2  ARG   7          HH22      ARG   7  -1.927   7.511   9.453
   45    H    ASP   8           HN       ASP   8  -3.491   5.186   1.380
   46    HA   ASP   8           HA       ASP   8  -2.552   3.218  -0.415
   47   1HB   ASP   8          HB2       ASP   8  -1.729   6.142  -0.296
   48   2HB   ASP   8          HB1       ASP   8  -1.651   5.090  -1.697
   49    H    LEU   9           HN       LEU   9  -0.767   2.028   0.026
   50    HA   LEU   9           HA       LEU   9   0.963   2.709   2.119
   51   1HB   LEU   9          HB2       LEU   9   1.323   0.638  -0.036
   52   2HB   LEU   9          HB1       LEU   9   2.239   0.730   1.454
   53    HG   LEU   9           HG       LEU   9  -0.732   0.255   1.287
   54   1HD1  LEU   9          HD11      LEU   9   1.521  -1.662   1.877
   55   2HD1  LEU   9          HD12      LEU   9   0.514  -1.644   0.427
   56   3HD1  LEU   9          HD13      LEU   9  -0.202  -2.019   1.994
   57   1HD2  LEU   9          HD21      LEU   9  -0.535  -0.260   3.671
   58   2HD2  LEU   9          HD22      LEU   9  -0.054   1.405   3.304
   59   3HD2  LEU   9          HD23      LEU   9   1.177   0.181   3.607
   60    H    VAL  10           HN       VAL  10   0.935   3.787  -1.013
   61    HA   VAL  10           HA       VAL  10   3.711   4.218  -1.374
   62    HB   VAL  10           HB       VAL  10   1.335   5.597  -2.628
   63   1HG1  VAL  10          HG11      VAL  10   2.878   6.329  -4.392
   64   2HG1  VAL  10          HG12      VAL  10   4.230   5.647  -3.493
   65   3HG1  VAL  10          HG13      VAL  10   3.329   7.009  -2.829
   66   1HG2  VAL  10          HG21      VAL  10   3.065   3.311  -3.471
   67   2HG2  VAL  10          HG22      VAL  10   1.929   4.141  -4.520
   68   3HG2  VAL  10          HG23      VAL  10   1.344   3.290  -3.065
   69    H    LYS  11           HN       LYS  11   1.100   6.023   0.049
   70    HA   LYS  11           HA       LYS  11   2.787   8.319   0.503
   71   1HB   LYS  11          HB2       LYS  11  -0.094   7.732   0.663
   72   2HB   LYS  11          HB1       LYS  11   0.491   8.887   1.860
   73   1HG   LYS  11          HG2       LYS  11  -0.368  10.017  -0.138
   74   2HG   LYS  11          HG1       LYS  11   1.349  10.314   0.079
   75   1HD   LYS  11          HD2       LYS  11   0.992   9.955  -2.247
   76   2HD   LYS  11          HD1       LYS  11   1.766   8.505  -1.628
   77   1HE   LYS  11          HE2       LYS  11  -0.024   7.935  -3.183
   78   2HE   LYS  11          HE1       LYS  11  -0.410   7.376  -1.557
   79   1HZ   LYS  11          HZ1       LYS  11  -1.422   9.957  -2.614
   80   2HZ   LYS  11          HZ2       LYS  11  -2.020   9.066  -1.299
   81   3HZ   LYS  11          HZ3       LYS  11  -2.238   8.516  -2.870
   82    H    ALA  12           HN       ALA  12   3.173   5.642   1.664
   83    HA   ALA  12           HA       ALA  12   3.677   6.523   4.396
   84   1HB   ALA  12          HB1       ALA  12   2.647   3.783   3.618
   85   2HB   ALA  12          HB2       ALA  12   1.723   5.017   4.472
   86   3HB   ALA  12          HB3       ALA  12   3.132   4.279   5.239
   87    H    VAL  13           HN       VAL  13   4.306   3.732   2.211
   88    HA   VAL  13           HA       VAL  13   6.862   3.209   3.350
   89    HB   VAL  13           HB       VAL  13   5.557   2.126   0.839
   90   1HG1  VAL  13          HG11      VAL  13   7.943   1.845   0.735
   91   2HG1  VAL  13          HG12      VAL  13   7.168   0.282   1.008
   92   3HG1  VAL  13          HG13      VAL  13   7.972   1.120   2.345
   93   1HG2  VAL  13          HG21      VAL  13   5.712   0.989   3.627
   94   2HG2  VAL  13          HG22      VAL  13   5.042   0.160   2.222
   95   3HG2  VAL  13          HG23      VAL  13   4.271   1.625   2.835
   96    H    ALA  14           HN       ALA  14   5.768   4.435   0.202
   97    HA   ALA  14           HA       ALA  14   8.381   4.879  -0.774
   98   1HB   ALA  14          HB1       ALA  14   5.788   6.181  -1.623
   99   2HB   ALA  14          HB2       ALA  14   6.462   4.694  -2.279
  100   3HB   ALA  14          HB3       ALA  14   7.297   6.234  -2.538
  101    H    HIS  15           HN       HIS  15   6.189   6.682   1.164
  102    HA   HIS  15           HA       HIS  15   7.485   9.181   0.936
  103   1HB   HIS  15          HB2       HIS  15   5.133   8.885   1.744
  104   2HB   HIS  15          HB1       HIS  15   5.769   8.222   3.243
  105    HD1  HIS  15           HD1      HIS  15   5.202  10.010   4.900
  106    HD2  HIS  15           HD2      HIS  15   6.959  11.551   1.461
  107    HE1  HIS  15           HE1      HIS  15   5.558  12.453   5.345
  108    HE2  HIS  15           HE2      HIS  15   6.588  13.374   3.225
  109    H    ILE  16           HN       ILE  16   8.153   6.335   2.815
  110    HA   ILE  16           HA       ILE  16   9.949   7.517   4.670
  111    HB   ILE  16           HB       ILE  16   9.757   4.672   3.617
  112   1HG1  ILE  16          HG12      ILE  16   7.805   5.364   4.908
  113   2HG1  ILE  16          HG11      ILE  16   8.723   4.150   5.784
  114   1HG2  ILE  16          HG21      ILE  16  12.021   5.013   4.386
  115   2HG2  ILE  16          HG22      ILE  16  11.157   3.955   5.499
  116   3HG2  ILE  16          HG23      ILE  16  11.434   5.648   5.922
  117   1HD1  ILE  16          HD11      ILE  16   7.927   5.895   7.272
  118   2HD1  ILE  16          HD12      ILE  16   8.760   7.117   6.309
  119   3HD1  ILE  16          HD13      ILE  16   9.689   5.907   7.190
  120    H    LEU  17           HN       LEU  17  10.254   6.232   1.429
  121    HA   LEU  17           HA       LEU  17  13.113   6.477   1.256
  122   1HB   LEU  17          HB2       LEU  17  11.038   6.275  -0.929
  123   2HB   LEU  17          HB1       LEU  17  12.766   6.185  -1.179
  124    HG   LEU  17           HG       LEU  17  11.149   4.226   0.428
  125   1HD1  LEU  17          HD11      LEU  17  12.297   4.001  -2.345
  126   2HD1  LEU  17          HD12      LEU  17  10.589   4.132  -1.932
  127   3HD1  LEU  17          HD13      LEU  17  11.506   2.704  -1.446
  128   1HD2  LEU  17          HD21      LEU  17  13.185   2.861   0.342
  129   2HD2  LEU  17          HD22      LEU  17  13.471   4.395   1.164
  130   3HD2  LEU  17          HD23      LEU  17  14.019   4.169  -0.494
  131    H    GLY  18           HN       GLY  18  10.394   8.496   0.666
  132   1HA   GLY  18          HA2       GLY  18  10.698  10.908   0.778
  133   2HA   GLY  18          HA1       GLY  18  12.211  10.691  -0.101
  134    H    ILE  19           HN       ILE  19   9.709   8.700  -1.183
  135    HA   ILE  19           HA       ILE  19   9.254  10.488  -3.432
  136    HB   ILE  19           HB       ILE  19   8.425   8.173  -4.447
  137   1HG1  ILE  19          HG12      ILE  19  10.656   7.363  -2.575
  138   2HG1  ILE  19          HG11      ILE  19   8.992   6.804  -2.529
  139   1HG2  ILE  19          HG21      ILE  19   9.948   9.657  -5.514
  140   2HG2  ILE  19          HG22      ILE  19  10.569   8.005  -5.612
  141   3HG2  ILE  19          HG23      ILE  19  11.267   9.142  -4.446
  142   1HD1  ILE  19          HD11      ILE  19   9.309   5.697  -4.684
  143   2HD1  ILE  19          HD12      ILE  19  10.470   5.131  -3.482
  144   3HD1  ILE  19          HD13      ILE  19  10.975   6.270  -4.731
  145    H    ARG  20           HN       ARG  20   7.226  10.408  -4.435
  146    HA   ARG  20           HA       ARG  20   4.998   9.341  -2.911
  147   1HB   ARG  20          HB2       ARG  20   5.537  11.480  -1.793
  148   2HB   ARG  20          HB1       ARG  20   5.325  12.311  -3.326
  149   1HG   ARG  20          HG2       ARG  20   2.962  11.440  -3.329
  150   2HG   ARG  20          HG1       ARG  20   3.253  10.922  -1.670
  151   1HD   ARG  20          HD2       ARG  20   2.212  13.125  -1.683
  152   2HD   ARG  20          HD1       ARG  20   3.853  13.191  -1.028
  153    HE   ARG  20           HE       ARG  20   3.489  13.787  -3.864
  154   1HH1  ARG  20          HH11      ARG  20   4.188  15.086  -0.614
  155   2HH1  ARG  20          HH12      ARG  20   4.765  16.563  -1.218
  156   1HH2  ARG  20          HH21      ARG  20   4.258  15.716  -4.629
  157   2HH2  ARG  20          HH22      ARG  20   4.781  16.977  -3.580
  158    H    ASP  21           HN       ASP  21   5.933  11.672  -5.416
  159    HA   ASP  21           HA       ASP  21   3.584  10.949  -6.930
  160   1HB   ASP  21          HB2       ASP  21   5.647  13.082  -7.461
  161   2HB   ASP  21          HB1       ASP  21   4.262  12.762  -8.500
  162    H    LEU  22           HN       LEU  22   7.021  10.549  -7.128
  163    HA   LEU  22           HA       LEU  22   8.299   9.115  -8.362
  164   1HB   LEU  22          HB2       LEU  22   5.612   7.799  -8.700
  165   2HB   LEU  22          HB1       LEU  22   7.031   7.159  -9.488
  166    HG   LEU  22           HG       LEU  22   6.510   5.910  -7.487
  167   1HD1  LEU  22          HD11      LEU  22   8.802   6.071  -8.120
  168   2HD1  LEU  22          HD12      LEU  22   8.657   6.038  -6.359
  169   3HD1  LEU  22          HD13      LEU  22   8.981   7.557  -7.196
  170   1HD2  LEU  22          HD21      LEU  22   5.393   7.629  -6.175
  171   2HD2  LEU  22          HD22      LEU  22   6.927   8.481  -5.980
  172   3HD2  LEU  22          HD23      LEU  22   6.705   6.887  -5.259
  173    H    ALA  23           HN       ALA  23   7.559  11.482  -9.573
  174    HA   ALA  23           HA       ALA  23   6.541  10.989 -12.199
  175   1HB   ALA  23          HB1       ALA  23   6.048  13.090 -11.054
  176   2HB   ALA  23          HB2       ALA  23   6.870  13.380 -12.588
  177   3HB   ALA  23          HB3       ALA  23   7.762  13.504 -11.073
  178    H    GLY  24           HN       GLY  24   9.441  10.583 -10.825
  179   1HA   GLY  24          HA2       GLY  24  10.816  10.514 -13.423
  180   2HA   GLY  24          HA1       GLY  24  11.552  11.399 -12.091
  181    H    ILE  25           HN       ILE  25   9.751   8.544 -11.367
  182    HA   ILE  25           HA       ILE  25  12.233   7.051 -11.102
  183    HB   ILE  25           HB       ILE  25  10.120   7.181  -8.884
  184   1HG1  ILE  25          HG12      ILE  25  12.128   7.991  -7.455
  185   2HG1  ILE  25          HG11      ILE  25  12.890   8.381  -8.985
  186   1HG2  ILE  25          HG21      ILE  25  11.626   5.781  -7.549
  187   2HG2  ILE  25          HG22      ILE  25  12.708   5.641  -8.935
  188   3HG2  ILE  25          HG23      ILE  25  11.079   4.974  -9.019
  189   1HD1  ILE  25          HD11      ILE  25  11.060   9.923  -9.491
  190   2HD1  ILE  25          HD12      ILE  25  11.866  10.336  -7.978
  191   3HD1  ILE  25          HD13      ILE  25  10.302   9.521  -7.950
  192    H    ASN  26           HN       ASN  26  11.924   4.819 -11.232
  193    HA   ASN  26           HA       ASN  26   9.848   4.056 -13.009
  194   1HB   ASN  26          HB2       ASN  26  12.033   2.502 -11.666
  195   2HB   ASN  26          HB1       ASN  26  10.766   1.673 -12.552
  196   1HD2  ASN  26          HD21      ASN  26  12.338   0.900 -14.005
  197   2HD2  ASN  26          HD22      ASN  26  12.979   1.912 -15.237
  198    H    LEU  27           HN       LEU  27   8.008   3.146 -12.746
  199    HA   LEU  27           HA       LEU  27   7.050   2.617 -10.033
  200   1HB   LEU  27          HB2       LEU  27   5.625   2.972 -12.676
  201   2HB   LEU  27          HB1       LEU  27   4.806   2.536 -11.187
  202    HG   LEU  27           HG       LEU  27   6.378   5.100 -11.517
  203   1HD1  LEU  27          HD11      LEU  27   4.502   5.079 -13.079
  204   2HD1  LEU  27          HD12      LEU  27   4.206   6.199 -11.746
  205   3HD1  LEU  27          HD13      LEU  27   3.414   4.619 -11.769
  206   1HD2  LEU  27          HD21      LEU  27   6.055   4.284  -9.202
  207   2HD2  LEU  27          HD22      LEU  27   4.306   4.254  -9.491
  208   3HD2  LEU  27          HD23      LEU  27   5.162   5.770  -9.522
  209    H    ASP  28           HN       ASP  28   8.583   1.048 -12.304
  210    HA   ASP  28           HA       ASP  28   7.098  -1.483 -12.078
  211   1HB   ASP  28          HB2       ASP  28   9.347  -0.688 -13.941
  212   2HB   ASP  28          HB1       ASP  28   8.643  -2.297 -13.864
  213    H    SER  29           HN       SER  29   9.285   0.097 -10.371
  214    HA   SER  29           HA       SER  29  11.327  -1.894 -10.101
  215   1HB   SER  29          HB2       SER  29  10.724   0.544  -8.416
  216   2HB   SER  29          HB1       SER  29  12.204  -0.414  -8.375
  217    HG   SER  29           HG       SER  29  12.150   1.590  -9.681
  218    H    SER  30           HN       SER  30  11.336  -3.536  -8.703
  219    HA   SER  30           HA       SER  30   9.130  -4.208  -7.090
  220   1HB   SER  30          HB2       SER  30  11.993  -5.146  -7.027
  221   2HB   SER  30          HB1       SER  30  10.673  -5.974  -6.218
  222    HG   SER  30           HG       SER  30  11.192  -5.600  -8.960
  223    H    LEU  31           HN       LEU  31   8.950  -4.145  -4.813
  224    HA   LEU  31           HA       LEU  31   9.853  -1.817  -3.581
  225   1HB   LEU  31          HB2       LEU  31   7.826  -3.233  -2.989
  226   2HB   LEU  31          HB1       LEU  31   8.926  -4.313  -2.160
  227    HG   LEU  31           HG       LEU  31   9.600  -2.382  -0.708
  228   1HD1  LEU  31          HD11      LEU  31   8.058  -0.471  -0.631
  229   2HD1  LEU  31          HD12      LEU  31   7.262  -1.122  -2.084
  230   3HD1  LEU  31          HD13      LEU  31   8.933  -0.602  -2.163
  231   1HD2  LEU  31          HD21      LEU  31   6.698  -3.164  -0.684
  232   2HD2  LEU  31          HD22      LEU  31   7.596  -2.468   0.665
  233   3HD2  LEU  31          HD23      LEU  31   8.023  -4.065   0.051
  234    H    ALA  32           HN       ALA  32  11.156  -4.991  -3.747
  235    HA   ALA  32           HA       ALA  32  12.999  -4.875  -1.675
  236   1HB   ALA  32          HB1       ALA  32  12.465  -6.951  -2.829
  237   2HB   ALA  32          HB2       ALA  32  14.205  -6.668  -2.835
  238   3HB   ALA  32          HB3       ALA  32  13.257  -6.356  -4.287
  239    H    ASP  33           HN       ASP  33  13.096  -3.658  -4.951
  240    HA   ASP  33           HA       ASP  33  15.889  -3.138  -5.032
  241   1HB   ASP  33          HB2       ASP  33  13.608  -2.261  -6.788
  242   2HB   ASP  33          HB1       ASP  33  15.254  -1.729  -7.068
  243    H    LEU  34           HN       LEU  34  13.032  -1.470  -4.208
  244    HA   LEU  34           HA       LEU  34  13.914   1.205  -4.269
  245   1HB   LEU  34          HB2       LEU  34  11.829  -0.008  -2.484
  246   2HB   LEU  34          HB1       LEU  34  11.956   1.672  -2.971
  247    HG   LEU  34           HG       LEU  34  11.363  -0.628  -4.818
  248   1HD1  LEU  34          HD11      LEU  34   9.561   1.495  -3.728
  249   2HD1  LEU  34          HD12      LEU  34   9.643  -0.186  -3.212
  250   3HD1  LEU  34          HD13      LEU  34   9.126   0.199  -4.860
  251   1HD2  LEU  34          HD21      LEU  34  10.788   1.066  -6.410
  252   2HD2  LEU  34          HD22      LEU  34  12.488   1.199  -5.941
  253   3HD2  LEU  34          HD23      LEU  34  11.290   2.340  -5.296
  254    H    GLY  35           HN       GLY  35  13.797  -1.197  -1.696
  255   1HA   GLY  35          HA2       GLY  35  16.076  -0.660  -0.415
  256   2HA   GLY  35          HA1       GLY  35  15.087   0.686   0.107
  257    H    LEU  36           HN       LEU  36  13.080  -1.994  -0.268
  258    HA   LEU  36           HA       LEU  36  12.720  -2.281   2.458
  259   1HB   LEU  36          HB2       LEU  36  10.865  -2.984   1.477
  260   2HB   LEU  36          HB1       LEU  36  11.624  -3.615   0.062
  261    HG   LEU  36           HG       LEU  36  12.156  -5.702   1.402
  262   1HD1  LEU  36          HD11      LEU  36  10.388  -4.427   3.479
  263   2HD1  LEU  36          HD12      LEU  36  12.112  -4.759   3.642
  264   3HD1  LEU  36          HD13      LEU  36  10.969  -6.093   3.490
  265   1HD2  LEU  36          HD21      LEU  36   9.266  -4.907   1.235
  266   2HD2  LEU  36          HD22      LEU  36   9.880  -6.559   1.356
  267   3HD2  LEU  36          HD23      LEU  36  10.244  -5.577  -0.067
  268    H    ASP  37           HN       ASP  37  14.180  -2.757   3.747
  269    HA   ASP  37           HA       ASP  37  16.065  -4.908   3.312
  270   1HB   ASP  37          HB2       ASP  37  17.198  -3.989   5.260
  271   2HB   ASP  37          HB1       ASP  37  16.762  -2.653   4.208
  272    H    SER  38           HN       SER  38  13.666  -3.830   5.578
  273    HA   SER  38           HA       SER  38  12.504  -6.349   6.099
  274   1HB   SER  38          HB2       SER  38  14.543  -6.627   7.491
  275   2HB   SER  38          HB1       SER  38  14.201  -5.096   8.295
  276    HG   SER  38           HG       SER  38  12.881  -6.085   9.560
  277    H    LEU  39           HN       LEU  39  13.131  -2.995   7.297
  278    HA   LEU  39           HA       LEU  39  10.717  -2.815   8.751
  279   1HB   LEU  39          HB2       LEU  39  12.591  -1.282   9.149
  280   2HB   LEU  39          HB1       LEU  39  12.323  -0.553   7.572
  281    HG   LEU  39           HG       LEU  39  10.009   0.030   8.340
  282   1HD1  LEU  39          HD11      LEU  39  11.085  -0.731  11.036
  283   2HD1  LEU  39          HD12      LEU  39   9.770  -1.511  10.158
  284   3HD1  LEU  39          HD13      LEU  39   9.581   0.142  10.739
  285   1HD2  LEU  39          HD21      LEU  39  11.750   1.680   8.218
  286   2HD2  LEU  39          HD22      LEU  39  12.309   1.240   9.841
  287   3HD2  LEU  39          HD23      LEU  39  10.709   1.969   9.617
  288    H    MET  40           HN       MET  40  11.549  -2.056   5.471
  289    HA   MET  40           HA       MET  40   9.020  -0.825   4.832
  290   1HB   MET  40          HB2       MET  40  11.212  -1.797   3.000
  291   2HB   MET  40          HB1       MET  40   9.859  -0.766   2.536
  292   1HG   MET  40          HG2       MET  40  10.642   0.960   4.079
  293   2HG   MET  40          HG1       MET  40  11.997  -0.070   4.530
  294   1HE   MET  40          HE1       MET  40  13.851   2.681   2.589
  295   2HE   MET  40          HE2       MET  40  13.817   1.674   4.035
  296   3HE   MET  40          HE3       MET  40  12.528   2.838   3.745
  297    H    GLY  41           HN       GLY  41   9.240  -3.608   5.845
  298   1HA   GLY  41          HA2       GLY  41   7.195  -4.707   4.066
  299   2HA   GLY  41          HA1       GLY  41   8.499  -5.743   4.663
  300    H    VAL  42           HN       VAL  42   8.798  -4.714   7.241
  301    HA   VAL  42           HA       VAL  42   6.674  -6.028   8.597
  302    HB   VAL  42           HB       VAL  42   8.811  -4.235   9.798
  303   1HG1  VAL  42          HG11      VAL  42   8.410  -5.492  11.858
  304   2HG1  VAL  42          HG12      VAL  42   7.117  -6.386  11.056
  305   3HG1  VAL  42          HG13      VAL  42   6.957  -4.649  11.317
  306   1HG2  VAL  42          HG21      VAL  42   8.839  -7.217   9.379
  307   2HG2  VAL  42          HG22      VAL  42  10.050  -6.294  10.262
  308   3HG2  VAL  42          HG23      VAL  42   9.836  -6.037   8.530
  309    H    GLU  43           HN       GLU  43   7.560  -2.551   8.276
  310    HA   GLU  43           HA       GLU  43   5.435  -1.764   9.948
  311   1HB   GLU  43          HB2       GLU  43   7.339  -0.258   9.606
  312   2HB   GLU  43          HB1       GLU  43   6.929  -0.090   7.903
  313   1HG   GLU  43          HG2       GLU  43   5.008   1.164   8.372
  314   2HG   GLU  43          HG1       GLU  43   4.990   0.667  10.058
  315    H    VAL  44           HN       VAL  44   5.687  -2.441   6.598
  316    HA   VAL  44           HA       VAL  44   3.223  -1.418   5.699
  317    HB   VAL  44           HB       VAL  44   4.532  -3.988   4.765
  318   1HG1  VAL  44          HG11      VAL  44   2.291  -3.668   3.917
  319   2HG1  VAL  44          HG12      VAL  44   3.474  -3.485   2.621
  320   3HG1  VAL  44          HG13      VAL  44   2.718  -2.060   3.335
  321   1HG2  VAL  44          HG21      VAL  44   5.694  -2.644   3.094
  322   2HG2  VAL  44          HG22      VAL  44   6.180  -2.253   4.742
  323   3HG2  VAL  44          HG23      VAL  44   5.087  -1.172   3.865
  324    H    ARG  45           HN       ARG  45   4.171  -4.593   6.982
  325    HA   ARG  45           HA       ARG  45   1.554  -5.628   6.982
  326   1HB   ARG  45          HB2       ARG  45   4.052  -6.532   8.345
  327   2HB   ARG  45          HB1       ARG  45   2.552  -7.409   8.531
  328   1HG   ARG  45          HG2       ARG  45   2.504  -7.533   5.990
  329   2HG   ARG  45          HG1       ARG  45   4.179  -6.973   6.054
  330   1HD   ARG  45          HD2       ARG  45   3.069  -9.426   7.402
  331   2HD   ARG  45          HD1       ARG  45   4.047  -9.409   5.937
  332    HE   ARG  45           HE       ARG  45   5.862  -8.551   7.260
  333   1HH1  ARG  45          HH11      ARG  45   3.134  -9.836   9.174
  334   2HH1  ARG  45          HH12      ARG  45   4.135 -10.470  10.395
  335   1HH2  ARG  45          HH21      ARG  45   7.223  -9.428   9.019
  336   2HH2  ARG  45          HH22      ARG  45   6.446 -10.135  10.365
  337    H    GLN  46           HN       GLN  46   3.157  -3.615   9.239
  338    HA   GLN  46           HA       GLN  46   1.362  -4.148  11.377
  339   1HB   GLN  46          HB2       GLN  46   3.056  -1.711  10.761
  340   2HB   GLN  46          HB1       GLN  46   2.086  -1.863  12.221
  341   1HG   GLN  46          HG2       GLN  46   3.368  -3.752  12.948
  342   2HG   GLN  46          HG1       GLN  46   4.252  -3.797  11.428
  343   1HE2  GLN  46          HE21      GLN  46   3.874  -2.124  14.493
  344   2HE2  GLN  46          HE22      GLN  46   5.347  -1.247  14.360
  345    H    ILE  47           HN       ILE  47   1.420  -1.797   8.769
  346    HA   ILE  47           HA       ILE  47  -1.086  -0.600   9.357
  347    HB   ILE  47           HB       ILE  47   0.346  -0.859   6.698
  348   1HG1  ILE  47          HG12      ILE  47   0.460   1.388   8.724
  349   2HG1  ILE  47          HG11      ILE  47   1.717   0.185   8.482
  350   1HG2  ILE  47          HG21      ILE  47  -1.777   1.113   7.591
  351   2HG2  ILE  47          HG22      ILE  47  -2.000  -0.196   6.433
  352   3HG2  ILE  47          HG23      ILE  47  -0.937   1.155   6.037
  353   1HD1  ILE  47          HD11      ILE  47   0.810   2.226   6.454
  354   2HD1  ILE  47          HD12      ILE  47   2.074   1.017   6.214
  355   3HD1  ILE  47          HD13      ILE  47   2.289   2.290   7.415
  356    H    LEU  48           HN       LEU  48  -0.087  -3.372   7.527
  357    HA   LEU  48           HA       LEU  48  -2.652  -3.861   6.390
  358   1HB   LEU  48          HB2       LEU  48  -0.253  -5.661   6.551
  359   2HB   LEU  48          HB1       LEU  48  -1.696  -6.010   5.625
  360    HG   LEU  48           HG       LEU  48   0.192  -3.738   5.191
  361   1HD1  LEU  48          HD11      LEU  48   0.744  -4.911   3.095
  362   2HD1  LEU  48          HD12      LEU  48  -0.288  -6.249   3.600
  363   3HD1  LEU  48          HD13      LEU  48   1.156  -5.847   4.530
  364   1HD2  LEU  48          HD21      LEU  48  -1.076  -3.302   3.125
  365   2HD2  LEU  48          HD22      LEU  48  -2.040  -3.072   4.584
  366   3HD2  LEU  48          HD23      LEU  48  -2.247  -4.531   3.613
  367    H    GLU  49           HN       GLU  49  -0.809  -5.975   8.611
  368    HA   GLU  49           HA       GLU  49  -3.086  -7.525   9.166
  369   1HB   GLU  49          HB2       GLU  49  -0.363  -7.496  10.454
  370   2HB   GLU  49          HB1       GLU  49  -1.615  -8.671  10.828
  371   1HG   GLU  49          HG2       GLU  49  -1.589  -9.426   8.492
  372   2HG   GLU  49          HG1       GLU  49  -0.328  -8.250   8.138
  373    H    ARG  50           HN       ARG  50  -1.813  -4.698  10.813
  374    HA   ARG  50           HA       ARG  50  -3.346  -5.417  13.172
  375   1HB   ARG  50          HB2       ARG  50  -1.152  -4.317  13.442
  376   2HB   ARG  50          HB1       ARG  50  -1.776  -2.896  12.623
  377   1HG   ARG  50          HG2       ARG  50  -3.427  -2.621  14.438
  378   2HG   ARG  50          HG1       ARG  50  -2.697  -3.997  15.268
  379   1HD   ARG  50          HD2       ARG  50  -1.801  -1.963  16.198
  380   2HD   ARG  50          HD1       ARG  50  -0.532  -2.777  15.277
  381    HE   ARG  50           HE       ARG  50  -2.019  -0.817  13.783
  382   1HH1  ARG  50          HH11      ARG  50   0.794  -1.250  15.924
  383   2HH1  ARG  50          HH12      ARG  50   1.577   0.151  15.385
  384   1HH2  ARG  50          HH21      ARG  50  -0.942   1.073  13.066
  385   2HH2  ARG  50          HH22      ARG  50   0.603   1.489  13.674
  386    H    GLU  51           HN       GLU  51  -3.343  -2.717  10.861
  387    HA   GLU  51           HA       GLU  51  -5.600  -1.440  11.941
  388   1HB   GLU  51          HB2       GLU  51  -4.584  -1.233   9.115
  389   2HB   GLU  51          HB1       GLU  51  -5.616  -0.080   9.941
  390   1HG   GLU  51          HG2       GLU  51  -2.740  -0.717  10.546
  391   2HG   GLU  51          HG1       GLU  51  -3.396   0.786   9.895
  392    H    HIS  52           HN       HIS  52  -5.366  -3.482   9.034
  393    HA   HIS  52           HA       HIS  52  -8.321  -3.546   9.041
  394   1HB   HIS  52          HB2       HIS  52  -7.284  -2.180   7.219
  395   2HB   HIS  52          HB1       HIS  52  -6.442  -3.605   6.679
  396    HD1  HIS  52           HD1      HIS  52  -7.535  -3.109   4.374
  397    HD2  HIS  52           HD2      HIS  52 -10.246  -4.102   7.350
  398    HE1  HIS  52           HE1      HIS  52  -9.670  -3.679   3.179
  399    HE2  HIS  52           HE2      HIS  52 -11.346  -3.873   5.026
  400    H    ASP  53           HN       ASP  53  -5.825  -5.357   9.832
  401    HA   ASP  53           HA       ASP  53  -5.187  -7.522   9.846
  402   1HB   ASP  53          HB2       ASP  53  -7.257  -7.705  11.183
  403   2HB   ASP  53          HB1       ASP  53  -8.185  -7.993   9.723
  404    H    LEU  54           HN       LEU  54  -4.183  -7.233   7.873
  405    HA   LEU  54           HA       LEU  54  -5.369  -8.720   5.623
  406   1HB   LEU  54          HB2       LEU  54  -5.378  -6.164   5.413
  407   2HB   LEU  54          HB1       LEU  54  -3.659  -6.280   5.493
  408    HG   LEU  54           HG       LEU  54  -3.522  -7.469   3.417
  409   1HD1  LEU  54          HD11      LEU  54  -6.537  -7.296   3.376
  410   2HD1  LEU  54          HD12      LEU  54  -5.599  -8.776   3.598
  411   3HD1  LEU  54          HD13      LEU  54  -5.516  -7.896   2.069
  412   1HD2  LEU  54          HD21      LEU  54  -4.386  -5.696   1.978
  413   2HD2  LEU  54          HD22      LEU  54  -3.602  -5.060   3.440
  414   3HD2  LEU  54          HD23      LEU  54  -5.354  -5.116   3.341
  415    H    VAL  55           HN       VAL  55  -4.072 -10.525   5.548
  416    HA   VAL  55           HA       VAL  55  -1.304 -10.223   6.335
  417    HB   VAL  55           HB       VAL  55  -2.688 -12.788   5.511
  418   1HG1  VAL  55          HG11      VAL  55  -0.799 -13.876   6.670
  419   2HG1  VAL  55          HG12      VAL  55  -0.089 -12.289   6.964
  420   3HG1  VAL  55          HG13      VAL  55  -0.253 -12.885   5.315
  421   1HG2  VAL  55          HG21      VAL  55  -2.836 -13.276   7.908
  422   2HG2  VAL  55          HG22      VAL  55  -3.766 -11.836   7.485
  423   3HG2  VAL  55          HG23      VAL  55  -2.195 -11.676   8.273
  424    H    LEU  56           HN       LEU  56  -0.536  -9.022   4.687
  425    HA   LEU  56           HA       LEU  56  -0.064 -10.570   2.253
  426   1HB   LEU  56          HB2       LEU  56   0.280  -7.602   2.694
  427   2HB   LEU  56          HB1       LEU  56   0.639  -8.446   1.207
  428    HG   LEU  56           HG       LEU  56  -2.114  -8.082   2.399
  429   1HD1  LEU  56          HD11      LEU  56  -2.513  -6.668   0.452
  430   2HD1  LEU  56          HD12      LEU  56  -0.836  -6.888  -0.050
  431   3HD1  LEU  56          HD13      LEU  56  -1.203  -6.036   1.451
  432   1HD2  LEU  56          HD21      LEU  56  -1.919 -10.220   1.232
  433   2HD2  LEU  56          HD22      LEU  56  -1.258  -9.399  -0.182
  434   3HD2  LEU  56          HD23      LEU  56  -2.925  -9.097   0.314
  435    HA   PRO  57           HA       PRO  57   3.734 -11.056   4.559
  436   1HB   PRO  57          HB2       PRO  57   4.374 -12.935   2.415
  437   2HB   PRO  57          HB1       PRO  57   4.144 -13.259   4.138
  438   1HG   PRO  57          HG2       PRO  57   2.377 -14.094   2.290
  439   2HG   PRO  57          HG1       PRO  57   1.855 -13.556   3.897
  440   1HD   PRO  57          HD2       PRO  57   1.843 -12.076   1.306
  441   2HD   PRO  57          HD1       PRO  57   0.577 -12.175   2.553
  442    H    ILE  58           HN       ILE  58   6.115 -11.185   3.845
  443    HA   ILE  58           HA       ILE  58   6.663  -8.983   2.132
  444    HB   ILE  58           HB       ILE  58   8.552 -11.020   3.421
  445   1HG1  ILE  58          HG12      ILE  58   9.370  -9.018   4.713
  446   2HG1  ILE  58          HG11      ILE  58   8.066  -8.088   3.999
  447   1HG2  ILE  58          HG21      ILE  58  10.449  -9.631   2.727
  448   2HG2  ILE  58          HG22      ILE  58   9.358  -8.619   1.782
  449   3HG2  ILE  58          HG23      ILE  58   9.589 -10.310   1.346
  450   1HD1  ILE  58          HD11      ILE  58   6.447  -9.525   5.112
  451   2HD1  ILE  58          HD12      ILE  58   7.563  -8.778   6.262
  452   3HD1  ILE  58          HD13      ILE  58   7.763 -10.470   5.807
  453    H    ARG  59           HN       ARG  59   6.398 -12.367   1.800
  454    HA   ARG  59           HA       ARG  59   7.592 -12.713  -0.745
  455   1HB   ARG  59          HB2       ARG  59   5.325 -14.305   0.490
  456   2HB   ARG  59          HB1       ARG  59   6.160 -14.750  -0.983
  457   1HG   ARG  59          HG2       ARG  59   7.122 -16.104   0.629
  458   2HG   ARG  59          HG1       ARG  59   8.278 -14.784   0.474
  459   1HD   ARG  59          HD2       ARG  59   7.219 -13.716   2.453
  460   2HD   ARG  59          HD1       ARG  59   6.194 -15.138   2.627
  461    HE   ARG  59           HE       ARG  59   9.063 -15.516   2.562
  462   1HH1  ARG  59          HH11      ARG  59   6.050 -15.661   4.437
  463   2HH1  ARG  59          HH12      ARG  59   6.780 -16.165   5.886
  464   1HH2  ARG  59          HH21      ARG  59  10.085 -16.257   4.560
  465   2HH2  ARG  59          HH22      ARG  59   9.131 -16.521   5.958
  466    H    GLU  60           HN       GLU  60   4.927 -10.951   0.102
  467    HA   GLU  60           HA       GLU  60   3.802 -10.987  -2.618
  468   1HB   GLU  60          HB2       GLU  60   2.263 -11.557  -0.719
  469   2HB   GLU  60          HB1       GLU  60   2.598  -9.980  -0.027
  470   1HG   GLU  60          HG2       GLU  60   0.486  -9.954  -1.133
  471   2HG   GLU  60          HG1       GLU  60   1.617  -8.932  -2.026
  472    H    VAL  61           HN       VAL  61   4.397  -8.918   0.186
  473    HA   VAL  61           HA       VAL  61   4.091  -6.471  -1.059
  474    HB   VAL  61           HB       VAL  61   5.558  -7.124   1.516
  475   1HG1  VAL  61          HG11      VAL  61   6.199  -4.910   0.732
  476   2HG1  VAL  61          HG12      VAL  61   5.157  -4.797   2.151
  477   3HG1  VAL  61          HG13      VAL  61   4.501  -4.479   0.545
  478   1HG2  VAL  61          HG21      VAL  61   2.730  -6.226   1.010
  479   2HG2  VAL  61          HG22      VAL  61   3.467  -6.461   2.593
  480   3HG2  VAL  61          HG23      VAL  61   3.236  -7.840   1.515
  481    H    ARG  62           HN       ARG  62   6.999  -8.416  -0.770
  482    HA   ARG  62           HA       ARG  62   8.832  -6.323  -1.258
  483   1HB   ARG  62          HB2       ARG  62   9.456  -8.388  -0.138
  484   2HB   ARG  62          HB1       ARG  62   9.120  -9.307  -1.592
  485   1HG   ARG  62          HG2       ARG  62  11.007  -8.412  -2.686
  486   2HG   ARG  62          HG1       ARG  62  11.230  -7.193  -1.422
  487   1HD   ARG  62          HD2       ARG  62  11.775  -8.896   0.190
  488   2HD   ARG  62          HD1       ARG  62  11.390 -10.171  -0.961
  489    HE   ARG  62           HE       ARG  62  13.289  -9.555  -2.226
  490   1HH1  ARG  62          HH11      ARG  62  13.185  -7.968   0.951
  491   2HH1  ARG  62          HH12      ARG  62  14.871  -7.912   1.165
  492   1HH2  ARG  62          HH21      ARG  62  15.628  -9.500  -1.924
  493   2HH2  ARG  62          HH22      ARG  62  16.319  -8.823  -0.533
  494    H    GLN  63           HN       GLN  63   6.717  -7.898  -3.346
  495    HA   GLN  63           HA       GLN  63   8.328  -7.082  -5.666
  496   1HB   GLN  63          HB2       GLN  63   6.069  -9.101  -5.662
  497   2HB   GLN  63          HB1       GLN  63   7.070  -8.654  -7.038
  498   1HG   GLN  63          HG2       GLN  63   8.345 -10.380  -6.505
  499   2HG   GLN  63          HG1       GLN  63   8.903  -9.421  -5.135
  500   1HE2  GLN  63          HE21      GLN  63   6.090  -9.645  -3.976
  501   2HE2  GLN  63          HE22      GLN  63   6.066 -11.236  -3.328
  502    H    LEU  64           HN       LEU  64   6.125  -5.802  -3.779
  503    HA   LEU  64           HA       LEU  64   4.181  -5.034  -5.726
  504   1HB   LEU  64          HB2       LEU  64   4.781  -3.723  -3.064
  505   2HB   LEU  64          HB1       LEU  64   3.373  -3.428  -4.052
  506    HG   LEU  64           HG       LEU  64   4.026  -5.952  -2.552
  507   1HD1  LEU  64          HD11      LEU  64   1.986  -5.435  -1.304
  508   2HD1  LEU  64          HD12      LEU  64   1.815  -3.938  -2.225
  509   3HD1  LEU  64          HD13      LEU  64   3.196  -4.160  -1.152
  510   1HD2  LEU  64          HD21      LEU  64   1.906  -6.836  -3.308
  511   2HD2  LEU  64          HD22      LEU  64   2.930  -6.476  -4.699
  512   3HD2  LEU  64          HD23      LEU  64   1.611  -5.388  -4.258
  513    H    THR  65           HN       THR  65   4.544  -3.654  -7.296
  514    HA   THR  65           HA       THR  65   6.974  -2.222  -7.379
  515    HB   THR  65           HB       THR  65   6.027  -1.690  -9.690
  516    HG1  THR  65           HG1      THR  65   4.049  -2.358 -10.042
  517   1HG2  THR  65          HG21      THR  65   7.623  -3.442  -9.212
  518   2HG2  THR  65          HG22      THR  65   6.424  -3.970 -10.432
  519   3HG2  THR  65          HG23      THR  65   6.280  -4.489  -8.731
  520    H    LEU  66           HN       LEU  66   6.601  -0.736  -5.758
  521    HA   LEU  66           HA       LEU  66   6.019   1.201  -4.758
  522   1HB   LEU  66          HB2       LEU  66   7.373   1.790  -6.937
  523   2HB   LEU  66          HB1       LEU  66   5.862   2.514  -7.443
  524    HG   LEU  66           HG       LEU  66   7.303   4.226  -6.521
  525   1HD1  LEU  66          HD11      LEU  66   4.915   4.500  -6.040
  526   2HD1  LEU  66          HD12      LEU  66   5.929   5.167  -4.758
  527   3HD1  LEU  66          HD13      LEU  66   5.131   3.626  -4.522
  528   1HD2  LEU  66          HD21      LEU  66   7.383   2.550  -4.035
  529   2HD2  LEU  66          HD22      LEU  66   8.061   4.170  -4.206
  530   3HD2  LEU  66          HD23      LEU  66   8.716   2.833  -5.151
  531    H    ARG  67           HN       ARG  67   4.127   1.788  -7.706
  532    HA   ARG  67           HA       ARG  67   1.965   2.811  -6.173
  533   1HB   ARG  67          HB2       ARG  67   2.323   2.245  -9.070
  534   2HB   ARG  67          HB1       ARG  67   0.771   2.804  -8.437
  535   1HG   ARG  67          HG2       ARG  67   3.426   4.235  -8.297
  536   2HG   ARG  67          HG1       ARG  67   2.016   4.707  -9.254
  537   1HD   ARG  67          HD2       ARG  67   0.740   4.992  -7.137
  538   2HD   ARG  67          HD1       ARG  67   2.180   4.571  -6.255
  539    HE   ARG  67           HE       ARG  67   3.198   6.565  -6.838
  540   1HH1  ARG  67          HH11      ARG  67  -0.045   6.448  -8.216
  541   2HH1  ARG  67          HH12      ARG  67  -0.332   8.126  -8.070
  542   1HH2  ARG  67          HH21      ARG  67   2.778   8.901  -6.574
  543   2HH2  ARG  67          HH22      ARG  67   1.322   9.551  -7.127
  544    H    LYS  68           HN       LYS  68   2.808  -0.290  -7.190
  545    HA   LYS  68           HA       LYS  68   0.216  -1.415  -6.993
  546   1HB   LYS  68          HB2       LYS  68   2.127  -2.593  -8.060
  547   2HB   LYS  68          HB1       LYS  68   2.897  -2.710  -6.488
  548   1HG   LYS  68          HG2       LYS  68   1.231  -4.207  -5.697
  549   2HG   LYS  68          HG1       LYS  68   0.263  -3.982  -7.151
  550   1HD   LYS  68          HD2       LYS  68   3.079  -5.009  -7.268
  551   2HD   LYS  68          HD1       LYS  68   1.704  -6.094  -7.037
  552   1HE   LYS  68          HE2       LYS  68   1.964  -4.161  -9.342
  553   2HE   LYS  68          HE1       LYS  68   2.498  -5.840  -9.415
  554   1HZ   LYS  68          HZ1       LYS  68  -0.314  -4.956  -8.888
  555   2HZ   LYS  68          HZ2       LYS  68   0.256  -6.529  -8.889
  556   3HZ   LYS  68          HZ3       LYS  68   0.268  -5.652 -10.321
  557    H    LEU  69           HN       LEU  69   2.478  -0.274  -4.699
  558    HA   LEU  69           HA       LEU  69   1.416  -1.466  -2.338
  559   1HB   LEU  69          HB2       LEU  69   2.859   1.152  -2.758
  560   2HB   LEU  69          HB1       LEU  69   2.175   0.771  -1.205
  561    HG   LEU  69           HG       LEU  69   4.542   0.367  -1.192
  562   1HD1  LEU  69          HD11      LEU  69   3.246  -1.082   0.185
  563   2HD1  LEU  69          HD12      LEU  69   4.634  -1.951  -0.471
  564   3HD1  LEU  69          HD13      LEU  69   3.029  -2.214  -1.149
  565   1HD2  LEU  69          HD21      LEU  69   4.930  -0.032  -3.556
  566   2HD2  LEU  69          HD22      LEU  69   4.101  -1.584  -3.445
  567   3HD2  LEU  69          HD23      LEU  69   5.615  -1.330  -2.578
  568    H    GLN  70           HN       GLN  70   0.168   1.087  -4.382
  569    HA   GLN  70           HA       GLN  70  -1.958   1.464  -2.442
  570   1HB   GLN  70          HB2       GLN  70  -2.679   3.413  -3.954
  571   2HB   GLN  70          HB1       GLN  70  -1.291   3.610  -2.901
  572   1HG   GLN  70          HG2       GLN  70   0.193   3.253  -4.807
  573   2HG   GLN  70          HG1       GLN  70  -1.206   2.982  -5.822
  574   1HE2  GLN  70          HE21      GLN  70  -1.958   4.597  -6.872
  575   2HE2  GLN  70          HE22      GLN  70  -1.758   6.273  -6.467
  576    H    GLU  71           HN       GLU  71  -1.432  -0.602  -4.461
  577    HA   GLU  71           HA       GLU  71  -4.050  -0.633  -5.785
  578   1HB   GLU  71          HB2       GLU  71  -2.089  -0.994  -7.218
  579   2HB   GLU  71          HB1       GLU  71  -1.553  -2.295  -6.171
  580   1HG   GLU  71          HG2       GLU  71  -3.544  -3.576  -6.793
  581   2HG   GLU  71          HG1       GLU  71  -4.015  -2.274  -7.889
  582    H    MET  72           HN       MET  72  -1.809  -2.294  -3.687
  583    HA   MET  72           HA       MET  72  -3.810  -4.274  -2.882
  584   1HB   MET  72          HB2       MET  72  -0.857  -4.088  -2.230
  585   2HB   MET  72          HB1       MET  72  -1.922  -5.412  -1.779
  586   1HG   MET  72          HG2       MET  72  -1.114  -4.629  -4.578
  587   2HG   MET  72          HG1       MET  72  -0.549  -6.017  -3.661
  588   1HE   MET  72          HE1       MET  72  -2.790  -7.610  -6.480
  589   2HE   MET  72          HE2       MET  72  -1.171  -7.531  -5.779
  590   3HE   MET  72          HE3       MET  72  -1.832  -6.138  -6.632
  591    H    SER  73           HN       SER  73  -3.343  -1.276  -2.137
  592    HA   SER  73           HA       SER  73  -2.598  -1.010   0.523
  593   1HB   SER  73          HB2       SER  73  -3.882   1.194   0.199
  594   2HB   SER  73          HB1       SER  73  -2.576   0.836  -0.912
  595    HG   SER  73           HG       SER  73  -4.711   1.500  -1.878
  596    H    SER  74           HN       SER  74  -5.699  -1.568  -1.011
  597    HA   SER  74           HA       SER  74  -7.626  -2.443  -0.349
  598   1HB   SER  74          HB2       SER  74  -6.182  -3.346   2.138
  599   2HB   SER  74          HB1       SER  74  -7.677  -4.012   1.477
  600    HG   SER  74           HG       SER  74  -5.123  -3.982   0.302
  601    H    LYS  75           HN       LYS  75  -8.238  -0.195  -0.234
  602    HA   LYS  75           HA       LYS  75  -8.540   1.232   2.196
  603   1HB   LYS  75          HB2       LYS  75 -10.208   1.394  -0.321
  604   2HB   LYS  75          HB1       LYS  75 -10.205   2.580   0.973
  605   1HG   LYS  75          HG2       LYS  75  -7.805   1.853  -0.678
  606   2HG   LYS  75          HG1       LYS  75  -8.857   3.234  -0.987
  607   1HD   LYS  75          HD2       LYS  75  -8.273   4.216   1.128
  608   2HD   LYS  75          HD1       LYS  75  -7.364   2.773   1.589
  609   1HE   LYS  75          HE2       LYS  75  -5.883   4.568   0.850
  610   2HE   LYS  75          HE1       LYS  75  -5.790   3.165  -0.209
  611   1HZ   LYS  75          HZ1       LYS  75  -5.828   5.116  -1.523
  612   2HZ   LYS  75          HZ2       LYS  75  -7.162   5.754  -0.790
  613   3HZ   LYS  75          HZ3       LYS  75  -7.318   4.380  -1.767
  614    H    ALA  76           HN       ALA  76 -10.596  -1.023   0.481
  615    HA   ALA  76           HA       ALA  76 -11.997  -1.632   2.928
  616   1HB   ALA  76          HB1       ALA  76 -13.433  -0.765   0.413
  617   2HB   ALA  76          HB2       ALA  76 -13.381   0.123   1.934
  618   3HB   ALA  76          HB3       ALA  76 -14.194  -1.439   1.851
  619    H    GLY  77           HN       GLY  77 -13.034  -3.665   2.761
  620   1HA   GLY  77          HA2       GLY  77 -11.644  -5.585   1.246
  621   2HA   GLY  77          HA1       GLY  77 -13.140  -5.868   2.129
  622    H    SER  78           HN       SER  78 -11.818  -6.102  -0.804
  623    HA   SER  78           HA       SER  78 -13.471  -4.959  -2.667
  624   1HB   SER  78          HB2       SER  78 -12.274  -7.713  -2.893
  625   2HB   SER  78          HB1       SER  78 -12.490  -6.499  -4.159
  626    HG   SER  78           HG       SER  78 -10.639  -5.665  -3.638
  627    H    ASP  79           HN       ASP  79 -15.615  -5.192  -2.936
  628    HA   ASP  79           HA       ASP  79 -17.082  -7.361  -1.751
  629   1HB   ASP  79          HB2       ASP  79 -17.957  -5.050  -1.782
  630   2HB   ASP  79          HB1       ASP  79 -18.025  -5.109  -3.540
  631    H    THR  80           HN       THR  80 -18.287  -8.953  -2.865
  632    HA   THR  80           HA       THR  80 -17.103  -9.633  -5.440
  633    HB   THR  80           HB       THR  80 -18.964 -11.296  -3.717
  634    HG1  THR  80           HG1      THR  80 -17.084 -10.783  -2.527
  635   1HG2  THR  80          HG21      THR  80 -16.964 -12.053  -5.864
  636   2HG2  THR  80          HG22      THR  80 -18.718 -12.055  -6.044
  637   3HG2  THR  80          HG23      THR  80 -17.941 -13.184  -4.931
  638    H    GLU  81           HN       GLU  81 -20.284  -9.312  -3.917
  639    HA   GLU  81           HA       GLU  81 -21.517  -8.760  -6.522
  640   1HB   GLU  81          HB2       GLU  81 -21.745 -11.191  -6.147
  641   2HB   GLU  81          HB1       GLU  81 -22.479 -10.878  -4.583
  642   1HG   GLU  81          HG2       GLU  81 -24.193 -11.446  -6.133
  643   2HG   GLU  81          HG1       GLU  81 -24.339  -9.732  -5.748
  644    H    LEU  82           HN       LEU  82 -22.417  -9.484  -3.203
  645    HA   LEU  82           HA       LEU  82 -23.250  -6.797  -2.628
  646   1HB   LEU  82          HB2       LEU  82 -25.109  -9.188  -2.545
  647   2HB   LEU  82          HB1       LEU  82 -25.407  -7.715  -1.650
  648    HG   LEU  82           HG       LEU  82 -25.267  -7.899  -4.663
  649   1HD1  LEU  82          HD11      LEU  82 -27.639  -7.646  -2.813
  650   2HD1  LEU  82          HD12      LEU  82 -27.216  -9.074  -3.756
  651   3HD1  LEU  82          HD13      LEU  82 -27.690  -7.584  -4.575
  652   1HD2  LEU  82          HD21      LEU  82 -26.176  -5.634  -4.595
  653   2HD2  LEU  82          HD22      LEU  82 -24.617  -5.715  -3.770
  654   3HD2  LEU  82          HD23      LEU  82 -26.111  -5.653  -2.833
  655    H    ALA  83           HN       ALA  83 -23.124  -6.485  -0.417
  656    HA   ALA  83           HA       ALA  83 -21.503  -8.391   0.957
  657   1HB   ALA  83          HB1       ALA  83 -21.554  -6.827   2.831
  658   2HB   ALA  83          HB2       ALA  83 -22.811  -5.886   2.025
  659   3HB   ALA  83          HB3       ALA  83 -21.194  -5.987   1.325
  660    H    ALA  84           HN       ALA  84 -22.627 -10.207   1.170
  661    HA   ALA  84           HA       ALA  84 -25.252 -10.381   2.246
  662   1HB   ALA  84          HB1       ALA  84 -24.316 -12.158   0.829
  663   2HB   ALA  84          HB2       ALA  84 -24.771 -12.794   2.410
  664   3HB   ALA  84          HB3       ALA  84 -23.076 -12.476   2.042
  665    HA   PRO  85           HA       PRO  85 -24.154  -9.036   6.338
  666   1HB   PRO  85          HB2       PRO  85 -26.347 -10.431   7.475
  667   2HB   PRO  85          HB1       PRO  85 -26.273  -8.725   7.029
  668   1HG   PRO  85          HG2       PRO  85 -27.391 -11.029   5.525
  669   2HG   PRO  85          HG1       PRO  85 -27.899  -9.332   5.531
  670   1HD   PRO  85          HD2       PRO  85 -26.576 -10.371   3.461
  671   2HD   PRO  85          HD1       PRO  85 -26.257  -8.711   4.007
  672    H    LYS  86           HN       LYS  86 -22.403 -10.004   7.050
  673    HA   LYS  86           HA       LYS  86 -22.344 -12.857   7.640
  674   1HB   LYS  86          HB2       LYS  86 -20.187 -10.872   8.341
  675   2HB   LYS  86          HB1       LYS  86 -20.021 -12.576   7.953
  676   1HG   LYS  86          HG2       LYS  86 -20.665 -12.004   5.598
  677   2HG   LYS  86          HG1       LYS  86 -20.564 -10.306   6.054
  678   1HD   LYS  86          HD2       LYS  86 -18.490 -10.857   5.064
  679   2HD   LYS  86          HD1       LYS  86 -18.195 -10.788   6.805
  680   1HE   LYS  86          HE2       LYS  86 -17.105 -12.740   5.843
  681   2HE   LYS  86          HE1       LYS  86 -18.417 -13.238   6.917
  682   1HZ   LYS  86          HZ1       LYS  86 -18.625 -13.026   3.967
  683   2HZ   LYS  86          HZ2       LYS  86 -19.827 -13.620   4.979
  684   3HZ   LYS  86          HZ3       LYS  86 -18.376 -14.478   4.789
  685    H    SER  87           HN       SER  87 -22.037  -9.716   9.112
  686    HA   SER  87           HA       SER  87 -22.787 -10.820  11.703
  687   1HB   SER  87          HB2       SER  87 -21.197  -8.317  11.053
  688   2HB   SER  87          HB1       SER  87 -21.573  -8.927  12.667
  689    HG   SER  87           HG       SER  87 -20.541 -10.921  11.837
  690    H    LYS  88           HN       LYS  88 -24.919 -10.515  11.782
  691    HA   LYS  88           HA       LYS  88 -26.355  -8.479  10.457
  692   1HB   LYS  88          HB2       LYS  88 -27.128 -10.092  12.907
  693   2HB   LYS  88          HB1       LYS  88 -28.240  -9.119  11.956
  694   1HG   LYS  88          HG2       LYS  88 -27.838 -10.544  10.010
  695   2HG   LYS  88          HG1       LYS  88 -26.694 -11.503  10.945
  696   1HD   LYS  88          HD2       LYS  88 -29.620 -11.176  11.631
  697   2HD   LYS  88          HD1       LYS  88 -28.954 -12.540  10.733
  698   1HE   LYS  88          HE2       LYS  88 -27.540 -13.107  12.658
  699   2HE   LYS  88          HE1       LYS  88 -28.200 -11.735  13.546
  700   1HZ   LYS  88          HZ1       LYS  88 -29.797 -14.052  12.562
  701   2HZ   LYS  88          HZ2       LYS  88 -30.370 -12.763  13.505
  702   3HZ   LYS  88          HZ3       LYS  88 -29.258 -13.848  14.139
  703    H    ASN  89           HN       ASN  89 -25.850  -8.861  13.931
  704    HA   ASN  89           HA       ASN  89 -25.485  -7.462  15.635
  705   1HB   ASN  89          HB2       ASN  89 -23.882  -6.040  13.506
  706   2HB   ASN  89          HB1       ASN  89 -23.823  -5.618  15.210
  707   1HD2  ASN  89          HD21      ASN  89 -21.639  -6.073  15.249
  708   2HD2  ASN  89          HD22      ASN  89 -21.008  -7.679  15.278
  Start of MODEL    3
    1   1H    GLY   1          HT1       GLY   1 -11.888   6.152  -0.161
    2   2H    GLY   1          HT2       GLY   1 -10.775   6.931  -1.209
    3   3H    GLY   1          HT3       GLY   1 -11.154   7.594   0.265
    4   1HA   GLY   1          HA1       GLY   1 -10.105   5.810   1.450
    5   2HA   GLY   1          HA2       GLY   1  -9.815   4.972  -0.067
    6    H    ASP   2           HN       ASP   2  -9.253   8.218   1.345
    7    HA   ASP   2           HA       ASP   2  -6.693   8.258  -0.072
    8   1HB   ASP   2          HB2       ASP   2  -6.692  10.663   0.165
    9   2HB   ASP   2          HB1       ASP   2  -8.242  10.160  -0.500
   10    H    GLY   3           HN       GLY   3  -8.116   8.413   3.120
   11   1HA   GLY   3          HA2       GLY   3  -6.384   7.272   4.671
   12   2HA   GLY   3          HA1       GLY   3  -5.398   8.655   4.228
   13    H    GLU   4           HN       GLU   4  -8.819   8.353   5.091
   14    HA   GLU   4           HA       GLU   4  -8.679  10.630   6.842
   15   1HB   GLU   4          HB2       GLU   4 -11.081  10.089   7.255
   16   2HB   GLU   4          HB1       GLU   4 -10.695  10.238   5.548
   17   1HG   GLU   4          HG2       GLU   4 -10.453   7.693   5.583
   18   2HG   GLU   4          HG1       GLU   4 -11.293   7.773   7.132
   19    H    ALA   5           HN       ALA   5  -8.868   7.188   7.125
   20    HA   ALA   5           HA       ALA   5  -7.761   7.229   9.792
   21   1HB   ALA   5          HB1       ALA   5 -10.164   6.781  10.144
   22   2HB   ALA   5          HB2       ALA   5  -9.255   5.281  10.339
   23   3HB   ALA   5          HB3       ALA   5 -10.144   5.583   8.849
   24    H    GLN   6           HN       GLN   6  -6.160   5.606   9.838
   25    HA   GLN   6           HA       GLN   6  -4.597   4.255   9.005
   26   1HB   GLN   6          HB2       GLN   6  -6.370   2.611   8.433
   27   2HB   GLN   6          HB1       GLN   6  -6.692   3.468   6.937
   28   1HG   GLN   6          HG2       GLN   6  -4.368   2.924   6.213
   29   2HG   GLN   6          HG1       GLN   6  -4.209   1.929   7.660
   30   1HE2  GLN   6          HE21      GLN   6  -4.087   1.140   4.880
   31   2HE2  GLN   6          HE22      GLN   6  -5.325  -0.029   4.636
   32    H    ARG   7           HN       ARG   7  -2.954   5.251   8.129
   33    HA   ARG   7           HA       ARG   7  -3.470   7.368   6.265
   34   1HB   ARG   7          HB2       ARG   7  -1.124   7.925   6.317
   35   2HB   ARG   7          HB1       ARG   7  -1.677   7.617   7.949
   36   1HG   ARG   7          HG2       ARG   7  -0.553   5.458   7.939
   37   2HG   ARG   7          HG1       ARG   7  -0.062   5.705   6.253
   38   1HD   ARG   7          HD2       ARG   7   1.092   7.790   6.966
   39   2HD   ARG   7          HD1       ARG   7   0.714   7.391   8.632
   40    HE   ARG   7           HE       ARG   7   2.064   5.215   7.916
   41   1HH1  ARG   7          HH11      ARG   7   2.766   8.590   7.130
   42   2HH1  ARG   7          HH12      ARG   7   4.469   8.400   7.213
   43   1HH2  ARG   7          HH21      ARG   7   4.491   4.954   7.880
   44   2HH2  ARG   7          HH22      ARG   7   5.416   6.343   7.630
   45    H    ASP   8           HN       ASP   8  -2.483   7.651   4.180
   46    HA   ASP   8           HA       ASP   8  -3.014   5.450   2.512
   47   1HB   ASP   8          HB2       ASP   8  -3.263   7.671   1.593
   48   2HB   ASP   8          HB1       ASP   8  -1.580   8.053   1.936
   49    H    LEU   9           HN       LEU   9  -1.887   3.822   2.069
   50    HA   LEU   9           HA       LEU   9   0.455   3.052   3.277
   51   1HB   LEU   9          HB2       LEU   9  -1.500   1.845   2.049
   52   2HB   LEU   9          HB1       LEU   9  -0.499   2.045   0.631
   53    HG   LEU   9           HG       LEU   9   0.363   0.674   3.120
   54   1HD1  LEU   9          HD11      LEU   9  -0.757  -0.475   0.556
   55   2HD1  LEU   9          HD12      LEU   9  -1.512  -0.531   2.158
   56   3HD1  LEU   9          HD13      LEU   9  -0.033  -1.437   1.843
   57   1HD2  LEU   9          HD21      LEU   9   2.089  -0.338   1.658
   58   2HD2  LEU   9          HD22      LEU   9   2.200   1.428   1.729
   59   3HD2  LEU   9          HD23      LEU   9   1.465   0.645   0.331
   60    H    VAL  10           HN       VAL  10  -0.032   4.630   0.181
   61    HA   VAL  10           HA       VAL  10   2.670   4.172  -0.611
   62    HB   VAL  10           HB       VAL  10   0.554   5.932  -1.857
   63   1HG1  VAL  10          HG11      VAL  10   2.841   6.619  -2.525
   64   2HG1  VAL  10          HG12      VAL  10   1.971   5.870  -3.864
   65   3HG1  VAL  10          HG13      VAL  10   3.192   4.953  -2.984
   66   1HG2  VAL  10          HG21      VAL  10  -0.003   3.579  -1.707
   67   2HG2  VAL  10          HG22      VAL  10   1.515   3.159  -2.500
   68   3HG2  VAL  10          HG23      VAL  10   0.280   4.078  -3.363
   69    H    LYS  11           HN       LYS  11   0.874   6.982   0.587
   70    HA   LYS  11           HA       LYS  11   3.257   8.587   0.588
   71   1HB   LYS  11          HB2       LYS  11   0.651   9.096   2.035
   72   2HB   LYS  11          HB1       LYS  11   1.931  10.278   1.747
   73   1HG   LYS  11          HG2       LYS  11   1.621  10.043  -0.644
   74   2HG   LYS  11          HG1       LYS  11   0.345   8.863  -0.366
   75   1HD   LYS  11          HD2       LYS  11  -0.832  10.688   0.944
   76   2HD   LYS  11          HD1       LYS  11   0.353  11.798   0.230
   77   1HE   LYS  11          HE2       LYS  11  -1.580  11.800  -1.178
   78   2HE   LYS  11          HE1       LYS  11  -0.291  10.927  -2.009
   79   1HZ   LYS  11          HZ1       LYS  11  -1.350   8.813  -1.161
   80   2HZ   LYS  11          HZ2       LYS  11  -2.346   9.708  -2.219
   81   3HZ   LYS  11          HZ3       LYS  11  -2.591   9.795  -0.562
   82    H    ALA  12           HN       ALA  12   2.592   6.049   2.286
   83    HA   ALA  12           HA       ALA  12   3.971   6.897   4.711
   84   1HB   ALA  12          HB1       ALA  12   2.681   4.260   3.957
   85   2HB   ALA  12          HB2       ALA  12   1.989   5.484   5.025
   86   3HB   ALA  12          HB3       ALA  12   3.446   4.615   5.508
   87    H    VAL  13           HN       VAL  13   4.041   4.133   2.477
   88    HA   VAL  13           HA       VAL  13   6.683   3.385   3.050
   89    HB   VAL  13           HB       VAL  13   4.880   2.631   0.732
   90   1HG1  VAL  13          HG11      VAL  13   7.206   2.274   0.101
   91   2HG1  VAL  13          HG12      VAL  13   6.365   0.738   0.361
   92   3HG1  VAL  13          HG13      VAL  13   7.477   1.356   1.590
   93   1HG2  VAL  13          HG21      VAL  13   5.602   1.203   3.287
   94   2HG2  VAL  13          HG22      VAL  13   4.577   0.561   2.005
   95   3HG2  VAL  13          HG23      VAL  13   4.058   1.972   2.924
   96    H    ALA  14           HN       ALA  14   5.366   5.250   0.293
   97    HA   ALA  14           HA       ALA  14   7.913   5.417  -0.958
   98   1HB   ALA  14          HB1       ALA  14   5.796   5.648  -2.261
   99   2HB   ALA  14          HB2       ALA  14   6.854   7.030  -2.504
  100   3HB   ALA  14          HB3       ALA  14   5.457   7.158  -1.435
  101    H    HIS  15           HN       HIS  15   6.338   7.126   1.551
  102    HA   HIS  15           HA       HIS  15   8.011   9.461   1.345
  103   1HB   HIS  15          HB2       HIS  15   5.687   9.581   2.245
  104   2HB   HIS  15          HB1       HIS  15   6.189   8.618   3.621
  105    HD1  HIS  15           HD1      HIS  15   7.139  11.982   2.037
  106    HD2  HIS  15           HD2      HIS  15   6.850  10.147   5.764
  107    HE1  HIS  15           HE1      HIS  15   7.633  13.768   3.708
  108    HE2  HIS  15           HE2      HIS  15   6.983  12.722   5.878
  109    H    ILE  16           HN       ILE  16   8.368   6.338   2.626
  110    HA   ILE  16           HA       ILE  16  10.321   6.947   4.623
  111    HB   ILE  16           HB       ILE  16   9.918   4.358   3.064
  112   1HG1  ILE  16          HG12      ILE  16   7.890   4.915   4.278
  113   2HG1  ILE  16          HG11      ILE  16   8.685   3.551   5.050
  114   1HG2  ILE  16          HG21      ILE  16  11.097   3.243   4.908
  115   2HG2  ILE  16          HG22      ILE  16  11.412   4.813   5.644
  116   3HG2  ILE  16          HG23      ILE  16  12.120   4.421   4.080
  117   1HD1  ILE  16          HD11      ILE  16   8.743   6.411   6.003
  118   2HD1  ILE  16          HD12      ILE  16   9.552   5.051   6.781
  119   3HD1  ILE  16          HD13      ILE  16   7.792   5.097   6.695
  120    H    LEU  17           HN       LEU  17  10.326   6.241   1.208
  121    HA   LEU  17           HA       LEU  17  13.195   6.400   0.919
  122   1HB   LEU  17          HB2       LEU  17  10.976   6.454  -1.131
  123   2HB   LEU  17          HB1       LEU  17  12.680   6.475  -1.533
  124    HG   LEU  17           HG       LEU  17  11.248   4.223  -0.124
  125   1HD1  LEU  17          HD11      LEU  17  12.276   4.441  -2.948
  126   2HD1  LEU  17          HD12      LEU  17  10.583   4.426  -2.456
  127   3HD1  LEU  17          HD13      LEU  17  11.585   2.997  -2.209
  128   1HD2  LEU  17          HD21      LEU  17  13.338   2.996  -0.467
  129   2HD2  LEU  17          HD22      LEU  17  13.596   4.428   0.535
  130   3HD2  LEU  17          HD23      LEU  17  14.073   4.443  -1.161
  131    H    GLY  18           HN       GLY  18  10.461   8.407   0.081
  132   1HA   GLY  18          HA2       GLY  18  10.736  10.825   0.685
  133   2HA   GLY  18          HA1       GLY  18  12.297  10.707  -0.130
  134    H    ILE  19           HN       ILE  19   9.204   9.315  -1.031
  135    HA   ILE  19           HA       ILE  19   9.011  11.066  -3.330
  136    HB   ILE  19           HB       ILE  19   8.114   8.828  -4.439
  137   1HG1  ILE  19          HG12      ILE  19  10.290   7.841  -2.589
  138   2HG1  ILE  19          HG11      ILE  19   8.603   7.361  -2.582
  139   1HG2  ILE  19          HG21      ILE  19  10.271   8.593  -5.595
  140   2HG2  ILE  19          HG22      ILE  19  11.000   9.667  -4.400
  141   3HG2  ILE  19          HG23      ILE  19   9.700  10.257  -5.468
  142   1HD1  ILE  19          HD11      ILE  19  10.601   6.799  -4.761
  143   2HD1  ILE  19          HD12      ILE  19   8.908   6.306  -4.764
  144   3HD1  ILE  19          HD13      ILE  19  10.013   5.649  -3.561
  145    H    ARG  20           HN       ARG  20   6.848  10.691  -4.381
  146    HA   ARG  20           HA       ARG  20   4.744   9.570  -2.756
  147   1HB   ARG  20          HB2       ARG  20   5.101  11.807  -1.694
  148   2HB   ARG  20          HB1       ARG  20   4.699  12.538  -3.249
  149   1HG   ARG  20          HG2       ARG  20   2.562  11.150  -3.115
  150   2HG   ARG  20          HG1       ARG  20   2.934  10.978  -1.403
  151   1HD   ARG  20          HD2       ARG  20   1.471  12.841  -1.588
  152   2HD   ARG  20          HD1       ARG  20   3.083  13.493  -1.287
  153    HE   ARG  20           HE       ARG  20   2.919  13.477  -3.990
  154   1HH1  ARG  20          HH11      ARG  20   0.852  14.894  -1.473
  155   2HH1  ARG  20          HH12      ARG  20   0.221  16.097  -2.499
  156   1HH2  ARG  20          HH21      ARG  20   2.087  15.053  -5.341
  157   2HH2  ARG  20          HH22      ARG  20   0.987  16.245  -4.769
  158    H    ASP  21           HN       ASP  21   5.711  11.685  -5.390
  159    HA   ASP  21           HA       ASP  21   3.227  11.237  -6.799
  160   1HB   ASP  21          HB2       ASP  21   5.665  12.770  -7.710
  161   2HB   ASP  21          HB1       ASP  21   4.077  12.779  -8.466
  162    H    LEU  22           HN       LEU  22   6.593  10.380  -7.024
  163    HA   LEU  22           HA       LEU  22   7.682   8.739  -8.174
  164   1HB   LEU  22          HB2       LEU  22   4.875   7.631  -8.365
  165   2HB   LEU  22          HB1       LEU  22   6.235   6.824  -9.106
  166    HG   LEU  22           HG       LEU  22   5.668   5.756  -7.040
  167   1HD1  LEU  22          HD11      LEU  22   7.966   5.770  -7.670
  168   2HD1  LEU  22          HD12      LEU  22   7.804   5.840  -5.916
  169   3HD1  LEU  22          HD13      LEU  22   8.220   7.295  -6.823
  170   1HD2  LEU  22          HD21      LEU  22   4.618   7.606  -5.846
  171   2HD2  LEU  22          HD22      LEU  22   6.177   8.407  -5.678
  172   3HD2  LEU  22          HD23      LEU  22   5.885   6.869  -4.867
  173    H    ALA  23           HN       ALA  23   7.189  11.080  -9.487
  174    HA   ALA  23           HA       ALA  23   6.121  10.422 -12.055
  175   1HB   ALA  23          HB1       ALA  23   7.271  13.014 -11.042
  176   2HB   ALA  23          HB2       ALA  23   5.568  12.557 -11.034
  177   3HB   ALA  23          HB3       ALA  23   6.412  12.794 -12.566
  178    H    GLY  24           HN       GLY  24   8.969   9.939 -10.647
  179   1HA   GLY  24          HA2       GLY  24  10.419   9.950 -13.215
  180   2HA   GLY  24          HA1       GLY  24  11.172  10.673 -11.801
  181    H    ILE  25           HN       ILE  25  10.256   8.768  -9.893
  182    HA   ILE  25           HA       ILE  25  12.240   6.813  -9.997
  183    HB   ILE  25           HB       ILE  25   9.615   6.752  -8.474
  184   1HG1  ILE  25          HG12      ILE  25  10.978   8.719  -7.967
  185   2HG1  ILE  25          HG11      ILE  25  10.857   7.638  -6.592
  186   1HG2  ILE  25          HG21      ILE  25  10.699   5.191  -6.913
  187   2HG2  ILE  25          HG22      ILE  25  12.114   5.133  -7.962
  188   3HG2  ILE  25          HG23      ILE  25  10.567   4.518  -8.539
  189   1HD1  ILE  25          HD11      ILE  25  13.092   6.805  -7.048
  190   2HD1  ILE  25          HD12      ILE  25  13.074   8.552  -6.806
  191   3HD1  ILE  25          HD13      ILE  25  13.217   7.888  -8.440
  192    H    ASN  26           HN       ASN  26  12.250   4.725 -10.591
  193    HA   ASN  26           HA       ASN  26  10.525   3.966 -12.753
  194   1HB   ASN  26          HB2       ASN  26  12.861   3.298 -12.809
  195   2HB   ASN  26          HB1       ASN  26  12.670   2.409 -11.298
  196   1HD2  ASN  26          HD21      ASN  26  12.077   2.412 -14.702
  197   2HD2  ASN  26          HD22      ASN  26  11.478   0.775 -14.766
  198    H    LEU  27           HN       LEU  27   8.736   2.786 -12.697
  199    HA   LEU  27           HA       LEU  27   7.907   1.797 -10.080
  200   1HB   LEU  27          HB2       LEU  27   6.291   2.552 -12.498
  201   2HB   LEU  27          HB1       LEU  27   5.621   1.920 -11.008
  202    HG   LEU  27           HG       LEU  27   7.129   4.519 -11.284
  203   1HD1  LEU  27          HD11      LEU  27   4.935   4.608 -12.325
  204   2HD1  LEU  27          HD12      LEU  27   4.967   5.559 -10.838
  205   3HD1  LEU  27          HD13      LEU  27   4.200   3.971 -10.854
  206   1HD2  LEU  27          HD21      LEU  27   6.432   4.902  -8.968
  207   2HD2  LEU  27          HD22      LEU  27   7.459   3.473  -9.103
  208   3HD2  LEU  27          HD23      LEU  27   5.713   3.292  -8.923
  209    H    ASP  28           HN       ASP  28   9.466   0.390 -12.460
  210    HA   ASP  28           HA       ASP  28   7.730  -1.965 -12.292
  211   1HB   ASP  28          HB2       ASP  28   8.670  -2.918 -14.287
  212   2HB   ASP  28          HB1       ASP  28   8.322  -1.247 -14.667
  213    H    SER  29           HN       SER  29  10.072  -0.645 -10.726
  214    HA   SER  29           HA       SER  29  11.889  -2.821 -10.346
  215   1HB   SER  29          HB2       SER  29  11.433  -0.314  -8.722
  216   2HB   SER  29          HB1       SER  29  12.783  -1.432  -8.526
  217    HG   SER  29           HG       SER  29  12.308  -0.331 -11.065
  218    H    SER  30           HN       SER  30  11.713  -4.436  -8.931
  219    HA   SER  30           HA       SER  30   9.431  -4.986  -7.416
  220   1HB   SER  30          HB2       SER  30  12.273  -5.952  -7.086
  221   2HB   SER  30          HB1       SER  30  10.868  -6.740  -6.386
  222    HG   SER  30           HG       SER  30  10.091  -6.841  -8.641
  223    H    LEU  31           HN       LEU  31   9.073  -4.793  -5.144
  224    HA   LEU  31           HA       LEU  31   9.830  -2.335  -4.002
  225   1HB   LEU  31          HB2       LEU  31   7.744  -3.637  -3.503
  226   2HB   LEU  31          HB1       LEU  31   8.719  -4.739  -2.555
  227    HG   LEU  31           HG       LEU  31   9.281  -2.916  -0.995
  228   1HD1  LEU  31          HD11      LEU  31   8.155  -0.798  -1.198
  229   2HD1  LEU  31          HD12      LEU  31   7.403  -1.379  -2.702
  230   3HD1  LEU  31          HD13      LEU  31   9.163  -1.138  -2.625
  231   1HD2  LEU  31          HD21      LEU  31   7.298  -4.269  -0.579
  232   2HD2  LEU  31          HD22      LEU  31   6.335  -3.140  -1.531
  233   3HD2  LEU  31          HD23      LEU  31   7.087  -2.608  -0.024
  234    H    ALA  32           HN       ALA  32  11.133  -5.496  -3.779
  235    HA   ALA  32           HA       ALA  32  12.653  -5.042  -1.446
  236   1HB   ALA  32          HB1       ALA  32  12.113  -7.306  -2.192
  237   2HB   ALA  32          HB2       ALA  32  13.858  -7.115  -1.990
  238   3HB   ALA  32          HB3       ALA  32  13.139  -7.090  -3.605
  239    H    ASP  33           HN       ASP  33  13.186  -4.442  -4.804
  240    HA   ASP  33           HA       ASP  33  15.973  -3.964  -4.706
  241   1HB   ASP  33          HB2       ASP  33  13.828  -3.298  -6.702
  242   2HB   ASP  33          HB1       ASP  33  15.458  -2.679  -6.906
  243    H    LEU  34           HN       LEU  34  13.272  -2.227  -3.749
  244    HA   LEU  34           HA       LEU  34  14.400   0.424  -3.986
  245   1HB   LEU  34          HB2       LEU  34  11.878  -0.710  -2.855
  246   2HB   LEU  34          HB1       LEU  34  12.354   0.920  -2.455
  247    HG   LEU  34           HG       LEU  34  11.988   1.683  -4.679
  248   1HD1  LEU  34          HD11      LEU  34  11.670  -1.197  -5.533
  249   2HD1  LEU  34          HD12      LEU  34  13.061  -0.174  -5.898
  250   3HD1  LEU  34          HD13      LEU  34  11.473   0.228  -6.554
  251   1HD2  LEU  34          HD21      LEU  34   9.996   1.325  -3.415
  252   2HD2  LEU  34          HD22      LEU  34   9.980  -0.363  -3.910
  253   3HD2  LEU  34          HD23      LEU  34   9.690   0.907  -5.115
  254    H    GLY  35           HN       GLY  35  14.350  -2.119  -1.695
  255   1HA   GLY  35          HA2       GLY  35  16.207  -1.667  -0.007
  256   2HA   GLY  35          HA1       GLY  35  15.234  -0.264   0.410
  257    H    LEU  36           HN       LEU  36  13.071  -2.646  -0.367
  258    HA   LEU  36           HA       LEU  36  12.398  -3.078   2.300
  259   1HB   LEU  36          HB2       LEU  36  10.537  -3.362   1.149
  260   2HB   LEU  36          HB1       LEU  36  11.281  -4.002  -0.272
  261    HG   LEU  36           HG       LEU  36  11.381  -6.251   0.908
  262   1HD1  LEU  36          HD11      LEU  36  10.002  -6.603   2.880
  263   2HD1  LEU  36          HD12      LEU  36   9.701  -4.868   2.985
  264   3HD1  LEU  36          HD13      LEU  36  11.334  -5.495   3.215
  265   1HD2  LEU  36          HD21      LEU  36   8.684  -4.980   0.671
  266   2HD2  LEU  36          HD22      LEU  36   9.012  -6.713   0.720
  267   3HD2  LEU  36          HD23      LEU  36   9.608  -5.737  -0.630
  268    H    ASP  37           HN       ASP  37  13.271  -4.093   3.690
  269    HA   ASP  37           HA       ASP  37  14.196  -6.823   3.335
  270   1HB   ASP  37          HB2       ASP  37  16.268  -5.666   3.041
  271   2HB   ASP  37          HB1       ASP  37  15.918  -4.571   4.373
  272    H    SER  38           HN       SER  38  13.700  -4.079   5.510
  273    HA   SER  38           HA       SER  38  12.586  -5.987   7.393
  274   1HB   SER  38          HB2       SER  38  14.492  -3.755   8.120
  275   2HB   SER  38          HB1       SER  38  13.608  -4.741   9.287
  276    HG   SER  38           HG       SER  38  15.489  -5.732   7.352
  277    H    LEU  39           HN       LEU  39  12.932  -2.402   7.401
  278    HA   LEU  39           HA       LEU  39  10.445  -2.108   8.691
  279   1HB   LEU  39          HB2       LEU  39  12.212  -0.407   8.788
  280   2HB   LEU  39          HB1       LEU  39  11.919  -0.020   7.101
  281    HG   LEU  39           HG       LEU  39   9.551   0.526   7.746
  282   1HD1  LEU  39          HD11      LEU  39  10.663   0.403  10.531
  283   2HD1  LEU  39          HD12      LEU  39   9.413  -0.629   9.840
  284   3HD1  LEU  39          HD13      LEU  39   9.105   1.092  10.078
  285   1HD2  LEU  39          HD21      LEU  39  11.742   2.194   8.955
  286   2HD2  LEU  39          HD22      LEU  39  10.089   2.722   8.594
  287   3HD2  LEU  39          HD23      LEU  39  11.169   2.238   7.279
  288    H    MET  40           HN       MET  40  11.308  -2.061   5.289
  289    HA   MET  40           HA       MET  40   8.753  -1.050   4.439
  290   1HB   MET  40          HB2       MET  40  10.942  -2.351   2.831
  291   2HB   MET  40          HB1       MET  40   9.519  -1.544   2.179
  292   1HG   MET  40          HG2       MET  40  10.216   0.548   3.179
  293   2HG   MET  40          HG1       MET  40  11.632  -0.242   3.865
  294   1HE   MET  40          HE1       MET  40  13.265   1.488   2.854
  295   2HE   MET  40          HE2       MET  40  11.884   2.379   2.218
  296   3HE   MET  40          HE3       MET  40  13.247   1.996   1.165
  297    H    GLY  41           HN       GLY  41   9.470  -3.862   5.780
  298   1HA   GLY  41          HA2       GLY  41   7.277  -5.202   4.349
  299   2HA   GLY  41          HA1       GLY  41   8.605  -6.063   5.129
  300    H    VAL  42           HN       VAL  42   8.742  -4.379   7.433
  301    HA   VAL  42           HA       VAL  42   6.693  -5.645   8.955
  302    HB   VAL  42           HB       VAL  42   8.728  -3.595   9.906
  303   1HG1  VAL  42          HG11      VAL  42   6.797  -3.750  11.389
  304   2HG1  VAL  42          HG12      VAL  42   8.230  -4.441  12.150
  305   3HG1  VAL  42          HG13      VAL  42   6.990  -5.500  11.476
  306   1HG2  VAL  42          HG21      VAL  42   8.786  -6.607  10.074
  307   2HG2  VAL  42          HG22      VAL  42   9.959  -5.512  10.807
  308   3HG2  VAL  42          HG23      VAL  42   9.813  -5.604   9.050
  309    H    GLU  43           HN       GLU  43   7.344  -2.211   8.058
  310    HA   GLU  43           HA       GLU  43   5.158  -1.386   9.639
  311   1HB   GLU  43          HB2       GLU  43   6.984   0.208   8.962
  312   2HB   GLU  43          HB1       GLU  43   6.297   0.218   7.336
  313   1HG   GLU  43          HG2       GLU  43   4.187   1.059   8.189
  314   2HG   GLU  43          HG1       GLU  43   4.799   0.984   9.831
  315    H    VAL  44           HN       VAL  44   5.503  -2.395   6.356
  316    HA   VAL  44           HA       VAL  44   2.956  -1.667   5.383
  317    HB   VAL  44           HB       VAL  44   4.695  -4.052   4.613
  318   1HG1  VAL  44          HG11      VAL  44   3.393  -4.149   2.538
  319   2HG1  VAL  44          HG12      VAL  44   2.337  -2.868   3.135
  320   3HG1  VAL  44          HG13      VAL  44   2.362  -4.434   3.942
  321   1HG2  VAL  44          HG21      VAL  44   5.343  -2.666   2.713
  322   2HG2  VAL  44          HG22      VAL  44   5.749  -1.888   4.244
  323   3HG2  VAL  44          HG23      VAL  44   4.341  -1.349   3.328
  324    H    ARG  45           HN       ARG  45   4.085  -4.572   7.020
  325    HA   ARG  45           HA       ARG  45   1.550  -5.773   7.134
  326   1HB   ARG  45          HB2       ARG  45   4.087  -6.231   8.663
  327   2HB   ARG  45          HB1       ARG  45   2.637  -7.156   9.020
  328   1HG   ARG  45          HG2       ARG  45   2.570  -7.910   6.678
  329   2HG   ARG  45          HG1       ARG  45   4.055  -7.009   6.366
  330   1HD   ARG  45          HD2       ARG  45   3.792  -9.193   8.414
  331   2HD   ARG  45          HD1       ARG  45   4.361  -9.451   6.767
  332    HE   ARG  45           HE       ARG  45   6.088  -7.703   7.419
  333   1HH1  ARG  45          HH11      ARG  45   4.727 -10.016   9.740
  334   2HH1  ARG  45          HH12      ARG  45   6.173 -10.229  10.610
  335   1HH2  ARG  45          HH21      ARG  45   8.138  -8.104   8.561
  336   2HH2  ARG  45          HH22      ARG  45   8.165  -9.132   9.911
  337    H    GLN  46           HN       GLN  46   3.121  -3.441   9.215
  338    HA   GLN  46           HA       GLN  46   1.060  -3.638  11.216
  339   1HB   GLN  46          HB2       GLN  46   3.161  -1.480  10.883
  340   2HB   GLN  46          HB1       GLN  46   2.131  -1.701  12.290
  341   1HG   GLN  46          HG2       GLN  46   3.170  -3.953  12.587
  342   2HG   GLN  46          HG1       GLN  46   4.292  -3.534  11.298
  343   1HE2  GLN  46          HE21      GLN  46   4.379  -0.675  12.276
  344   2HE2  GLN  46          HE22      GLN  46   5.386  -0.745  13.660
  345    H    ILE  47           HN       ILE  47   0.974  -2.496   8.223
  346    HA   ILE  47           HA       ILE  47  -1.074  -0.504   8.885
  347    HB   ILE  47           HB       ILE  47   0.110  -1.221   6.160
  348   1HG1  ILE  47          HG12      ILE  47   0.434   1.309   7.789
  349   2HG1  ILE  47          HG11      ILE  47   1.646   0.037   7.657
  350   1HG2  ILE  47          HG21      ILE  47  -1.882   0.939   6.878
  351   2HG2  ILE  47          HG22      ILE  47  -2.222  -0.524   5.957
  352   3HG2  ILE  47          HG23      ILE  47  -1.147   0.704   5.292
  353   1HD1  ILE  47          HD11      ILE  47   2.179   1.915   6.204
  354   2HD1  ILE  47          HD12      ILE  47   0.616   1.762   5.403
  355   3HD1  ILE  47          HD13      ILE  47   1.814   0.478   5.248
  356    H    LEU  48           HN       LEU  48  -0.560  -3.171   6.621
  357    HA   LEU  48           HA       LEU  48  -3.280  -3.531   6.125
  358   1HB   LEU  48          HB2       LEU  48  -0.938  -5.328   5.576
  359   2HB   LEU  48          HB1       LEU  48  -2.570  -5.778   5.152
  360    HG   LEU  48           HG       LEU  48  -1.560  -4.972   3.194
  361   1HD1  LEU  48          HD11      LEU  48  -2.895  -3.043   2.587
  362   2HD1  LEU  48          HD12      LEU  48  -3.286  -2.794   4.289
  363   3HD1  LEU  48          HD13      LEU  48  -3.825  -4.259   3.465
  364   1HD2  LEU  48          HD21      LEU  48   0.321  -3.768   4.135
  365   2HD2  LEU  48          HD22      LEU  48  -0.760  -2.489   4.692
  366   3HD2  LEU  48          HD23      LEU  48  -0.534  -2.764   2.965
  367    H    GLU  49           HN       GLU  49  -1.170  -5.397   8.345
  368    HA   GLU  49           HA       GLU  49  -3.350  -7.132   9.029
  369   1HB   GLU  49          HB2       GLU  49  -1.001  -7.920   9.110
  370   2HB   GLU  49          HB1       GLU  49  -0.683  -6.791  10.421
  371   1HG   GLU  49          HG2       GLU  49  -2.464  -7.996  11.737
  372   2HG   GLU  49          HG1       GLU  49  -2.471  -9.210  10.460
  373    H    ARG  50           HN       ARG  50  -2.025  -4.200  10.238
  374    HA   ARG  50           HA       ARG  50  -3.184  -4.445  12.846
  375   1HB   ARG  50          HB2       ARG  50  -1.153  -3.066  12.192
  376   2HB   ARG  50          HB1       ARG  50  -2.291  -1.895  11.548
  377   1HG   ARG  50          HG2       ARG  50  -3.331  -1.770  13.806
  378   2HG   ARG  50          HG1       ARG  50  -2.021  -2.792  14.400
  379   1HD   ARG  50          HD2       ARG  50  -1.344  -0.584  14.853
  380   2HD   ARG  50          HD1       ARG  50  -0.434  -1.074  13.425
  381    HE   ARG  50           HE       ARG  50  -2.855   0.193  12.698
  382   1HH1  ARG  50          HH11      ARG  50   0.488   0.915  13.706
  383   2HH1  ARG  50          HH12      ARG  50   0.386   2.552  13.249
  384   1HH2  ARG  50          HH21      ARG  50  -2.954   2.392  12.092
  385   2HH2  ARG  50          HH22      ARG  50  -1.637   3.448  12.394
  386    H    GLU  51           HN       GLU  51  -3.925  -2.469   9.984
  387    HA   GLU  51           HA       GLU  51  -6.244  -1.355  11.269
  388   1HB   GLU  51          HB2       GLU  51  -5.400  -1.046   8.398
  389   2HB   GLU  51          HB1       GLU  51  -6.423   0.030   9.327
  390   1HG   GLU  51          HG2       GLU  51  -3.476  -0.436   9.798
  391   2HG   GLU  51          HG1       GLU  51  -4.167   0.924   8.930
  392    H    HIS  52           HN       HIS  52  -5.584  -3.912   8.909
  393    HA   HIS  52           HA       HIS  52  -8.479  -4.416   8.786
  394   1HB   HIS  52          HB2       HIS  52  -6.666  -4.035   6.457
  395   2HB   HIS  52          HB1       HIS  52  -8.005  -5.161   6.324
  396    HD1  HIS  52           HD1      HIS  52 -10.179  -4.231   5.730
  397    HD2  HIS  52           HD2      HIS  52  -7.556  -1.314   7.054
  398    HE1  HIS  52           HE1      HIS  52 -11.311  -2.038   5.253
  399    HE2  HIS  52           HE2      HIS  52  -9.891  -0.400   6.494
  400    H    ASP  53           HN       ASP  53  -5.693  -5.795   9.698
  401    HA   ASP  53           HA       ASP  53  -4.978  -7.867  10.154
  402   1HB   ASP  53          HB2       ASP  53  -7.851  -8.593   9.638
  403   2HB   ASP  53          HB1       ASP  53  -6.650  -9.782  10.127
  404    H    LEU  54           HN       LEU  54  -4.922  -6.915   7.335
  405    HA   LEU  54           HA       LEU  54  -4.880  -9.455   5.942
  406   1HB   LEU  54          HB2       LEU  54  -4.410  -6.644   5.043
  407   2HB   LEU  54          HB1       LEU  54  -3.727  -7.947   4.103
  408    HG   LEU  54           HG       LEU  54  -6.028  -8.869   3.820
  409   1HD1  LEU  54          HD11      LEU  54  -7.108  -7.842   5.744
  410   2HD1  LEU  54          HD12      LEU  54  -7.941  -7.445   4.240
  411   3HD1  LEU  54          HD13      LEU  54  -6.882  -6.256   5.004
  412   1HD2  LEU  54          HD21      LEU  54  -6.702  -7.223   2.146
  413   2HD2  LEU  54          HD22      LEU  54  -4.973  -7.566   2.087
  414   3HD2  LEU  54          HD23      LEU  54  -5.552  -6.072   2.827
  415    H    VAL  55           HN       VAL  55  -3.364 -10.757   6.559
  416    HA   VAL  55           HA       VAL  55  -0.686  -9.835   7.114
  417    HB   VAL  55           HB       VAL  55  -1.721 -12.673   6.792
  418   1HG1  VAL  55          HG11      VAL  55   0.288 -13.323   8.045
  419   2HG1  VAL  55          HG12      VAL  55   0.822 -11.640   8.059
  420   3HG1  VAL  55          HG13      VAL  55   0.697 -12.513   6.533
  421   1HG2  VAL  55          HG21      VAL  55  -2.890 -11.543   8.603
  422   2HG2  VAL  55          HG22      VAL  55  -1.352 -11.037   9.301
  423   3HG2  VAL  55          HG23      VAL  55  -1.774 -12.749   9.251
  424    H    LEU  56           HN       LEU  56   0.040  -8.907   5.323
  425    HA   LEU  56           HA       LEU  56   0.148 -10.532   2.912
  426   1HB   LEU  56          HB2       LEU  56   0.958  -7.649   3.317
  427   2HB   LEU  56          HB1       LEU  56   1.028  -8.517   1.802
  428    HG   LEU  56           HG       LEU  56  -1.470  -7.766   3.315
  429   1HD1  LEU  56          HD11      LEU  56  -0.368  -6.843   0.667
  430   2HD1  LEU  56          HD12      LEU  56  -0.420  -5.907   2.162
  431   3HD1  LEU  56          HD13      LEU  56  -1.920  -6.376   1.361
  432   1HD2  LEU  56          HD21      LEU  56  -1.165  -9.267   0.715
  433   2HD2  LEU  56          HD22      LEU  56  -2.690  -8.711   1.413
  434   3HD2  LEU  56          HD23      LEU  56  -1.738  -9.943   2.240
  435    HA   PRO  57           HA       PRO  57   4.142 -11.728   4.483
  436   1HB   PRO  57          HB2       PRO  57   4.081 -13.352   2.007
  437   2HB   PRO  57          HB1       PRO  57   4.289 -13.874   3.684
  438   1HG   PRO  57          HG2       PRO  57   2.004 -14.378   2.439
  439   2HG   PRO  57          HG1       PRO  57   1.994 -13.796   4.121
  440   1HD   PRO  57          HD2       PRO  57   1.576 -12.228   1.611
  441   2HD   PRO  57          HD1       PRO  57   0.587 -12.269   3.093
  442    H    ILE  58           HN       ILE  58   6.292 -11.422   3.780
  443    HA   ILE  58           HA       ILE  58   6.650  -9.231   2.058
  444    HB   ILE  58           HB       ILE  58   8.599 -11.047   3.513
  445   1HG1  ILE  58          HG12      ILE  58   9.236  -8.910   4.642
  446   2HG1  ILE  58          HG11      ILE  58   7.955  -8.120   3.731
  447   1HG2  ILE  58          HG21      ILE  58  10.477  -9.662   2.823
  448   2HG2  ILE  58          HG22      ILE  58   9.421  -8.793   1.709
  449   3HG2  ILE  58          HG23      ILE  58   9.747 -10.508   1.458
  450   1HD1  ILE  58          HD11      ILE  58   7.606 -10.323   5.763
  451   2HD1  ILE  58          HD12      ILE  58   6.309  -9.535   4.867
  452   3HD1  ILE  58          HD13      ILE  58   7.274  -8.609   6.017
  453    H    ARG  59           HN       ARG  59   6.724 -12.588   1.577
  454    HA   ARG  59           HA       ARG  59   7.979 -12.604  -0.951
  455   1HB   ARG  59          HB2       ARG  59   6.714 -14.853  -1.321
  456   2HB   ARG  59          HB1       ARG  59   7.954 -14.762  -0.088
  457   1HG   ARG  59          HG2       ARG  59   5.103 -14.319   0.681
  458   2HG   ARG  59          HG1       ARG  59   5.671 -15.961   0.364
  459   1HD   ARG  59          HD2       ARG  59   6.978 -14.055   2.337
  460   2HD   ARG  59          HD1       ARG  59   5.796 -15.288   2.770
  461    HE   ARG  59           HE       ARG  59   7.436 -16.886   1.756
  462   1HH1  ARG  59          HH11      ARG  59   8.551 -13.894   3.371
  463   2HH1  ARG  59          HH12      ARG  59  10.074 -14.540   3.772
  464   1HH2  ARG  59          HH21      ARG  59   9.515 -17.765   2.437
  465   2HH2  ARG  59          HH22      ARG  59  10.583 -16.805   3.338
  466    H    GLU  60           HN       GLU  60   4.972 -11.421  -0.101
  467    HA   GLU  60           HA       GLU  60   4.016 -11.378  -2.904
  468   1HB   GLU  60          HB2       GLU  60   2.705 -10.360  -0.360
  469   2HB   GLU  60          HB1       GLU  60   1.957 -10.405  -1.940
  470   1HG   GLU  60          HG2       GLU  60   2.744 -12.766  -0.256
  471   2HG   GLU  60          HG1       GLU  60   1.111 -12.150  -0.502
  472    H    VAL  61           HN       VAL  61   4.703  -9.407  -0.110
  473    HA   VAL  61           HA       VAL  61   4.252  -6.909  -1.161
  474    HB   VAL  61           HB       VAL  61   6.104  -7.701   1.115
  475   1HG1  VAL  61          HG11      VAL  61   4.867  -5.020   0.510
  476   2HG1  VAL  61          HG12      VAL  61   6.581  -5.421   0.383
  477   3HG1  VAL  61          HG13      VAL  61   5.789  -5.426   1.956
  478   1HG2  VAL  61          HG21      VAL  61   3.220  -6.833   1.122
  479   2HG2  VAL  61          HG22      VAL  61   4.204  -7.147   2.551
  480   3HG2  VAL  61          HG23      VAL  61   3.827  -8.458   1.432
  481    H    ARG  62           HN       ARG  62   7.181  -8.837  -1.318
  482    HA   ARG  62           HA       ARG  62   8.930  -6.841  -2.093
  483   1HB   ARG  62          HB2       ARG  62   8.972  -9.789  -2.456
  484   2HB   ARG  62          HB1       ARG  62  10.211  -8.791  -3.206
  485   1HG   ARG  62          HG2       ARG  62  10.796  -7.866  -1.073
  486   2HG   ARG  62          HG1       ARG  62   9.514  -8.782  -0.304
  487   1HD   ARG  62          HD2       ARG  62  11.673  -9.905   0.022
  488   2HD   ARG  62          HD1       ARG  62  10.540 -10.894  -0.886
  489    HE   ARG  62           HE       ARG  62  11.940  -9.743  -2.849
  490   1HH1  ARG  62          HH11      ARG  62  12.964 -11.364   0.108
  491   2HH1  ARG  62          HH12      ARG  62  14.422 -11.974  -0.521
  492   1HH2  ARG  62          HH21      ARG  62  13.953 -10.556  -3.772
  493   2HH2  ARG  62          HH22      ARG  62  15.005 -11.460  -2.795
  494    H    GLN  63           HN       GLN  63   6.409  -8.190  -3.994
  495    HA   GLN  63           HA       GLN  63   7.825  -7.338  -6.399
  496   1HB   GLN  63          HB2       GLN  63   5.372  -9.096  -6.197
  497   2HB   GLN  63          HB1       GLN  63   6.039  -8.518  -7.716
  498   1HG   GLN  63          HG2       GLN  63   6.910 -10.661  -7.541
  499   2HG   GLN  63          HG1       GLN  63   8.207  -9.640  -6.931
  500   1HE2  GLN  63          HE21      GLN  63   5.310 -10.500  -5.195
  501   2HE2  GLN  63          HE22      GLN  63   6.095 -11.427  -3.976
  502    H    LEU  64           HN       LEU  64   5.950  -6.006  -4.234
  503    HA   LEU  64           HA       LEU  64   4.019  -4.722  -5.951
  504   1HB   LEU  64          HB2       LEU  64   4.797  -4.008  -3.119
  505   2HB   LEU  64          HB1       LEU  64   3.352  -3.489  -3.964
  506    HG   LEU  64           HG       LEU  64   4.022  -6.275  -3.095
  507   1HD1  LEU  64          HD11      LEU  64   1.916  -4.364  -2.106
  508   2HD1  LEU  64          HD12      LEU  64   3.367  -4.877  -1.245
  509   3HD1  LEU  64          HD13      LEU  64   2.092  -6.043  -1.595
  510   1HD2  LEU  64          HD21      LEU  64   1.757  -6.888  -3.844
  511   2HD2  LEU  64          HD22      LEU  64   2.779  -6.346  -5.177
  512   3HD2  LEU  64          HD23      LEU  64   1.554  -5.267  -4.508
  513    H    THR  65           HN       THR  65   4.617  -3.184  -7.314
  514    HA   THR  65           HA       THR  65   7.244  -2.113  -7.234
  515    HB   THR  65           HB       THR  65   6.481  -1.233  -9.465
  516    HG1  THR  65           HG1      THR  65   4.411  -2.432 -10.064
  517   1HG2  THR  65          HG21      THR  65   6.026  -4.122  -8.826
  518   2HG2  THR  65          HG22      THR  65   7.612  -3.401  -9.084
  519   3HG2  THR  65          HG23      THR  65   6.443  -3.492 -10.427
  520    H    LEU  66           HN       LEU  66   6.088  -1.048  -5.111
  521    HA   LEU  66           HA       LEU  66   5.818   0.830  -3.924
  522   1HB   LEU  66          HB2       LEU  66   7.832   1.491  -5.385
  523   2HB   LEU  66          HB1       LEU  66   6.705   2.425  -6.338
  524    HG   LEU  66           HG       LEU  66   7.979   3.828  -4.779
  525   1HD1  LEU  66          HD11      LEU  66   5.086   3.652  -4.035
  526   2HD1  LEU  66          HD12      LEU  66   5.770   4.559  -5.385
  527   3HD1  LEU  66          HD13      LEU  66   6.153   5.024  -3.721
  528   1HD2  LEU  66          HD21      LEU  66   6.652   2.221  -2.605
  529   2HD2  LEU  66          HD22      LEU  66   7.641   3.662  -2.363
  530   3HD2  LEU  66          HD23      LEU  66   8.365   2.193  -3.018
  531    H    ARG  67           HN       ARG  67   4.700   1.837  -7.179
  532    HA   ARG  67           HA       ARG  67   2.505   3.211  -5.939
  533   1HB   ARG  67          HB2       ARG  67   3.323   2.847  -8.783
  534   2HB   ARG  67          HB1       ARG  67   1.685   3.361  -8.426
  535   1HG   ARG  67          HG2       ARG  67   4.206   4.789  -7.599
  536   2HG   ARG  67          HG1       ARG  67   3.123   5.258  -8.911
  537   1HD   ARG  67          HD2       ARG  67   1.295   5.266  -7.065
  538   2HD   ARG  67          HD1       ARG  67   2.661   5.351  -5.954
  539    HE   ARG  67           HE       ARG  67   3.117   7.323  -7.786
  540   1HH1  ARG  67          HH11      ARG  67   0.623   6.678  -5.354
  541   2HH1  ARG  67          HH12      ARG  67   0.003   8.262  -5.383
  542   1HH2  ARG  67          HH21      ARG  67   2.208   9.436  -7.889
  543   2HH2  ARG  67          HH22      ARG  67   0.872   9.852  -6.914
  544    H    LYS  68           HN       LYS  68   3.024   0.099  -7.163
  545    HA   LYS  68           HA       LYS  68   0.372  -0.720  -7.577
  546   1HB   LYS  68          HB2       LYS  68   2.404  -2.051  -8.175
  547   2HB   LYS  68          HB1       LYS  68   2.616  -2.421  -6.470
  548   1HG   LYS  68          HG2       LYS  68   0.469  -3.554  -6.440
  549   2HG   LYS  68          HG1       LYS  68   0.230  -3.168  -8.143
  550   1HD   LYS  68          HD2       LYS  68   2.319  -4.423  -8.639
  551   2HD   LYS  68          HD1       LYS  68   2.347  -4.938  -6.946
  552   1HE   LYS  68          HE2       LYS  68   0.164  -5.945  -7.207
  553   2HE   LYS  68          HE1       LYS  68   0.098  -5.408  -8.886
  554   1HZ   LYS  68          HZ1       LYS  68   1.876  -7.463  -7.696
  555   2HZ   LYS  68          HZ2       LYS  68   2.199  -6.758  -9.185
  556   3HZ   LYS  68          HZ3       LYS  68   0.751  -7.631  -8.953
  557    H    LEU  69           HN       LEU  69   2.185  -0.191  -4.725
  558    HA   LEU  69           HA       LEU  69   0.676  -1.475  -2.741
  559   1HB   LEU  69          HB2       LEU  69   2.280   1.055  -2.637
  560   2HB   LEU  69          HB1       LEU  69   1.352   0.553  -1.247
  561    HG   LEU  69           HG       LEU  69   3.630  -0.061  -0.936
  562   1HD1  LEU  69          HD11      LEU  69   2.037  -1.584  -0.034
  563   2HD1  LEU  69          HD12      LEU  69   3.469  -2.457  -0.578
  564   3HD1  LEU  69          HD13      LEU  69   1.994  -2.493  -1.545
  565   1HD2  LEU  69          HD21      LEU  69   4.388  -0.137  -3.239
  566   2HD2  LEU  69          HD22      LEU  69   3.453  -1.607  -3.511
  567   3HD2  LEU  69          HD23      LEU  69   4.819  -1.623  -2.391
  568    H    GLN  70           HN       GLN  70  -0.256   1.217  -4.625
  569    HA   GLN  70           HA       GLN  70  -2.214   2.393  -2.915
  570   1HB   GLN  70          HB2       GLN  70  -2.111   2.329  -5.921
  571   2HB   GLN  70          HB1       GLN  70  -3.141   3.369  -4.928
  572   1HG   GLN  70          HG2       GLN  70  -1.243   4.542  -4.163
  573   2HG   GLN  70          HG1       GLN  70  -0.114   3.535  -5.079
  574   1HE2  GLN  70          HE21      GLN  70  -0.321   3.582  -7.379
  575   2HE2  GLN  70          HE22      GLN  70  -0.896   5.007  -8.161
  576    H    GLU  71           HN       GLU  71  -2.201  -0.235  -5.258
  577    HA   GLU  71           HA       GLU  71  -5.083  -0.619  -5.044
  578   1HB   GLU  71          HB2       GLU  71  -3.735  -0.790  -7.225
  579   2HB   GLU  71          HB1       GLU  71  -3.082  -2.288  -6.583
  580   1HG   GLU  71          HG2       GLU  71  -4.876  -2.774  -8.101
  581   2HG   GLU  71          HG1       GLU  71  -5.370  -3.194  -6.462
  582    H    MET  72           HN       MET  72  -2.542  -1.270  -3.234
  583    HA   MET  72           HA       MET  72  -3.554  -3.865  -2.247
  584   1HB   MET  72          HB2       MET  72  -0.716  -2.792  -2.169
  585   2HB   MET  72          HB1       MET  72  -1.248  -4.298  -1.440
  586   1HG   MET  72          HG2       MET  72  -1.271  -3.669  -4.386
  587   2HG   MET  72          HG1       MET  72  -0.056  -4.631  -3.551
  588   1HE   MET  72          HE1       MET  72  -2.157  -7.755  -2.413
  589   2HE   MET  72          HE2       MET  72  -1.870  -6.282  -1.485
  590   3HE   MET  72          HE3       MET  72  -0.564  -6.999  -2.427
  591    H    SER  73           HN       SER  73  -4.279  -1.067  -1.669
  592    HA   SER  73           HA       SER  73  -2.919  -0.292   0.667
  593   1HB   SER  73          HB2       SER  73  -4.625   1.571   0.613
  594   2HB   SER  73          HB1       SER  73  -3.570   1.411  -0.792
  595    HG   SER  73           HG       SER  73  -5.241   1.143  -1.949
  596    H    SER  74           HN       SER  74  -5.722  -2.102  -0.143
  597    HA   SER  74           HA       SER  74  -7.242  -3.295   0.976
  598   1HB   SER  74          HB2       SER  74  -5.559  -3.631   2.818
  599   2HB   SER  74          HB1       SER  74  -6.124  -2.145   3.568
  600    HG   SER  74           HG       SER  74  -7.793  -4.375   3.035
  601    H    LYS  75           HN       LYS  75  -7.060  -0.198   0.570
  602    HA   LYS  75           HA       LYS  75  -9.621   0.538   1.804
  603   1HB   LYS  75          HB2       LYS  75  -7.577   2.172   0.287
  604   2HB   LYS  75          HB1       LYS  75  -9.050   2.802   1.000
  605   1HG   LYS  75          HG2       LYS  75  -8.233   2.374   3.207
  606   2HG   LYS  75          HG1       LYS  75  -6.811   1.539   2.559
  607   1HD   LYS  75          HD2       LYS  75  -6.040   3.581   1.523
  608   2HD   LYS  75          HD1       LYS  75  -7.497   4.429   2.029
  609   1HE   LYS  75          HE2       LYS  75  -5.495   3.206   3.912
  610   2HE   LYS  75          HE1       LYS  75  -5.489   4.896   3.421
  611   1HZ   LYS  75          HZ1       LYS  75  -6.601   4.672   5.520
  612   2HZ   LYS  75          HZ2       LYS  75  -7.702   3.540   4.932
  613   3HZ   LYS  75          HZ3       LYS  75  -7.734   5.113   4.382
  614    H    ALA  76           HN       ALA  76 -11.408   0.846   0.456
  615    HA   ALA  76           HA       ALA  76 -11.181  -0.041  -2.244
  616   1HB   ALA  76          HB1       ALA  76 -13.572   0.506  -2.389
  617   2HB   ALA  76          HB2       ALA  76 -13.489   1.281  -0.804
  618   3HB   ALA  76          HB3       ALA  76 -13.225  -0.457  -0.951
  619    H    GLY  77           HN       GLY  77 -10.675   1.157  -3.918
  620   1HA   GLY  77          HA2       GLY  77 -10.187   3.975  -3.607
  621   2HA   GLY  77          HA1       GLY  77  -9.892   3.006  -5.042
  622    H    SER  78           HN       SER  78 -12.846   3.519  -3.219
  623    HA   SER  78           HA       SER  78 -14.306   4.163  -5.609
  624   1HB   SER  78          HB2       SER  78 -15.179   4.068  -2.713
  625   2HB   SER  78          HB1       SER  78 -16.235   4.096  -4.128
  626    HG   SER  78           HG       SER  78 -16.109   2.053  -4.023
  627    H    ASP  79           HN       ASP  79 -12.723   5.945  -5.743
  628    HA   ASP  79           HA       ASP  79 -13.188   8.259  -4.062
  629   1HB   ASP  79          HB2       ASP  79 -10.917   7.635  -4.882
  630   2HB   ASP  79          HB1       ASP  79 -11.460   7.971  -6.523
  631    H    THR  80           HN       THR  80 -13.049   7.728  -7.504
  632    HA   THR  80           HA       THR  80 -13.997   8.685  -9.255
  633    HB   THR  80           HB       THR  80 -16.537   7.948  -7.796
  634    HG1  THR  80           HG1      THR  80 -15.990   5.907  -8.128
  635   1HG2  THR  80          HG21      THR  80 -17.312   7.377 -10.070
  636   2HG2  THR  80          HG22      THR  80 -15.760   7.898 -10.731
  637   3HG2  THR  80          HG23      THR  80 -16.841   9.077  -9.984
  638    H    GLU  81           HN       GLU  81 -13.234  10.832  -8.772
  639    HA   GLU  81           HA       GLU  81 -15.142  12.720  -7.742
  640   1HB   GLU  81          HB2       GLU  81 -13.507  14.454  -8.345
  641   2HB   GLU  81          HB1       GLU  81 -12.760  13.169  -7.411
  642   1HG   GLU  81          HG2       GLU  81 -11.711  12.269  -9.352
  643   2HG   GLU  81          HG1       GLU  81 -12.618  13.351 -10.406
  644    H    LEU  82           HN       LEU  82 -14.413  11.300 -10.779
  645    HA   LEU  82           HA       LEU  82 -15.557  13.349 -12.380
  646   1HB   LEU  82          HB2       LEU  82 -14.804  10.493 -12.933
  647   2HB   LEU  82          HB1       LEU  82 -15.750  11.397 -14.092
  648    HG   LEU  82           HG       LEU  82 -13.880  13.028 -14.287
  649   1HD1  LEU  82          HD11      LEU  82 -11.675  12.445 -13.452
  650   2HD1  LEU  82          HD12      LEU  82 -12.367  11.086 -12.563
  651   3HD1  LEU  82          HD13      LEU  82 -12.813  12.738 -12.137
  652   1HD2  LEU  82          HD21      LEU  82 -14.116  11.224 -15.877
  653   2HD2  LEU  82          HD22      LEU  82 -13.171  10.158 -14.837
  654   3HD2  LEU  82          HD23      LEU  82 -12.413  11.566 -15.576
  655    H    ALA  83           HN       ALA  83 -17.513  13.900 -12.105
  656    HA   ALA  83           HA       ALA  83 -19.617  11.865 -11.808
  657   1HB   ALA  83          HB1       ALA  83 -21.039  13.700 -11.007
  658   2HB   ALA  83          HB2       ALA  83 -19.717  14.839 -11.259
  659   3HB   ALA  83          HB3       ALA  83 -19.569  13.573 -10.040
  660    H    ALA  84           HN       ALA  84 -18.250  14.269 -13.825
  661    HA   ALA  84           HA       ALA  84 -20.224  13.656 -15.881
  662   1HB   ALA  84          HB1       ALA  84 -20.211  16.003 -16.604
  663   2HB   ALA  84          HB2       ALA  84 -19.177  16.420 -15.237
  664   3HB   ALA  84          HB3       ALA  84 -20.824  15.848 -14.956
  665    HA   PRO  85           HA       PRO  85 -16.337  12.830 -17.852
  666   1HB   PRO  85          HB2       PRO  85 -17.844  12.450 -20.325
  667   2HB   PRO  85          HB1       PRO  85 -16.976  11.254 -19.359
  668   1HG   PRO  85          HG2       PRO  85 -19.682  11.310 -19.541
  669   2HG   PRO  85          HG1       PRO  85 -18.826  10.739 -18.095
  670   1HD   PRO  85          HD2       PRO  85 -20.127  13.384 -18.612
  671   2HD   PRO  85          HD1       PRO  85 -20.136  12.392 -17.137
  672    H    LYS  86           HN       LYS  86 -14.905  14.123 -18.807
  673    HA   LYS  86           HA       LYS  86 -15.920  16.415 -20.292
  674   1HB   LYS  86          HB2       LYS  86 -13.205  15.952 -19.052
  675   2HB   LYS  86          HB1       LYS  86 -13.648  17.380 -19.983
  676   1HG   LYS  86          HG2       LYS  86 -15.446  17.823 -18.336
  677   2HG   LYS  86          HG1       LYS  86 -14.837  16.474 -17.379
  678   1HD   LYS  86          HD2       LYS  86 -12.700  17.585 -17.126
  679   2HD   LYS  86          HD1       LYS  86 -13.247  18.913 -18.154
  680   1HE   LYS  86          HE2       LYS  86 -15.057  19.355 -16.524
  681   2HE   LYS  86          HE1       LYS  86 -14.375  18.113 -15.479
  682   1HZ   LYS  86          HZ1       LYS  86 -13.720  20.341 -14.864
  683   2HZ   LYS  86          HZ2       LYS  86 -12.962  20.567 -16.365
  684   3HZ   LYS  86          HZ3       LYS  86 -12.367  19.419 -15.259
  685    H    SER  87           HN       SER  87 -14.747  13.377 -20.879
  686    HA   SER  87           HA       SER  87 -13.179  13.656 -23.159
  687   1HB   SER  87          HB2       SER  87 -15.335  11.585 -22.693
  688   2HB   SER  87          HB1       SER  87 -13.787  11.380 -23.516
  689    HG   SER  87           HG       SER  87 -13.176  10.675 -21.651
  690    H    LYS  88           HN       LYS  88 -16.625  13.443 -22.596
  691    HA   LYS  88           HA       LYS  88 -17.366  15.296 -24.566
  692   1HB   LYS  88          HB2       LYS  88 -17.244  13.284 -26.013
  693   2HB   LYS  88          HB1       LYS  88 -18.174  12.370 -24.833
  694   1HG   LYS  88          HG2       LYS  88 -20.029  13.999 -25.168
  695   2HG   LYS  88          HG1       LYS  88 -19.100  14.683 -26.497
  696   1HD   LYS  88          HD2       LYS  88 -19.199  12.605 -27.687
  697   2HD   LYS  88          HD1       LYS  88 -19.977  11.814 -26.306
  698   1HE   LYS  88          HE2       LYS  88 -21.103  14.150 -27.830
  699   2HE   LYS  88          HE1       LYS  88 -21.579  12.467 -28.058
  700   1HZ   LYS  88          HZ1       LYS  88 -22.472  12.392 -25.867
  701   2HZ   LYS  88          HZ2       LYS  88 -23.072  13.782 -26.613
  702   3HZ   LYS  88          HZ3       LYS  88 -21.895  13.919 -25.446
  703    H    ASN  89           HN       ASN  89 -19.567  15.892 -24.000
  704    HA   ASN  89           HA       ASN  89 -20.640  14.406 -21.736
  705   1HB   ASN  89          HB2       ASN  89 -19.445  16.557 -21.052
  706   2HB   ASN  89          HB1       ASN  89 -20.697  17.415 -21.941
  707   1HD2  ASN  89          HD21      ASN  89 -19.913  15.612 -19.171
  708   2HD2  ASN  89          HD22      ASN  89 -21.376  15.907 -18.285
  Start of MODEL    4
    1   1H    GLY   1          HT1       GLY   1  -9.385  14.616  10.620
    2   2H    GLY   1          HT2       GLY   1  -9.081  14.451   8.946
    3   3H    GLY   1          HT3       GLY   1  -7.977  15.235   9.942
    4   1HA   GLY   1          HA1       GLY   1  -8.705  12.375  10.101
    5   2HA   GLY   1          HA2       GLY   1  -7.251  13.011   9.344
    6    H    ASP   2           HN       ASP   2  -8.940  12.452  12.321
    7    HA   ASP   2           HA       ASP   2  -6.523  13.184  13.826
    8   1HB   ASP   2          HB2       ASP   2  -8.548  14.340  14.576
    9   2HB   ASP   2          HB1       ASP   2  -9.373  12.800  14.777
   10    H    GLY   3           HN       GLY   3  -9.014  10.732  13.416
   11   1HA   GLY   3          HA2       GLY   3  -7.580   8.846  15.091
   12   2HA   GLY   3          HA1       GLY   3  -9.116   8.567  14.277
   13    H    GLU   4           HN       GLU   4  -5.832   9.369  13.354
   14    HA   GLU   4           HA       GLU   4  -6.025   7.804  10.921
   15   1HB   GLU   4          HB2       GLU   4  -3.692   9.297  12.116
   16   2HB   GLU   4          HB1       GLU   4  -3.777   8.639  10.492
   17   1HG   GLU   4          HG2       GLU   4  -5.556  10.807  11.564
   18   2HG   GLU   4          HG1       GLU   4  -4.106  11.075  10.602
   19    H    ALA   5           HN       ALA   5  -5.688   5.682  11.032
   20    HA   ALA   5           HA       ALA   5  -3.567   4.716  12.815
   21   1HB   ALA   5          HB1       ALA   5  -6.088   3.263  11.995
   22   2HB   ALA   5          HB2       ALA   5  -5.769   3.950  13.590
   23   3HB   ALA   5          HB3       ALA   5  -4.797   2.603  12.999
   24    H    GLN   6           HN       GLN   6  -5.426   3.987   9.899
   25    HA   GLN   6           HA       GLN   6  -3.237   2.472   8.811
   26   1HB   GLN   6          HB2       GLN   6  -5.483   1.688   8.358
   27   2HB   GLN   6          HB1       GLN   6  -5.933   3.237   7.673
   28   1HG   GLN   6          HG2       GLN   6  -4.526   2.886   5.775
   29   2HG   GLN   6          HG1       GLN   6  -3.819   1.444   6.501
   30   1HE2  GLN   6          HE21      GLN   6  -4.938  -0.459   6.440
   31   2HE2  GLN   6          HE22      GLN   6  -6.382  -0.680   5.518
   32    H    ARG   7           HN       ARG   7  -1.638   3.367   7.846
   33    HA   ARG   7           HA       ARG   7  -1.831   6.074   6.778
   34   1HB   ARG   7          HB2       ARG   7   0.041   5.327   8.314
   35   2HB   ARG   7          HB1       ARG   7   0.548   4.218   7.058
   36   1HG   ARG   7          HG2       ARG   7   1.012   6.122   5.584
   37   2HG   ARG   7          HG1       ARG   7   0.518   7.225   6.877
   38   1HD   ARG   7          HD2       ARG   7   2.266   6.195   8.326
   39   2HD   ARG   7          HD1       ARG   7   2.811   5.265   6.934
   40    HE   ARG   7           HE       ARG   7   2.704   8.108   6.530
   41   1HH1  ARG   7          HH11      ARG   7   4.851   5.316   7.368
   42   2HH1  ARG   7          HH12      ARG   7   6.232   6.274   7.373
   43   1HH2  ARG   7          HH21      ARG   7   4.703   9.352   6.505
   44   2HH2  ARG   7          HH22      ARG   7   6.179   8.573   6.852
   45    H    ASP   8           HN       ASP   8  -1.684   6.425   4.562
   46    HA   ASP   8           HA       ASP   8  -2.317   4.289   2.786
   47   1HB   ASP   8          HB2       ASP   8  -2.939   6.579   2.193
   48   2HB   ASP   8          HB1       ASP   8  -1.244   7.057   2.185
   49    H    LEU   9           HN       LEU   9  -1.039   3.109   1.452
   50    HA   LEU   9           HA       LEU   9   1.520   2.649   2.479
   51   1HB   LEU   9          HB2       LEU   9   0.100   1.454   0.142
   52   2HB   LEU   9          HB1       LEU   9   1.716   0.962   0.604
   53    HG   LEU   9           HG       LEU   9  -0.755   0.749   2.324
   54   1HD1  LEU   9          HD11      LEU   9  -0.448  -1.641   2.083
   55   2HD1  LEU   9          HD12      LEU   9   0.918  -1.373   0.993
   56   3HD1  LEU   9          HD13      LEU   9  -0.709  -0.876   0.517
   57   1HD2  LEU   9          HD21      LEU   9   1.228   1.215   3.663
   58   2HD2  LEU   9          HD22      LEU   9   2.085  -0.108   2.872
   59   3HD2  LEU   9          HD23      LEU   9   0.689  -0.449   3.893
   60    H    VAL  10           HN       VAL  10   0.578   4.643  -0.214
   61    HA   VAL  10           HA       VAL  10   3.353   4.725  -1.022
   62    HB   VAL  10           HB       VAL  10   0.897   6.079  -2.199
   63   1HG1  VAL  10          HG11      VAL  10   2.354   6.901  -3.998
   64   2HG1  VAL  10          HG12      VAL  10   3.768   6.250  -3.170
   65   3HG1  VAL  10          HG13      VAL  10   2.864   7.584  -2.453
   66   1HG2  VAL  10          HG21      VAL  10   1.141   3.728  -2.588
   67   2HG2  VAL  10          HG22      VAL  10   2.780   3.975  -3.207
   68   3HG2  VAL  10          HG23      VAL  10   1.390   4.633  -4.081
   69    H    LYS  11           HN       LYS  11   1.038   6.577   0.761
   70    HA   LYS  11           HA       LYS  11   2.887   8.745   1.101
   71   1HB   LYS  11          HB2       LYS  11   0.356   8.072   2.604
   72   2HB   LYS  11          HB1       LYS  11   1.493   9.288   3.152
   73   1HG   LYS  11          HG2       LYS  11  -0.232  10.480   2.069
   74   2HG   LYS  11          HG1       LYS  11   1.113  10.476   0.945
   75   1HD   LYS  11          HD2       LYS  11  -1.040   8.408   0.730
   76   2HD   LYS  11          HD1       LYS  11  -1.320  10.037   0.134
   77   1HE   LYS  11          HE2       LYS  11   0.521   9.831  -1.403
   78   2HE   LYS  11          HE1       LYS  11   0.957   8.261  -0.716
   79   1HZ   LYS  11          HZ1       LYS  11  -1.035   7.322  -1.498
   80   2HZ   LYS  11          HZ2       LYS  11  -0.392   8.189  -2.837
   81   3HZ   LYS  11          HZ3       LYS  11  -1.668   8.820  -1.934
   82    H    ALA  12           HN       ALA  12   2.777   5.667   2.253
   83    HA   ALA  12           HA       ALA  12   4.390   6.260   4.617
   84   1HB   ALA  12          HB1       ALA  12   4.102   3.913   5.212
   85   2HB   ALA  12          HB2       ALA  12   3.248   3.619   3.697
   86   3HB   ALA  12          HB3       ALA  12   2.540   4.677   4.918
   87    H    VAL  13           HN       VAL  13   4.496   3.683   2.165
   88    HA   VAL  13           HA       VAL  13   7.201   3.098   2.578
   89    HB   VAL  13           HB       VAL  13   5.412   2.416   0.227
   90   1HG1  VAL  13          HG11      VAL  13   7.028   0.636  -0.267
   91   2HG1  VAL  13          HG12      VAL  13   8.100   1.275   0.984
   92   3HG1  VAL  13          HG13      VAL  13   7.718   2.248  -0.441
   93   1HG2  VAL  13          HG21      VAL  13   5.212   0.229   1.328
   94   2HG2  VAL  13          HG22      VAL  13   4.615   1.533   2.356
   95   3HG2  VAL  13          HG23      VAL  13   6.195   0.820   2.669
   96    H    ALA  14           HN       ALA  14   5.628   4.931  -0.023
   97    HA   ALA  14           HA       ALA  14   8.064   5.459  -1.346
   98   1HB   ALA  14          HB1       ALA  14   6.816   7.133  -2.665
   99   2HB   ALA  14          HB2       ALA  14   5.483   7.023  -1.509
  100   3HB   ALA  14          HB3       ALA  14   5.885   5.635  -2.505
  101    H    HIS  15           HN       HIS  15   6.415   6.991   1.298
  102    HA   HIS  15           HA       HIS  15   7.954   9.416   1.186
  103   1HB   HIS  15          HB2       HIS  15   5.687   9.195   2.307
  104   2HB   HIS  15          HB1       HIS  15   6.498   8.326   3.601
  105    HD1  HIS  15           HD1      HIS  15   7.527   9.767   5.461
  106    HD2  HIS  15           HD2      HIS  15   6.523  11.951   2.061
  107    HE1  HIS  15           HE1      HIS  15   7.775  12.160   6.091
  108    HE2  HIS  15           HE2      HIS  15   7.012  13.465   4.067
  109    H    ILE  16           HN       ILE  16   8.331   6.287   2.649
  110    HA   ILE  16           HA       ILE  16  10.486   6.858   4.392
  111    HB   ILE  16           HB       ILE  16   9.774   4.269   2.942
  112   1HG1  ILE  16          HG12      ILE  16   8.006   4.996   4.431
  113   2HG1  ILE  16          HG11      ILE  16   8.786   3.564   5.087
  114   1HG2  ILE  16          HG21      ILE  16  11.675   4.609   5.256
  115   2HG2  ILE  16          HG22      ILE  16  12.093   4.104   3.615
  116   3HG2  ILE  16          HG23      ILE  16  11.090   3.069   4.634
  117   1HD1  ILE  16          HD11      ILE  16  10.039   4.977   6.646
  118   2HD1  ILE  16          HD12      ILE  16   8.298   5.172   6.836
  119   3HD1  ILE  16          HD13      ILE  16   9.237   6.405   5.991
  120    H    LEU  17           HN       LEU  17  10.249   6.191   1.001
  121    HA   LEU  17           HA       LEU  17  13.107   6.151   0.521
  122   1HB   LEU  17          HB2       LEU  17  10.836   6.436  -1.453
  123   2HB   LEU  17          HB1       LEU  17  12.497   6.034  -1.832
  124    HG   LEU  17           HG       LEU  17  10.571   4.298  -0.296
  125   1HD1  LEU  17          HD11      LEU  17  11.650   4.062  -3.095
  126   2HD1  LEU  17          HD12      LEU  17   9.993   4.447  -2.636
  127   3HD1  LEU  17          HD13      LEU  17  10.663   2.856  -2.271
  128   1HD2  LEU  17          HD21      LEU  17  12.303   2.572  -0.491
  129   2HD2  LEU  17          HD22      LEU  17  12.860   3.960   0.445
  130   3HD2  LEU  17          HD23      LEU  17  13.390   3.755  -1.225
  131    H    GLY  18           HN       GLY  18  10.440   8.363   0.226
  132   1HA   GLY  18          HA2       GLY  18  10.821  10.735   0.636
  133   2HA   GLY  18          HA1       GLY  18  12.324  10.578  -0.269
  134    H    ILE  19           HN       ILE  19   9.262   9.131  -1.198
  135    HA   ILE  19           HA       ILE  19   8.978  11.050  -3.357
  136    HB   ILE  19           HB       ILE  19   8.130   8.973  -4.642
  137   1HG1  ILE  19          HG12      ILE  19  10.283   7.712  -2.938
  138   2HG1  ILE  19          HG11      ILE  19   8.569   7.321  -2.924
  139   1HG2  ILE  19          HG21      ILE  19  10.350   8.820  -5.777
  140   2HG2  ILE  19          HG22      ILE  19  11.047   9.740  -4.439
  141   3HG2  ILE  19          HG23      ILE  19   9.823  10.477  -5.481
  142   1HD1  ILE  19          HD11      ILE  19  10.457   6.899  -5.233
  143   2HD1  ILE  19          HD12      ILE  19   8.742   6.489  -5.215
  144   3HD1  ILE  19          HD13      ILE  19   9.861   5.655  -4.137
  145    H    ARG  20           HN       ARG  20   6.938  10.618  -4.550
  146    HA   ARG  20           HA       ARG  20   4.724   9.265  -3.441
  147   1HB   ARG  20          HB2       ARG  20   4.869  11.141  -1.787
  148   2HB   ARG  20          HB1       ARG  20   4.673  12.274  -3.116
  149   1HG   ARG  20          HG2       ARG  20   2.482  11.215  -3.615
  150   2HG   ARG  20          HG1       ARG  20   2.684  10.236  -2.164
  151   1HD   ARG  20          HD2       ARG  20   2.598  13.241  -2.283
  152   2HD   ARG  20          HD1       ARG  20   1.294  12.189  -1.744
  153    HE   ARG  20           HE       ARG  20   3.664  11.734  -0.246
  154   1HH1  ARG  20          HH11      ARG  20   0.985  14.026  -0.599
  155   2HH1  ARG  20          HH12      ARG  20   1.078  14.605   1.003
  156   1HH2  ARG  20          HH21      ARG  20   3.756  12.482   1.963
  157   2HH2  ARG  20          HH22      ARG  20   2.714  13.700   2.497
  158    H    ASP  21           HN       ASP  21   5.858  12.066  -5.230
  159    HA   ASP  21           HA       ASP  21   3.714  12.331  -7.005
  160   1HB   ASP  21          HB2       ASP  21   5.106  13.840  -8.255
  161   2HB   ASP  21          HB1       ASP  21   5.481  14.071  -6.551
  162    H    LEU  22           HN       LEU  22   6.820  10.699  -7.480
  163    HA   LEU  22           HA       LEU  22   7.472   9.004  -8.856
  164   1HB   LEU  22          HB2       LEU  22   4.524   8.504  -8.685
  165   2HB   LEU  22          HB1       LEU  22   5.483   7.573  -9.808
  166    HG   LEU  22           HG       LEU  22   4.997   6.436  -7.691
  167   1HD1  LEU  22          HD11      LEU  22   7.275   5.606  -7.293
  168   2HD1  LEU  22          HD12      LEU  22   7.920   7.024  -8.112
  169   3HD1  LEU  22          HD13      LEU  22   6.981   5.839  -9.021
  170   1HD2  LEU  22          HD21      LEU  22   6.804   8.499  -6.448
  171   2HD2  LEU  22          HD22      LEU  22   6.221   7.040  -5.649
  172   3HD2  LEU  22          HD23      LEU  22   5.081   8.295  -6.141
  173    H    ALA  23           HN       ALA  23   6.918  11.710 -10.001
  174    HA   ALA  23           HA       ALA  23   5.712  11.256 -12.543
  175   1HB   ALA  23          HB1       ALA  23   6.277  13.555 -13.054
  176   2HB   ALA  23          HB2       ALA  23   7.333  13.625 -11.641
  177   3HB   ALA  23          HB3       ALA  23   5.590  13.442 -11.435
  178    H    GLY  24           HN       GLY  24   8.737  10.714 -11.375
  179   1HA   GLY  24          HA2       GLY  24   9.584   9.963 -14.069
  180   2HA   GLY  24          HA1       GLY  24  10.633  11.093 -13.213
  181    H    ILE  25           HN       ILE  25   9.030   8.824 -11.287
  182    HA   ILE  25           HA       ILE  25  11.618   7.568 -10.855
  183    HB   ILE  25           HB       ILE  25   9.184   7.654  -9.030
  184   1HG1  ILE  25          HG12      ILE  25  10.812   8.850  -7.450
  185   2HG1  ILE  25          HG11      ILE  25  11.873   9.024  -8.837
  186   1HG2  ILE  25          HG21      ILE  25  10.557   6.544  -7.318
  187   2HG2  ILE  25          HG22      ILE  25  11.854   6.363  -8.500
  188   3HG2  ILE  25          HG23      ILE  25  10.318   5.530  -8.744
  189   1HD1  ILE  25          HD11      ILE  25  10.140  10.348  -9.968
  190   2HD1  ILE  25          HD12      ILE  25  10.621  11.059  -8.429
  191   3HD1  ILE  25          HD13      ILE  25   9.100  10.175  -8.552
  192    H    ASN  26           HN       ASN  26  11.862   5.404 -11.022
  193    HA   ASN  26           HA       ASN  26  10.310   4.058 -12.905
  194   1HB   ASN  26          HB2       ASN  26  12.411   3.072 -11.002
  195   2HB   ASN  26          HB1       ASN  26  11.598   2.002 -12.137
  196   1HD2  ASN  26          HD21      ASN  26  12.125   2.084 -14.281
  197   2HD2  ASN  26          HD22      ASN  26  13.423   3.042 -14.886
  198    H    LEU  27           HN       LEU  27   8.582   2.966 -12.857
  199    HA   LEU  27           HA       LEU  27   7.367   2.091 -10.322
  200   1HB   LEU  27          HB2       LEU  27   6.247   2.343 -13.119
  201   2HB   LEU  27          HB1       LEU  27   5.334   1.833 -11.714
  202    HG   LEU  27           HG       LEU  27   6.582   4.563 -12.038
  203   1HD1  LEU  27          HD11      LEU  27   4.310   5.334 -12.425
  204   2HD1  LEU  27          HD12      LEU  27   3.724   3.675 -12.345
  205   3HD1  LEU  27          HD13      LEU  27   4.792   4.169 -13.660
  206   1HD2  LEU  27          HD21      LEU  27   4.615   3.475 -10.027
  207   2HD2  LEU  27          HD22      LEU  27   5.183   5.138 -10.123
  208   3HD2  LEU  27          HD23      LEU  27   6.310   3.846  -9.713
  209    H    ASP  28           HN       ASP  28   9.440   1.010 -12.391
  210    HA   ASP  28           HA       ASP  28   8.349  -1.697 -12.693
  211   1HB   ASP  28          HB2       ASP  28  10.199  -2.031 -14.361
  212   2HB   ASP  28          HB1       ASP  28   9.015  -0.819 -14.820
  213    H    SER  29           HN       SER  29   9.831  -0.186 -10.444
  214    HA   SER  29           HA       SER  29  11.995  -2.075  -9.967
  215   1HB   SER  29          HB2       SER  29  11.123   0.316  -8.337
  216   2HB   SER  29          HB1       SER  29  12.657  -0.549  -8.235
  217    HG   SER  29           HG       SER  29  12.960   0.118 -10.489
  218    H    SER  30           HN       SER  30  11.738  -3.646  -8.395
  219    HA   SER  30           HA       SER  30   9.106  -4.059  -7.348
  220   1HB   SER  30          HB2       SER  30  11.726  -5.485  -6.876
  221   2HB   SER  30          HB1       SER  30  10.146  -6.092  -6.403
  222    HG   SER  30           HG       SER  30  11.372  -5.933  -8.899
  223    H    LEU  31           HN       LEU  31   8.785  -4.290  -5.000
  224    HA   LEU  31           HA       LEU  31   9.815  -2.110  -3.527
  225   1HB   LEU  31          HB2       LEU  31   7.600  -3.290  -3.189
  226   2HB   LEU  31          HB1       LEU  31   8.479  -4.614  -2.461
  227    HG   LEU  31           HG       LEU  31   9.194  -3.120  -0.622
  228   1HD1  LEU  31          HD11      LEU  31   8.183  -0.924  -0.436
  229   2HD1  LEU  31          HD12      LEU  31   7.404  -1.164  -2.003
  230   3HD1  LEU  31          HD13      LEU  31   9.165  -1.036  -1.905
  231   1HD2  LEU  31          HD21      LEU  31   7.024  -2.857   0.412
  232   2HD2  LEU  31          HD22      LEU  31   7.139  -4.405  -0.429
  233   3HD2  LEU  31          HD23      LEU  31   6.243  -3.072  -1.152
  234    H    ALA  32           HN       ALA  32  10.786  -5.386  -3.963
  235    HA   ALA  32           HA       ALA  32  12.597  -5.547  -1.833
  236   1HB   ALA  32          HB1       ALA  32  12.658  -7.023  -4.463
  237   2HB   ALA  32          HB2       ALA  32  11.823  -7.544  -2.997
  238   3HB   ALA  32          HB3       ALA  32  13.582  -7.457  -3.026
  239    H    ASP  33           HN       ASP  33  12.829  -4.214  -5.076
  240    HA   ASP  33           HA       ASP  33  15.663  -3.974  -5.150
  241   1HB   ASP  33          HB2       ASP  33  13.546  -2.439  -6.687
  242   2HB   ASP  33          HB1       ASP  33  15.270  -2.267  -6.958
  243    H    LEU  34           HN       LEU  34  13.068  -2.170  -3.894
  244    HA   LEU  34           HA       LEU  34  14.400   0.316  -3.518
  245   1HB   LEU  34          HB2       LEU  34  12.035  -0.753  -1.993
  246   2HB   LEU  34          HB1       LEU  34  12.469   0.932  -2.242
  247    HG   LEU  34           HG       LEU  34  11.533  -0.979  -4.374
  248   1HD1  LEU  34          HD11      LEU  34  10.134   1.317  -3.065
  249   2HD1  LEU  34          HD12      LEU  34   9.798  -0.416  -2.905
  250   3HD1  LEU  34          HD13      LEU  34   9.550   0.386  -4.457
  251   1HD2  LEU  34          HD21      LEU  34  12.139   1.960  -4.554
  252   2HD2  LEU  34          HD22      LEU  34  11.397   0.944  -5.804
  253   3HD2  LEU  34          HD23      LEU  34  13.061   0.636  -5.295
  254    H    GLY  35           HN       GLY  35  14.117  -2.635  -1.722
  255   1HA   GLY  35          HA2       GLY  35  16.136  -3.004  -0.306
  256   2HA   GLY  35          HA1       GLY  35  15.765  -1.442   0.402
  257    H    LEU  36           HN       LEU  36  13.086  -3.532  -0.326
  258    HA   LEU  36           HA       LEU  36  12.457  -3.648   2.391
  259   1HB   LEU  36          HB2       LEU  36  10.538  -3.699   1.305
  260   2HB   LEU  36          HB1       LEU  36  11.092  -4.611  -0.052
  261    HG   LEU  36           HG       LEU  36  10.837  -6.703   1.310
  262   1HD1  LEU  36          HD11      LEU  36  11.168  -5.784   3.532
  263   2HD1  LEU  36          HD12      LEU  36   9.633  -6.648   3.412
  264   3HD1  LEU  36          HD13      LEU  36   9.657  -4.883   3.392
  265   1HD2  LEU  36          HD21      LEU  36   9.046  -5.958  -0.111
  266   2HD2  LEU  36          HD22      LEU  36   8.417  -4.951   1.191
  267   3HD2  LEU  36          HD23      LEU  36   8.410  -6.710   1.356
  268    H    ASP  37           HN       ASP  37  13.456  -4.553   3.773
  269    HA   ASP  37           HA       ASP  37  13.589  -7.444   3.838
  270   1HB   ASP  37          HB2       ASP  37  15.858  -6.928   3.141
  271   2HB   ASP  37          HB1       ASP  37  16.005  -5.705   4.401
  272    H    SER  38           HN       SER  38  13.864  -4.323   5.497
  273    HA   SER  38           HA       SER  38  12.952  -5.733   7.879
  274   1HB   SER  38          HB2       SER  38  14.597  -3.201   7.812
  275   2HB   SER  38          HB1       SER  38  14.087  -4.084   9.252
  276    HG   SER  38           HG       SER  38  15.398  -5.618   7.389
  277    H    LEU  39           HN       LEU  39  12.991  -2.178   7.362
  278    HA   LEU  39           HA       LEU  39  10.493  -1.976   8.690
  279   1HB   LEU  39          HB2       LEU  39  12.163  -0.223   8.839
  280   2HB   LEU  39          HB1       LEU  39  12.000   0.104   7.123
  281    HG   LEU  39           HG       LEU  39   9.583   0.658   7.580
  282   1HD1  LEU  39          HD11      LEU  39   9.310  -0.397   9.715
  283   2HD1  LEU  39          HD12      LEU  39   8.988   1.332   9.853
  284   3HD1  LEU  39          HD13      LEU  39  10.514   0.670  10.436
  285   1HD2  LEU  39          HD21      LEU  39  11.709   2.382   8.827
  286   2HD2  LEU  39          HD22      LEU  39  10.079   2.903   8.367
  287   3HD2  LEU  39          HD23      LEU  39  11.214   2.352   7.129
  288    H    MET  40           HN       MET  40  11.367  -2.095   5.336
  289    HA   MET  40           HA       MET  40   8.944  -0.943   4.326
  290   1HB   MET  40          HB2       MET  40  11.004  -2.617   2.899
  291   2HB   MET  40          HB1       MET  40   9.726  -1.663   2.151
  292   1HG   MET  40          HG2       MET  40  10.682   0.377   3.022
  293   2HG   MET  40          HG1       MET  40  11.943  -0.545   3.836
  294   1HE   MET  40          HE1       MET  40  13.985   1.241   1.097
  295   2HE   MET  40          HE2       MET  40  13.853   0.843   2.809
  296   3HE   MET  40          HE3       MET  40  12.646   1.884   2.051
  297    H    GLY  41           HN       GLY  41   9.334  -3.716   5.889
  298   1HA   GLY  41          HA2       GLY  41   6.980  -4.866   4.548
  299   2HA   GLY  41          HA1       GLY  41   8.253  -5.869   5.241
  300    H    VAL  42           HN       VAL  42   8.702  -4.229   7.551
  301    HA   VAL  42           HA       VAL  42   6.735  -5.381   9.228
  302    HB   VAL  42           HB       VAL  42   8.862  -3.322   9.917
  303   1HG1  VAL  42          HG11      VAL  42   7.197  -5.061  11.737
  304   2HG1  VAL  42          HG12      VAL  42   7.050  -3.314  11.558
  305   3HG1  VAL  42          HG13      VAL  42   8.517  -4.009  12.248
  306   1HG2  VAL  42          HG21      VAL  42   9.805  -5.416   9.104
  307   2HG2  VAL  42          HG22      VAL  42   8.825  -6.319  10.258
  308   3HG2  VAL  42          HG23      VAL  42  10.093  -5.239  10.835
  309    H    GLU  43           HN       GLU  43   7.281  -1.974   8.169
  310    HA   GLU  43           HA       GLU  43   5.171  -1.058   9.790
  311   1HB   GLU  43          HB2       GLU  43   6.914   0.486   8.876
  312   2HB   GLU  43          HB1       GLU  43   6.204   0.295   7.273
  313   1HG   GLU  43          HG2       GLU  43   4.158   1.305   7.977
  314   2HG   GLU  43          HG1       GLU  43   4.673   1.301   9.656
  315    H    VAL  44           HN       VAL  44   5.358  -2.289   6.566
  316    HA   VAL  44           HA       VAL  44   2.773  -1.700   5.641
  317    HB   VAL  44           HB       VAL  44   4.450  -4.150   5.004
  318   1HG1  VAL  44          HG11      VAL  44   2.197  -2.879   3.458
  319   2HG1  VAL  44          HG12      VAL  44   2.149  -4.428   4.303
  320   3HG1  VAL  44          HG13      VAL  44   3.197  -4.223   2.898
  321   1HG2  VAL  44          HG21      VAL  44   5.678  -2.124   4.593
  322   2HG2  VAL  44          HG22      VAL  44   4.343  -1.468   3.638
  323   3HG2  VAL  44          HG23      VAL  44   5.232  -2.888   3.071
  324    H    ARG  45           HN       ARG  45   4.035  -4.598   7.266
  325    HA   ARG  45           HA       ARG  45   1.594  -5.912   7.483
  326   1HB   ARG  45          HB2       ARG  45   4.142  -6.141   9.015
  327   2HB   ARG  45          HB1       ARG  45   2.753  -7.091   9.491
  328   1HG   ARG  45          HG2       ARG  45   2.684  -7.994   7.160
  329   2HG   ARG  45          HG1       ARG  45   4.201  -7.142   6.857
  330   1HD   ARG  45          HD2       ARG  45   3.791  -9.168   9.048
  331   2HD   ARG  45          HD1       ARG  45   4.472  -9.533   7.464
  332    HE   ARG  45           HE       ARG  45   6.282  -8.024   7.995
  333   1HH1  ARG  45          HH11      ARG  45   4.336  -8.969  10.845
  334   2HH1  ARG  45          HH12      ARG  45   5.660  -9.036  11.896
  335   1HH2  ARG  45          HH21      ARG  45   8.076  -8.181   9.425
  336   2HH2  ARG  45          HH22      ARG  45   7.862  -8.592  11.088
  337    H    GLN  46           HN       GLN  46   3.027  -3.517   9.649
  338    HA   GLN  46           HA       GLN  46   0.946  -3.978  11.551
  339   1HB   GLN  46          HB2       GLN  46   2.951  -1.725  11.426
  340   2HB   GLN  46          HB1       GLN  46   1.803  -1.955  12.737
  341   1HG   GLN  46          HG2       GLN  46   2.792  -4.181  13.155
  342   2HG   GLN  46          HG1       GLN  46   3.983  -3.835  11.909
  343   1HE2  GLN  46          HE21      GLN  46   4.154  -0.997  12.720
  344   2HE2  GLN  46          HE22      GLN  46   5.086  -0.986  14.157
  345    H    ILE  47           HN       ILE  47   0.987  -2.312   8.684
  346    HA   ILE  47           HA       ILE  47  -1.232  -0.621   9.506
  347    HB   ILE  47           HB       ILE  47  -0.023  -1.007   6.740
  348   1HG1  ILE  47          HG12      ILE  47   0.296   1.293   8.690
  349   2HG1  ILE  47          HG11      ILE  47   1.512   0.069   8.338
  350   1HG2  ILE  47          HG21      ILE  47  -2.351  -0.328   6.619
  351   2HG2  ILE  47          HG22      ILE  47  -1.307   1.015   6.138
  352   3HG2  ILE  47          HG23      ILE  47  -2.043   0.994   7.742
  353   1HD1  ILE  47          HD11      ILE  47   1.643   0.842   6.035
  354   2HD1  ILE  47          HD12      ILE  47   1.974   2.150   7.172
  355   3HD1  ILE  47          HD13      ILE  47   0.408   2.057   6.368
  356    H    LEU  48           HN       LEU  48  -0.617  -3.148   7.089
  357    HA   LEU  48           HA       LEU  48  -3.353  -3.382   6.467
  358   1HB   LEU  48          HB2       LEU  48  -0.967  -4.990   5.649
  359   2HB   LEU  48          HB1       LEU  48  -2.570  -5.467   5.155
  360    HG   LEU  48           HG       LEU  48  -1.659  -4.301   3.345
  361   1HD1  LEU  48          HD11      LEU  48  -3.056  -2.316   3.095
  362   2HD1  LEU  48          HD12      LEU  48  -3.425  -2.377   4.820
  363   3HD1  LEU  48          HD13      LEU  48  -3.940  -3.690   3.762
  364   1HD2  LEU  48          HD21      LEU  48  -0.674  -2.063   3.487
  365   2HD2  LEU  48          HD22      LEU  48   0.218  -3.235   4.457
  366   3HD2  LEU  48          HD23      LEU  48  -0.873  -2.095   5.238
  367    H    GLU  49           HN       GLU  49  -1.283  -5.400   8.507
  368    HA   GLU  49           HA       GLU  49  -3.309  -7.357   8.892
  369   1HB   GLU  49          HB2       GLU  49  -0.974  -7.925   9.215
  370   2HB   GLU  49          HB1       GLU  49  -0.823  -6.728  10.487
  371   1HG   GLU  49          HG2       GLU  49  -2.391  -8.032  11.857
  372   2HG   GLU  49          HG1       GLU  49  -2.455  -9.249  10.580
  373    H    ARG  50           HN       ARG  50  -2.304  -4.519  10.628
  374    HA   ARG  50           HA       ARG  50  -3.920  -4.904  12.935
  375   1HB   ARG  50          HB2       ARG  50  -1.967  -3.521  12.999
  376   2HB   ARG  50          HB1       ARG  50  -2.605  -2.473  11.753
  377   1HG   ARG  50          HG2       ARG  50  -4.388  -1.781  13.325
  378   2HG   ARG  50          HG1       ARG  50  -3.599  -2.748  14.578
  379   1HD   ARG  50          HD2       ARG  50  -1.572  -1.445  14.352
  380   2HD   ARG  50          HD1       ARG  50  -2.273  -0.531  13.026
  381    HE   ARG  50           HE       ARG  50  -3.615  -0.466  15.617
  382   1HH1  ARG  50          HH11      ARG  50  -1.744   1.304  13.124
  383   2HH1  ARG  50          HH12      ARG  50  -1.946   2.800  13.928
  384   1HH2  ARG  50          HH21      ARG  50  -3.848   1.639  16.630
  385   2HH2  ARG  50          HH22      ARG  50  -3.164   3.003  15.876
  386    H    GLU  51           HN       GLU  51  -4.358  -2.985   9.983
  387    HA   GLU  51           HA       GLU  51  -6.922  -2.048  10.926
  388   1HB   GLU  51          HB2       GLU  51  -5.235  -1.416   8.555
  389   2HB   GLU  51          HB1       GLU  51  -6.895  -0.858   8.688
  390   1HG   GLU  51          HG2       GLU  51  -4.761  -0.311  10.726
  391   2HG   GLU  51          HG1       GLU  51  -5.266   0.809   9.457
  392    H    HIS  52           HN       HIS  52  -5.785  -4.402   8.589
  393    HA   HIS  52           HA       HIS  52  -8.598  -4.660   7.760
  394   1HB   HIS  52          HB2       HIS  52  -6.988  -3.485   6.138
  395   2HB   HIS  52          HB1       HIS  52  -6.260  -5.061   5.901
  396    HD1  HIS  52           HD1      HIS  52  -9.273  -3.037   5.124
  397    HD2  HIS  52           HD2      HIS  52  -7.787  -6.820   4.284
  398    HE1  HIS  52           HE1      HIS  52 -10.691  -3.921   3.225
  399    HE2  HIS  52           HE2      HIS  52  -9.930  -6.306   2.950
  400    H    ASP  53           HN       ASP  53  -6.186  -6.223   9.397
  401    HA   ASP  53           HA       ASP  53  -5.598  -8.371   9.865
  402   1HB   ASP  53          HB2       ASP  53  -7.946  -8.663  10.478
  403   2HB   ASP  53          HB1       ASP  53  -8.416  -8.827   8.798
  404    H    LEU  54           HN       LEU  54  -5.103  -7.147   7.326
  405    HA   LEU  54           HA       LEU  54  -5.196  -9.208   5.301
  406   1HB   LEU  54          HB2       LEU  54  -5.937  -6.898   4.933
  407   2HB   LEU  54          HB1       LEU  54  -4.308  -6.345   5.196
  408    HG   LEU  54           HG       LEU  54  -3.625  -7.718   3.197
  409   1HD1  LEU  54          HD11      LEU  54  -5.540  -9.268   3.238
  410   2HD1  LEU  54          HD12      LEU  54  -5.408  -8.428   1.690
  411   3HD1  LEU  54          HD13      LEU  54  -6.612  -7.914   2.869
  412   1HD2  LEU  54          HD21      LEU  54  -4.538  -6.111   1.616
  413   2HD2  LEU  54          HD22      LEU  54  -4.026  -5.331   3.133
  414   3HD2  LEU  54          HD23      LEU  54  -5.736  -5.642   2.834
  415    H    VAL  55           HN       VAL  55  -3.642 -10.605   6.006
  416    HA   VAL  55           HA       VAL  55  -0.956  -9.673   6.521
  417    HB   VAL  55           HB       VAL  55  -1.998 -12.509   6.245
  418   1HG1  VAL  55          HG11      VAL  55   0.670 -11.496   7.271
  419   2HG1  VAL  55          HG12      VAL  55   0.416 -12.351   5.755
  420   3HG1  VAL  55          HG13      VAL  55   0.142 -13.177   7.285
  421   1HG2  VAL  55          HG21      VAL  55  -1.356 -10.873   8.695
  422   2HG2  VAL  55          HG22      VAL  55  -1.815 -12.577   8.692
  423   3HG2  VAL  55          HG23      VAL  55  -2.965 -11.352   8.156
  424    H    LEU  56           HN       LEU  56   0.011  -8.909   4.895
  425    HA   LEU  56           HA       LEU  56   0.037 -10.467   2.429
  426   1HB   LEU  56          HB2       LEU  56   1.008  -7.624   2.852
  427   2HB   LEU  56          HB1       LEU  56   0.882  -8.472   1.340
  428    HG   LEU  56           HG       LEU  56  -1.466  -7.608   3.026
  429   1HD1  LEU  56          HD11      LEU  56  -0.379  -6.510   0.436
  430   2HD1  LEU  56          HD12      LEU  56  -0.332  -5.719   2.013
  431   3HD1  LEU  56          HD13      LEU  56  -1.879  -6.011   1.218
  432   1HD2  LEU  56          HD21      LEU  56  -2.819  -8.276   1.093
  433   2HD2  LEU  56          HD22      LEU  56  -1.936  -9.648   1.759
  434   3HD2  LEU  56          HD23      LEU  56  -1.370  -8.871   0.281
  435    HA   PRO  57           HA       PRO  57   3.919 -11.693   4.383
  436   1HB   PRO  57          HB2       PRO  57   4.054 -13.335   1.918
  437   2HB   PRO  57          HB1       PRO  57   4.158 -13.845   3.609
  438   1HG   PRO  57          HG2       PRO  57   1.967 -14.387   2.217
  439   2HG   PRO  57          HG1       PRO  57   1.839 -13.801   3.893
  440   1HD   PRO  57          HD2       PRO  57   1.539 -12.255   1.348
  441   2HD   PRO  57          HD1       PRO  57   0.482 -12.284   2.780
  442    H    ILE  58           HN       ILE  58   6.068 -11.214   3.918
  443    HA   ILE  58           HA       ILE  58   6.458  -9.132   2.068
  444    HB   ILE  58           HB       ILE  58   8.243 -10.596   3.988
  445   1HG1  ILE  58          HG12      ILE  58   8.634  -8.333   4.880
  446   2HG1  ILE  58          HG11      ILE  58   7.665  -7.655   3.587
  447   1HG2  ILE  58          HG21      ILE  58  10.223  -9.324   3.333
  448   2HG2  ILE  58          HG22      ILE  58   9.352  -8.696   1.934
  449   3HG2  ILE  58          HG23      ILE  58   9.697 -10.422   2.057
  450   1HD1  ILE  58          HD11      ILE  58   6.686  -9.486   5.769
  451   2HD1  ILE  58          HD12      ILE  58   5.693  -8.796   4.485
  452   3HD1  ILE  58          HD13      ILE  58   6.438  -7.742   5.683
  453    H    ARG  59           HN       ARG  59   6.751 -12.468   1.839
  454    HA   ARG  59           HA       ARG  59   8.417 -12.676  -0.448
  455   1HB   ARG  59          HB2       ARG  59   6.217 -14.557   0.480
  456   2HB   ARG  59          HB1       ARG  59   7.377 -14.931  -0.781
  457   1HG   ARG  59          HG2       ARG  59   8.184 -16.051   1.104
  458   2HG   ARG  59          HG1       ARG  59   9.174 -14.602   1.024
  459   1HD   ARG  59          HD2       ARG  59   7.666 -13.563   2.750
  460   2HD   ARG  59          HD1       ARG  59   6.825 -15.101   2.883
  461    HE   ARG  59           HE       ARG  59   9.692 -15.162   3.235
  462   1HH1  ARG  59          HH11      ARG  59   6.519 -15.186   4.902
  463   2HH1  ARG  59          HH12      ARG  59   7.193 -15.516   6.422
  464   1HH2  ARG  59          HH21      ARG  59  10.559 -15.736   5.357
  465   2HH2  ARG  59          HH22      ARG  59   9.512 -15.887   6.678
  466    H    GLU  60           HN       GLU  60   5.221 -11.650   0.015
  467    HA   GLU  60           HA       GLU  60   4.523 -11.737  -2.830
  468   1HB   GLU  60          HB2       GLU  60   2.922 -11.192  -0.332
  469   2HB   GLU  60          HB1       GLU  60   2.237 -11.082  -1.938
  470   1HG   GLU  60          HG2       GLU  60   3.447 -13.569  -0.729
  471   2HG   GLU  60          HG1       GLU  60   1.723 -13.196  -0.753
  472    H    VAL  61           HN       VAL  61   4.748  -9.611  -0.030
  473    HA   VAL  61           HA       VAL  61   4.037  -7.189  -1.214
  474    HB   VAL  61           HB       VAL  61   5.803  -7.685   1.217
  475   1HG1  VAL  61          HG11      VAL  61   4.348  -5.170   0.415
  476   2HG1  VAL  61          HG12      VAL  61   6.099  -5.395   0.410
  477   3HG1  VAL  61          HG13      VAL  61   5.207  -5.436   1.931
  478   1HG2  VAL  61          HG21      VAL  61   3.772  -7.253   2.477
  479   2HG2  VAL  61          HG22      VAL  61   3.607  -8.644   1.406
  480   3HG2  VAL  61          HG23      VAL  61   2.875  -7.100   0.966
  481    H    ARG  62           HN       ARG  62   7.144  -8.810  -1.188
  482    HA   ARG  62           HA       ARG  62   8.749  -6.647  -1.908
  483   1HB   ARG  62          HB2       ARG  62   9.066  -9.579  -2.180
  484   2HB   ARG  62          HB1       ARG  62  10.188  -8.530  -3.033
  485   1HG   ARG  62          HG2       ARG  62  10.723  -7.421  -0.919
  486   2HG   ARG  62          HG1       ARG  62   9.624  -8.527  -0.090
  487   1HD   ARG  62          HD2       ARG  62  10.976 -10.381  -0.590
  488   2HD   ARG  62          HD1       ARG  62  11.938  -9.457  -1.749
  489    HE   ARG  62           HE       ARG  62  12.418  -8.086   0.443
  490   1HH1  ARG  62          HH11      ARG  62  12.182 -11.597   0.225
  491   2HH1  ARG  62          HH12      ARG  62  13.522 -11.879   1.225
  492   1HH2  ARG  62          HH21      ARG  62  14.189  -8.440   1.812
  493   2HH2  ARG  62          HH22      ARG  62  14.706 -10.040   2.174
  494    H    GLN  63           HN       GLN  63   6.419  -8.151  -3.834
  495    HA   GLN  63           HA       GLN  63   7.789  -7.236  -6.234
  496   1HB   GLN  63          HB2       GLN  63   5.487  -9.172  -5.955
  497   2HB   GLN  63          HB1       GLN  63   6.043  -8.541  -7.496
  498   1HG   GLN  63          HG2       GLN  63   7.038 -10.649  -7.292
  499   2HG   GLN  63          HG1       GLN  63   8.310  -9.495  -6.924
  500   1HE2  GLN  63          HE21      GLN  63   5.750 -10.421  -4.702
  501   2HE2  GLN  63          HE22      GLN  63   6.772 -11.297  -3.625
  502    H    LEU  64           HN       LEU  64   5.830  -5.985  -4.067
  503    HA   LEU  64           HA       LEU  64   3.891  -4.798  -5.810
  504   1HB   LEU  64          HB2       LEU  64   4.732  -3.795  -3.076
  505   2HB   LEU  64          HB1       LEU  64   3.263  -3.382  -3.926
  506    HG   LEU  64           HG       LEU  64   3.977  -6.010  -2.667
  507   1HD1  LEU  64          HD11      LEU  64   3.280  -4.343  -1.086
  508   2HD1  LEU  64          HD12      LEU  64   2.035  -5.579  -1.240
  509   3HD1  LEU  64          HD13      LEU  64   1.825  -4.012  -2.024
  510   1HD2  LEU  64          HD21      LEU  64   1.492  -5.320  -4.238
  511   2HD2  LEU  64          HD22      LEU  64   1.746  -6.810  -3.328
  512   3HD2  LEU  64          HD23      LEU  64   2.749  -6.450  -4.733
  513    H    THR  65           HN       THR  65   4.571  -3.459  -7.384
  514    HA   THR  65           HA       THR  65   7.080  -2.163  -7.186
  515    HB   THR  65           HB       THR  65   6.462  -1.462  -9.557
  516    HG1  THR  65           HG1      THR  65   4.172  -1.717  -9.438
  517   1HG2  THR  65          HG21      THR  65   7.868  -3.352  -8.977
  518   2HG2  THR  65          HG22      THR  65   6.794  -3.777 -10.337
  519   3HG2  THR  65          HG23      THR  65   6.416  -4.305  -8.682
  520    H    LEU  66           HN       LEU  66   6.246  -0.905  -5.332
  521    HA   LEU  66           HA       LEU  66   5.949   1.097  -4.340
  522   1HB   LEU  66          HB2       LEU  66   7.526   1.751  -6.278
  523   2HB   LEU  66          HB1       LEU  66   6.110   2.427  -7.049
  524    HG   LEU  66           HG       LEU  66   7.485   4.149  -5.964
  525   1HD1  LEU  66          HD11      LEU  66   5.785   5.287  -4.639
  526   2HD1  LEU  66          HD12      LEU  66   4.850   3.792  -4.577
  527   3HD1  LEU  66          HD13      LEU  66   5.116   4.600  -6.122
  528   1HD2  LEU  66          HD21      LEU  66   7.671   4.260  -3.531
  529   2HD2  LEU  66          HD22      LEU  66   8.451   2.821  -4.192
  530   3HD2  LEU  66          HD23      LEU  66   6.879   2.689  -3.404
  531    H    ARG  67           HN       ARG  67   4.152   1.368  -7.381
  532    HA   ARG  67           HA       ARG  67   2.031   2.705  -5.986
  533   1HB   ARG  67          HB2       ARG  67   2.454   2.039  -8.875
  534   2HB   ARG  67          HB1       ARG  67   0.931   2.695  -8.284
  535   1HG   ARG  67          HG2       ARG  67   3.633   3.998  -8.031
  536   2HG   ARG  67          HG1       ARG  67   2.337   4.469  -9.141
  537   1HD   ARG  67          HD2       ARG  67   0.862   4.794  -7.140
  538   2HD   ARG  67          HD1       ARG  67   2.251   4.472  -6.154
  539    HE   ARG  67           HE       ARG  67   3.126   6.493  -6.543
  540   1HH1  ARG  67          HH11      ARG  67   0.484   6.093  -8.951
  541   2HH1  ARG  67          HH12      ARG  67   0.302   7.755  -9.183
  542   1HH2  ARG  67          HH21      ARG  67   2.765   8.855  -6.891
  543   2HH2  ARG  67          HH22      ARG  67   1.609   9.333  -8.017
  544    H    LYS  68           HN       LYS  68   2.746  -0.472  -6.978
  545    HA   LYS  68           HA       LYS  68   0.102  -1.480  -6.834
  546   1HB   LYS  68          HB2       LYS  68   2.188  -2.699  -7.759
  547   2HB   LYS  68          HB1       LYS  68   2.538  -3.046  -6.061
  548   1HG   LYS  68          HG2       LYS  68   0.541  -4.273  -5.804
  549   2HG   LYS  68          HG1       LYS  68  -0.003  -3.827  -7.424
  550   1HD   LYS  68          HD2       LYS  68   1.884  -5.041  -8.387
  551   2HD   LYS  68          HD1       LYS  68   2.418  -5.482  -6.757
  552   1HE   LYS  68          HE2       LYS  68   0.357  -6.612  -6.356
  553   2HE   LYS  68          HE1       LYS  68  -0.246  -6.159  -7.949
  554   1HZ   LYS  68          HZ1       LYS  68   0.538  -8.407  -8.043
  555   2HZ   LYS  68          HZ2       LYS  68   2.006  -8.016  -7.338
  556   3HZ   LYS  68          HZ3       LYS  68   1.673  -7.480  -8.899
  557    H    LEU  69           HN       LEU  69   2.356  -0.517  -4.574
  558    HA   LEU  69           HA       LEU  69   1.365  -1.639  -2.167
  559   1HB   LEU  69          HB2       LEU  69   2.662   1.027  -2.671
  560   2HB   LEU  69          HB1       LEU  69   1.956   0.707  -1.108
  561    HG   LEU  69           HG       LEU  69   4.323   0.379  -1.014
  562   1HD1  LEU  69          HD11      LEU  69   2.894  -2.253  -0.923
  563   2HD1  LEU  69          HD12      LEU  69   3.003  -1.065   0.375
  564   3HD1  LEU  69          HD13      LEU  69   4.454  -1.903  -0.177
  565   1HD2  LEU  69          HD21      LEU  69   5.481  -1.339  -2.304
  566   2HD2  LEU  69          HD22      LEU  69   4.777  -0.106  -3.354
  567   3HD2  LEU  69          HD23      LEU  69   3.991  -1.678  -3.185
  568    H    GLN  70           HN       GLN  70   0.322   1.375  -3.775
  569    HA   GLN  70           HA       GLN  70  -1.928   1.600  -1.987
  570   1HB   GLN  70          HB2       GLN  70  -2.555   3.623  -3.282
  571   2HB   GLN  70          HB1       GLN  70  -0.922   3.684  -2.644
  572   1HG   GLN  70          HG2       GLN  70  -0.001   3.226  -4.776
  573   2HG   GLN  70          HG1       GLN  70  -1.607   2.958  -5.488
  574   1HE2  GLN  70          HE21      GLN  70  -1.321   4.557  -6.987
  575   2HE2  GLN  70          HE22      GLN  70  -1.288   6.245  -6.580
  576    H    GLU  71           HN       GLU  71  -1.480  -0.476  -4.180
  577    HA   GLU  71           HA       GLU  71  -4.171  -0.444  -5.315
  578   1HB   GLU  71          HB2       GLU  71  -2.282  -0.953  -6.840
  579   2HB   GLU  71          HB1       GLU  71  -1.781  -2.262  -5.789
  580   1HG   GLU  71          HG2       GLU  71  -3.808  -3.479  -6.312
  581   2HG   GLU  71          HG1       GLU  71  -4.360  -2.149  -7.329
  582    H    MET  72           HN       MET  72  -2.236  -1.655  -2.803
  583    HA   MET  72           HA       MET  72  -4.232  -3.678  -2.007
  584   1HB   MET  72          HB2       MET  72  -1.245  -3.665  -1.458
  585   2HB   MET  72          HB1       MET  72  -2.379  -4.901  -0.951
  586   1HG   MET  72          HG2       MET  72  -1.577  -4.274  -3.801
  587   2HG   MET  72          HG1       MET  72  -1.039  -5.626  -2.827
  588   1HE   MET  72          HE1       MET  72  -2.382  -5.790  -5.768
  589   2HE   MET  72          HE2       MET  72  -3.402  -7.215  -5.581
  590   3HE   MET  72          HE3       MET  72  -1.768  -7.206  -4.915
  591    H    SER  73           HN       SER  73  -3.684  -0.678  -1.453
  592    HA   SER  73           HA       SER  73  -2.632  -0.539   1.169
  593   1HB   SER  73          HB2       SER  73  -3.202   1.901   0.867
  594   2HB   SER  73          HB1       SER  73  -2.104   1.187  -0.309
  595    HG   SER  73           HG       SER  73  -4.577   2.254  -0.693
  596    H    SER  74           HN       SER  74  -5.674  -1.254  -0.047
  597    HA   SER  74           HA       SER  74  -7.682  -1.614   0.828
  598   1HB   SER  74          HB2       SER  74  -6.612  -0.647   3.511
  599   2HB   SER  74          HB1       SER  74  -8.138  -1.501   3.245
  600    HG   SER  74           HG       SER  74  -5.732  -2.606   2.361
  601    H    LYS  75           HN       LYS  75  -6.343   1.522   1.763
  602    HA   LYS  75           HA       LYS  75  -8.864   2.714   0.803
  603   1HB   LYS  75          HB2       LYS  75  -8.553   4.620   2.263
  604   2HB   LYS  75          HB1       LYS  75  -8.471   3.171   3.248
  605   1HG   LYS  75          HG2       LYS  75  -6.092   3.355   3.454
  606   2HG   LYS  75          HG1       LYS  75  -6.037   4.638   2.243
  607   1HD   LYS  75          HD2       LYS  75  -7.328   6.099   3.735
  608   2HD   LYS  75          HD1       LYS  75  -7.387   4.815   4.942
  609   1HE   LYS  75          HE2       LYS  75  -4.964   4.874   5.160
  610   2HE   LYS  75          HE1       LYS  75  -4.863   6.093   3.892
  611   1HZ   LYS  75          HZ1       LYS  75  -5.918   7.689   5.301
  612   2HZ   LYS  75          HZ2       LYS  75  -4.754   6.946   6.279
  613   3HZ   LYS  75          HZ3       LYS  75  -6.365   6.522   6.416
  614    H    ALA  76           HN       ALA  76  -8.420   5.004  -0.110
  615    HA   ALA  76           HA       ALA  76  -5.837   4.934  -1.496
  616   1HB   ALA  76          HB1       ALA  76  -6.923   6.150  -3.328
  617   2HB   ALA  76          HB2       ALA  76  -8.451   6.121  -2.446
  618   3HB   ALA  76          HB3       ALA  76  -7.736   4.614  -3.023
  619    H    GLY  77           HN       GLY  77  -4.534   6.325  -0.496
  620   1HA   GLY  77          HA2       GLY  77  -5.596   8.744   0.699
  621   2HA   GLY  77          HA1       GLY  77  -3.927   8.173   0.760
  622    H    SER  78           HN       SER  78  -6.322   9.699  -1.226
  623    HA   SER  78           HA       SER  78  -4.264  10.475  -3.161
  624   1HB   SER  78          HB2       SER  78  -7.262  10.739  -3.349
  625   2HB   SER  78          HB1       SER  78  -6.093  10.977  -4.648
  626    HG   SER  78           HG       SER  78  -7.162   8.892  -4.599
  627    H    ASP  79           HN       ASP  79  -6.601  11.708  -0.868
  628    HA   ASP  79           HA       ASP  79  -7.152  13.710  -0.049
  629   1HB   ASP  79          HB2       ASP  79  -4.790  13.997   0.572
  630   2HB   ASP  79          HB1       ASP  79  -4.393  14.515  -1.060
  631    H    THR  80           HN       THR  80  -5.292  14.997  -2.637
  632    HA   THR  80           HA       THR  80  -6.818  15.114  -4.765
  633    HB   THR  80           HB       THR  80  -8.613  16.330  -3.419
  634    HG1  THR  80           HG1      THR  80  -8.240  16.591  -5.726
  635   1HG2  THR  80          HG21      THR  80  -7.176  17.706  -1.974
  636   2HG2  THR  80          HG22      THR  80  -8.298  18.718  -2.884
  637   3HG2  THR  80          HG23      THR  80  -6.609  18.602  -3.384
  638    H    GLU  81           HN       GLU  81  -4.836  16.864  -2.518
  639    HA   GLU  81           HA       GLU  81  -2.962  17.998  -2.611
  640   1HB   GLU  81          HB2       GLU  81  -2.099  15.875  -3.543
  641   2HB   GLU  81          HB1       GLU  81  -2.421  16.466  -5.167
  642   1HG   GLU  81          HG2       GLU  81  -0.798  18.258  -4.843
  643   2HG   GLU  81          HG1       GLU  81  -0.491  17.688  -3.204
  644    H    LEU  82           HN       LEU  82  -3.763  20.002  -2.789
  645    HA   LEU  82           HA       LEU  82  -4.391  21.130  -5.339
  646   1HB   LEU  82          HB2       LEU  82  -4.005  22.443  -2.640
  647   2HB   LEU  82          HB1       LEU  82  -4.593  23.258  -4.072
  648    HG   LEU  82           HG       LEU  82  -6.004  21.020  -2.614
  649   1HD1  LEU  82          HD11      LEU  82  -7.625  22.746  -2.015
  650   2HD1  LEU  82          HD12      LEU  82  -6.614  23.966  -2.794
  651   3HD1  LEU  82          HD13      LEU  82  -6.023  23.107  -1.372
  652   1HD2  LEU  82          HD21      LEU  82  -6.457  20.962  -5.015
  653   2HD2  LEU  82          HD22      LEU  82  -6.886  22.673  -4.986
  654   3HD2  LEU  82          HD23      LEU  82  -7.879  21.500  -4.120
  655    H    ALA  83           HN       ALA  83  -3.266  22.841  -6.286
  656    HA   ALA  83           HA       ALA  83  -1.543  23.877  -7.172
  657   1HB   ALA  83          HB1       ALA  83   0.528  24.354  -5.984
  658   2HB   ALA  83          HB2       ALA  83   0.147  23.134  -4.768
  659   3HB   ALA  83          HB3       ALA  83  -0.840  24.590  -4.894
  660    H    ALA  84           HN       ALA  84  -1.302  22.860  -8.877
  661    HA   ALA  84           HA       ALA  84   0.781  20.856  -9.173
  662   1HB   ALA  84          HB1       ALA  84  -2.031  20.797 -10.350
  663   2HB   ALA  84          HB2       ALA  84  -1.352  19.607  -9.236
  664   3HB   ALA  84          HB3       ALA  84  -0.711  19.750 -10.876
  665    HA   PRO  85           HA       PRO  85   2.144  23.638 -12.360
  666   1HB   PRO  85          HB2       PRO  85   1.556  21.622 -14.482
  667   2HB   PRO  85          HB1       PRO  85   3.036  22.546 -14.189
  668   1HG   PRO  85          HG2       PRO  85   2.909  19.995 -13.494
  669   2HG   PRO  85          HG1       PRO  85   3.703  21.178 -12.434
  670   1HD   PRO  85          HD2       PRO  85   1.021  19.887 -12.161
  671   2HD   PRO  85          HD1       PRO  85   2.200  20.316 -10.904
  672    H    LYS  86           HN       LYS  86   0.518  25.085 -12.209
  673    HA   LYS  86           HA       LYS  86  -1.413  25.140 -14.434
  674   1HB   LYS  86          HB2       LYS  86  -2.535  24.632 -12.278
  675   2HB   LYS  86          HB1       LYS  86  -1.845  26.089 -11.588
  676   1HG   LYS  86          HG2       LYS  86  -3.096  27.419 -13.261
  677   2HG   LYS  86          HG1       LYS  86  -3.845  25.924 -13.825
  678   1HD   LYS  86          HD2       LYS  86  -5.322  27.076 -12.278
  679   2HD   LYS  86          HD1       LYS  86  -4.760  25.557 -11.572
  680   1HE   LYS  86          HE2       LYS  86  -3.114  26.750 -10.247
  681   2HE   LYS  86          HE1       LYS  86  -3.574  28.271 -11.005
  682   1HZ   LYS  86          HZ1       LYS  86  -5.761  28.047 -10.043
  683   2HZ   LYS  86          HZ2       LYS  86  -4.567  28.040  -8.840
  684   3HZ   LYS  86          HZ3       LYS  86  -5.327  26.592  -9.289
  685    H    SER  87           HN       SER  87   0.574  26.830 -12.084
  686    HA   SER  87           HA       SER  87   0.422  29.293 -13.566
  687   1HB   SER  87          HB2       SER  87   0.416  29.244 -11.052
  688   2HB   SER  87          HB1       SER  87   2.024  28.528 -11.097
  689    HG   SER  87           HG       SER  87   2.794  30.461 -11.288
  690    H    LYS  88           HN       LYS  88   1.806  29.635 -15.168
  691    HA   LYS  88           HA       LYS  88   3.858  27.831 -15.873
  692   1HB   LYS  88          HB2       LYS  88   3.448  30.692 -16.767
  693   2HB   LYS  88          HB1       LYS  88   4.547  29.548 -17.532
  694   1HG   LYS  88          HG2       LYS  88   2.655  28.097 -18.065
  695   2HG   LYS  88          HG1       LYS  88   1.558  29.254 -17.319
  696   1HD   LYS  88          HD2       LYS  88   2.214  30.935 -18.962
  697   2HD   LYS  88          HD1       LYS  88   3.326  29.781 -19.702
  698   1HE   LYS  88          HE2       LYS  88   0.337  29.445 -19.480
  699   2HE   LYS  88          HE1       LYS  88   1.210  29.931 -20.934
  700   1HZ   LYS  88          HZ1       LYS  88   1.548  27.304 -19.541
  701   2HZ   LYS  88          HZ2       LYS  88   2.330  27.776 -20.933
  702   3HZ   LYS  88          HZ3       LYS  88   0.675  27.548 -20.960
  703    H    ASN  89           HN       ASN  89   3.916  30.915 -14.218
  704    HA   ASN  89           HA       ASN  89   6.681  30.367 -13.511
  705   1HB   ASN  89          HB2       ASN  89   6.457  32.561 -14.523
  706   2HB   ASN  89          HB1       ASN  89   5.133  32.971 -13.435
  707   1HD2  ASN  89          HD21      ASN  89   8.568  32.315 -13.609
  708   2HD2  ASN  89          HD22      ASN  89   8.980  33.140 -12.152
  Start of MODEL    5
    1   1H    GLY   1          HT1       GLY   1   1.019   2.848  14.346
    2   2H    GLY   1          HT2       GLY   1   1.454   1.740  15.541
    3   3H    GLY   1          HT3       GLY   1  -0.142   2.308  15.446
    4   1HA   GLY   1          HA1       GLY   1   1.271   0.656  13.434
    5   2HA   GLY   1          HA2       GLY   1   0.015   0.092  14.536
    6    H    ASP   2           HN       ASP   2  -2.083   0.978  14.322
    7    HA   ASP   2           HA       ASP   2  -2.741   1.470  11.547
    8   1HB   ASP   2          HB2       ASP   2  -5.050   1.143  12.151
    9   2HB   ASP   2          HB1       ASP   2  -4.112  -0.106  12.954
   10    H    GLY   3           HN       GLY   3  -3.630   3.274  10.733
   11   1HA   GLY   3          HA2       GLY   3  -3.669   5.611  12.512
   12   2HA   GLY   3          HA1       GLY   3  -3.356   5.662  10.774
   13    H    GLU   4           HN       GLU   4  -5.400   7.099  12.209
   14    HA   GLU   4           HA       GLU   4  -7.768   5.784  11.164
   15   1HB   GLU   4          HB2       GLU   4  -8.993   7.633  12.410
   16   2HB   GLU   4          HB1       GLU   4  -8.149   6.455  13.399
   17   1HG   GLU   4          HG2       GLU   4  -6.294   8.047  13.652
   18   2HG   GLU   4          HG1       GLU   4  -7.225   9.231  12.730
   19    H    ALA   5           HN       ALA   5  -9.263   7.035   9.875
   20    HA   ALA   5           HA       ALA   5  -9.647   7.950   7.862
   21   1HB   ALA   5          HB1       ALA   5  -7.618  10.064   8.695
   22   2HB   ALA   5          HB2       ALA   5  -9.347  10.131   9.029
   23   3HB   ALA   5          HB3       ALA   5  -8.770  10.217   7.367
   24    H    GLN   6           HN       GLN   6  -8.929   6.255   6.787
   25    HA   GLN   6           HA       GLN   6  -6.347   5.374   6.484
   26   1HB   GLN   6          HB2       GLN   6  -8.516   4.157   5.966
   27   2HB   GLN   6          HB1       GLN   6  -8.456   4.940   4.386
   28   1HG   GLN   6          HG2       GLN   6  -7.491   2.802   4.150
   29   2HG   GLN   6          HG1       GLN   6  -6.172   3.976   4.109
   30   1HE2  GLN   6          HE21      GLN   6  -4.571   2.750   4.870
   31   2HE2  GLN   6          HE22      GLN   6  -4.536   2.000   6.424
   32    H    ARG   7           HN       ARG   7  -4.700   5.864   5.291
   33    HA   ARG   7           HA       ARG   7  -4.904   8.060   3.354
   34   1HB   ARG   7          HB2       ARG   7  -2.524   8.319   3.650
   35   2HB   ARG   7          HB1       ARG   7  -3.261   8.207   5.242
   36   1HG   ARG   7          HG2       ARG   7  -2.574   5.880   5.424
   37   2HG   ARG   7          HG1       ARG   7  -1.894   5.943   3.801
   38   1HD   ARG   7          HD2       ARG   7  -0.101   6.183   5.357
   39   2HD   ARG   7          HD1       ARG   7  -0.365   7.746   4.590
   40    HE   ARG   7           HE       ARG   7  -1.850   7.590   6.963
   41   1HH1  ARG   7          HH11      ARG   7   1.507   8.084   5.802
   42   2HH1  ARG   7          HH12      ARG   7   2.061   8.711   7.274
   43   1HH2  ARG   7          HH21      ARG   7  -1.027   8.485   9.007
   44   2HH2  ARG   7          HH22      ARG   7   0.620   8.895   9.140
   45    H    ASP   8           HN       ASP   8  -3.186   7.774   1.501
   46    HA   ASP   8           HA       ASP   8  -3.649   5.196   0.213
   47   1HB   ASP   8          HB2       ASP   8  -1.801   7.413  -0.737
   48   2HB   ASP   8          HB1       ASP   8  -2.372   6.048  -1.664
   49    H    LEU   9           HN       LEU   9  -1.896   3.747  -0.320
   50    HA   LEU   9           HA       LEU   9  -0.055   3.665   1.854
   51   1HB   LEU   9          HB2       LEU   9  -0.168   1.850  -0.537
   52   2HB   LEU   9          HB1       LEU   9   0.779   1.585   0.906
   53    HG   LEU   9           HG       LEU   9  -2.185   1.449   0.580
   54   1HD1  LEU   9          HD11      LEU   9  -0.124  -0.491   1.564
   55   2HD1  LEU   9          HD12      LEU   9  -0.950  -0.524   0.006
   56   3HD1  LEU   9          HD13      LEU   9  -1.861  -0.787   1.495
   57   1HD2  LEU   9          HD21      LEU   9  -2.362   1.091   2.990
   58   2HD2  LEU   9          HD22      LEU   9  -1.762   2.707   2.624
   59   3HD2  LEU   9          HD23      LEU   9  -0.647   1.455   3.173
   60    H    VAL  10           HN       VAL  10   0.077   5.117  -1.138
   61    HA   VAL  10           HA       VAL  10   2.904   4.958  -1.440
   62    HB   VAL  10           HB       VAL  10   0.918   6.914  -2.662
   63   1HG1  VAL  10          HG11      VAL  10   3.169   7.884  -2.630
   64   2HG1  VAL  10          HG12      VAL  10   2.689   7.456  -4.275
   65   3HG1  VAL  10          HG13      VAL  10   3.812   6.428  -3.384
   66   1HG2  VAL  10          HG21      VAL  10   1.194   5.552  -4.672
   67   2HG2  VAL  10          HG22      VAL  10   0.577   4.597  -3.322
   68   3HG2  VAL  10          HG23      VAL  10   2.269   4.469  -3.790
   69    H    LYS  11           HN       LYS  11   0.695   7.064   0.264
   70    HA   LYS  11           HA       LYS  11   2.864   8.815   1.072
   71   1HB   LYS  11          HB2       LYS  11  -0.042   8.716   1.781
   72   2HB   LYS  11          HB1       LYS  11   1.051   9.870   2.535
   73   1HG   LYS  11          HG2       LYS  11  -0.010  11.133   0.887
   74   2HG   LYS  11          HG1       LYS  11   1.473  10.643   0.077
   75   1HD   LYS  11          HD2       LYS  11   0.284   8.900  -1.121
   76   2HD   LYS  11          HD1       LYS  11  -1.175   9.244  -0.174
   77   1HE   LYS  11          HE2       LYS  11  -1.246  11.510  -1.135
   78   2HE   LYS  11          HE1       LYS  11   0.157  11.120  -2.127
   79   1HZ   LYS  11          HZ1       LYS  11  -1.133   9.447  -3.280
   80   2HZ   LYS  11          HZ2       LYS  11  -1.975  10.890  -3.338
   81   3HZ   LYS  11          HZ3       LYS  11  -2.454   9.685  -2.265
   82    H    ALA  12           HN       ALA  12   2.628   5.900   1.730
   83    HA   ALA  12           HA       ALA  12   3.142   6.144   4.605
   84   1HB   ALA  12          HB1       ALA  12   1.612   3.891   3.293
   85   2HB   ALA  12          HB2       ALA  12   0.919   5.149   4.315
   86   3HB   ALA  12          HB3       ALA  12   2.052   3.984   4.999
   87    H    VAL  13           HN       VAL  13   3.345   3.737   1.971
   88    HA   VAL  13           HA       VAL  13   5.762   2.607   3.007
   89    HB   VAL  13           HB       VAL  13   4.317   2.151   0.379
   90   1HG1  VAL  13          HG11      VAL  13   6.558   0.557   1.629
   91   2HG1  VAL  13          HG12      VAL  13   6.660   1.553   0.174
   92   3HG1  VAL  13          HG13      VAL  13   5.654   0.102   0.181
   93   1HG2  VAL  13          HG21      VAL  13   4.337   0.543   2.934
   94   2HG2  VAL  13          HG22      VAL  13   3.528   0.080   1.438
   95   3HG2  VAL  13          HG23      VAL  13   2.994   1.509   2.320
   96    H    ALA  14           HN       ALA  14   4.913   4.454   0.082
   97    HA   ALA  14           HA       ALA  14   7.572   4.690  -0.829
   98   1HB   ALA  14          HB1       ALA  14   6.680   6.399  -2.400
   99   2HB   ALA  14          HB2       ALA  14   5.184   6.459  -1.458
  100   3HB   ALA  14          HB3       ALA  14   5.607   4.999  -2.319
  101    H    HIS  15           HN       HIS  15   5.680   6.401   1.415
  102    HA   HIS  15           HA       HIS  15   7.058   8.799   1.844
  103   1HB   HIS  15          HB2       HIS  15   4.865   8.321   2.809
  104   2HB   HIS  15          HB1       HIS  15   5.533   7.024   3.768
  105    HD1  HIS  15           HD1      HIS  15   4.878  10.655   3.788
  106    HD2  HIS  15           HD2      HIS  15   7.071   7.936   6.044
  107    HE1  HIS  15           HE1      HIS  15   5.338  11.789   5.962
  108    HE2  HIS  15           HE2      HIS  15   6.400  10.027   7.390
  109    H    ILE  16           HN       ILE  16   7.883   5.529   2.760
  110    HA   ILE  16           HA       ILE  16   9.848   6.284   4.720
  111    HB   ILE  16           HB       ILE  16   9.394   3.621   3.326
  112   1HG1  ILE  16          HG12      ILE  16   7.447   4.268   4.631
  113   2HG1  ILE  16          HG11      ILE  16   8.285   2.945   5.430
  114   1HG2  ILE  16          HG21      ILE  16  10.698   2.614   5.147
  115   2HG2  ILE  16          HG22      ILE  16  11.040   4.224   5.785
  116   3HG2  ILE  16          HG23      ILE  16  11.659   3.753   4.202
  117   1HD1  ILE  16          HD11      ILE  16   9.285   4.537   6.993
  118   2HD1  ILE  16          HD12      ILE  16   7.525   4.596   7.030
  119   3HD1  ILE  16          HD13      ILE  16   8.432   5.856   6.190
  120    H    LEU  17           HN       LEU  17   9.765   5.494   1.335
  121    HA   LEU  17           HA       LEU  17  12.630   5.326   1.033
  122   1HB   LEU  17          HB2       LEU  17  10.477   5.526  -1.065
  123   2HB   LEU  17          HB1       LEU  17  12.145   5.068  -1.335
  124    HG   LEU  17           HG       LEU  17  10.138   3.498   0.264
  125   1HD1  LEU  17          HD11      LEU  17  10.242   1.906  -1.583
  126   2HD1  LEU  17          HD12      LEU  17  11.290   3.015  -2.470
  127   3HD1  LEU  17          HD13      LEU  17   9.629   3.477  -2.096
  128   1HD2  LEU  17          HD21      LEU  17  12.970   2.819  -0.541
  129   2HD2  LEU  17          HD22      LEU  17  11.845   1.729   0.267
  130   3HD2  LEU  17          HD23      LEU  17  12.417   3.179   1.094
  131    H    GLY  18           HN       GLY  18  10.146   7.695   0.651
  132   1HA   GLY  18          HA2       GLY  18  10.749  10.045   0.877
  133   2HA   GLY  18          HA1       GLY  18  12.200   9.697  -0.054
  134    H    ILE  19           HN       ILE  19   9.058   8.392  -0.877
  135    HA   ILE  19           HA       ILE  19   8.910  10.240  -3.088
  136    HB   ILE  19           HB       ILE  19   7.958   8.168  -4.330
  137   1HG1  ILE  19          HG12      ILE  19   9.940   6.873  -2.451
  138   2HG1  ILE  19          HG11      ILE  19   8.216   6.541  -2.559
  139   1HG2  ILE  19          HG21      ILE  19  10.885   8.776  -4.071
  140   2HG2  ILE  19          HG22      ILE  19   9.696   9.517  -5.163
  141   3HG2  ILE  19          HG23      ILE  19  10.161   7.826  -5.380
  142   1HD1  ILE  19          HD11      ILE  19   9.521   4.789  -3.616
  143   2HD1  ILE  19          HD12      ILE  19  10.270   5.970  -4.689
  144   3HD1  ILE  19          HD13      ILE  19   8.542   5.637  -4.812
  145    H    ARG  20           HN       ARG  20   6.867  10.182  -4.156
  146    HA   ARG  20           HA       ARG  20   4.516   9.148  -2.924
  147   1HB   ARG  20          HB2       ARG  20   4.963  10.969  -1.323
  148   2HB   ARG  20          HB1       ARG  20   5.091  12.110  -2.652
  149   1HG   ARG  20          HG2       ARG  20   2.695  11.498  -3.220
  150   2HG   ARG  20          HG1       ARG  20   2.637  10.703  -1.644
  151   1HD   ARG  20          HD2       ARG  20   1.788  12.999  -1.532
  152   2HD   ARG  20          HD1       ARG  20   3.244  12.794  -0.550
  153    HE   ARG  20           HE       ARG  20   3.719  13.689  -3.241
  154   1HH1  ARG  20          HH11      ARG  20   2.938  14.843   0.005
  155   2HH1  ARG  20          HH12      ARG  20   3.761  16.320  -0.172
  156   1HH2  ARG  20          HH21      ARG  20   4.920  15.622  -3.472
  157   2HH2  ARG  20          HH22      ARG  20   5.010  16.742  -2.169
  158    H    ASP  21           HN       ASP  21   5.919  11.772  -4.793
  159    HA   ASP  21           HA       ASP  21   3.665  11.934  -6.523
  160   1HB   ASP  21          HB2       ASP  21   6.348  13.303  -6.741
  161   2HB   ASP  21          HB1       ASP  21   4.956  13.643  -7.767
  162    H    LEU  22           HN       LEU  22   6.864  10.547  -6.812
  163    HA   LEU  22           HA       LEU  22   7.693   8.957  -8.232
  164   1HB   LEU  22          HB2       LEU  22   4.745   8.449  -8.522
  165   2HB   LEU  22          HB1       LEU  22   5.881   7.585  -9.523
  166    HG   LEU  22           HG       LEU  22   5.141   6.249  -7.626
  167   1HD1  LEU  22          HD11      LEU  22   7.318   5.577  -6.770
  168   2HD1  LEU  22          HD12      LEU  22   8.018   7.047  -7.462
  169   3HD1  LEU  22          HD13      LEU  22   7.312   5.829  -8.517
  170   1HD2  LEU  22          HD21      LEU  22   4.719   8.005  -5.997
  171   2HD2  LEU  22          HD22      LEU  22   6.446   8.340  -5.894
  172   3HD2  LEU  22          HD23      LEU  22   5.813   6.789  -5.340
  173    H    ALA  23           HN       ALA  23   7.371  11.661  -9.212
  174    HA   ALA  23           HA       ALA  23   6.368  11.486 -11.893
  175   1HB   ALA  23          HB1       ALA  23   6.929  13.850 -12.061
  176   2HB   ALA  23          HB2       ALA  23   7.804  13.764 -10.533
  177   3HB   ALA  23          HB3       ALA  23   6.056  13.515 -10.568
  178    H    GLY  24           HN       GLY  24   9.105  10.412 -10.625
  179   1HA   GLY  24          HA2       GLY  24  10.337  10.115 -13.166
  180   2HA   GLY  24          HA1       GLY  24  11.252  11.221 -12.133
  181    H    ILE  25           HN       ILE  25   9.394   8.346 -11.362
  182    HA   ILE  25           HA       ILE  25  11.828   7.049 -10.356
  183    HB   ILE  25           HB       ILE  25   9.105   7.008  -9.002
  184   1HG1  ILE  25          HG12      ILE  25  10.207   9.250  -8.791
  185   2HG1  ILE  25          HG11      ILE  25   9.942   8.437  -7.255
  186   1HG2  ILE  25          HG21      ILE  25  10.265   5.927  -7.122
  187   2HG2  ILE  25          HG22      ILE  25  11.761   5.930  -8.059
  188   3HG2  ILE  25          HG23      ILE  25  10.379   4.983  -8.609
  189   1HD1  ILE  25          HD11      ILE  25  12.561   8.606  -8.740
  190   2HD1  ILE  25          HD12      ILE  25  12.276   7.806  -7.184
  191   3HD1  ILE  25          HD13      ILE  25  12.089   9.550  -7.318
  192    H    ASN  26           HN       ASN  26  11.749   4.804 -10.682
  193    HA   ASN  26           HA       ASN  26  10.085   3.792 -12.745
  194   1HB   ASN  26          HB2       ASN  26  11.974   2.451 -10.828
  195   2HB   ASN  26          HB1       ASN  26  10.972   1.510 -11.918
  196   1HD2  ASN  26          HD21      ASN  26  11.486   1.429 -14.057
  197   2HD2  ASN  26          HD22      ASN  26  12.951   2.082 -14.702
  198    H    LEU  27           HN       LEU  27   8.201   2.842 -12.725
  199    HA   LEU  27           HA       LEU  27   6.808   2.394 -10.152
  200   1HB   LEU  27          HB2       LEU  27   5.669   2.433 -12.951
  201   2HB   LEU  27          HB1       LEU  27   4.777   2.504 -11.447
  202    HG   LEU  27           HG       LEU  27   6.535   4.673 -12.584
  203   1HD1  LEU  27          HD11      LEU  27   3.551   4.500 -12.262
  204   2HD1  LEU  27          HD12      LEU  27   4.447   4.419 -13.778
  205   3HD1  LEU  27          HD13      LEU  27   4.447   5.908 -12.828
  206   1HD2  LEU  27          HD21      LEU  27   4.855   4.662 -10.079
  207   2HD2  LEU  27          HD22      LEU  27   5.723   6.050 -10.738
  208   3HD2  LEU  27          HD23      LEU  27   6.617   4.651 -10.142
  209    H    ASP  28           HN       ASP  28   8.697   0.825 -12.122
  210    HA   ASP  28           HA       ASP  28   7.194  -1.697 -12.105
  211   1HB   ASP  28          HB2       ASP  28   8.629  -2.419 -13.953
  212   2HB   ASP  28          HB1       ASP  28   7.810  -0.917 -14.356
  213    H    SER  29           HN       SER  29   9.225  -0.143 -10.247
  214    HA   SER  29           HA       SER  29  11.089  -2.309  -9.828
  215   1HB   SER  29          HB2       SER  29  10.880   0.443  -8.615
  216   2HB   SER  29          HB1       SER  29  12.119  -0.731  -8.172
  217    HG   SER  29           HG       SER  29  12.625  -0.795 -10.461
  218    H    SER  30           HN       SER  30  10.909  -3.697  -8.283
  219    HA   SER  30           HA       SER  30   8.483  -3.853  -6.763
  220   1HB   SER  30          HB2       SER  30  10.938  -5.557  -7.055
  221   2HB   SER  30          HB1       SER  30   9.541  -6.050  -6.123
  222    HG   SER  30           HG       SER  30   9.810  -5.601  -8.907
  223    H    LEU  31           HN       LEU  31   8.600  -4.136  -4.403
  224    HA   LEU  31           HA       LEU  31  10.321  -2.310  -3.134
  225   1HB   LEU  31          HB2       LEU  31   8.701  -4.549  -1.884
  226   2HB   LEU  31          HB1       LEU  31   9.472  -3.259  -0.984
  227    HG   LEU  31           HG       LEU  31   7.203  -2.933  -2.959
  228   1HD1  LEU  31          HD11      LEU  31   7.270  -2.659   0.034
  229   2HD1  LEU  31          HD12      LEU  31   6.495  -3.956  -0.878
  230   3HD1  LEU  31          HD13      LEU  31   5.895  -2.303  -1.008
  231   1HD2  LEU  31          HD21      LEU  31   8.572  -0.910  -1.214
  232   2HD2  LEU  31          HD22      LEU  31   7.127  -0.630  -2.196
  233   3HD2  LEU  31          HD23      LEU  31   8.670  -1.009  -2.974
  234    H    ALA  32           HN       ALA  32  10.739  -5.613  -3.958
  235    HA   ALA  32           HA       ALA  32  12.936  -6.212  -2.291
  236   1HB   ALA  32          HB1       ALA  32  11.796  -7.946  -3.596
  237   2HB   ALA  32          HB2       ALA  32  13.515  -7.912  -3.979
  238   3HB   ALA  32          HB3       ALA  32  12.350  -7.194  -5.092
  239    H    ASP  33           HN       ASP  33  12.571  -4.445  -5.294
  240    HA   ASP  33           HA       ASP  33  15.325  -4.194  -5.867
  241   1HB   ASP  33          HB2       ASP  33  12.955  -2.577  -6.845
  242   2HB   ASP  33          HB1       ASP  33  14.593  -2.303  -7.398
  243    H    LEU  34           HN       LEU  34  13.007  -2.538  -3.911
  244    HA   LEU  34           HA       LEU  34  14.702  -0.221  -3.601
  245   1HB   LEU  34          HB2       LEU  34  12.060  -0.836  -2.260
  246   2HB   LEU  34          HB1       LEU  34  12.973   0.632  -2.002
  247    HG   LEU  34           HG       LEU  34  11.747   1.566  -3.609
  248   1HD1  LEU  34          HD11      LEU  34  13.685   1.189  -4.991
  249   2HD1  LEU  34          HD12      LEU  34  12.177   1.127  -5.931
  250   3HD1  LEU  34          HD13      LEU  34  12.985  -0.373  -5.451
  251   1HD2  LEU  34          HD21      LEU  34  10.820  -1.166  -4.415
  252   2HD2  LEU  34          HD22      LEU  34  10.144   0.360  -4.990
  253   3HD2  LEU  34          HD23      LEU  34  10.024  -0.075  -3.284
  254    H    GLY  35           HN       GLY  35  14.583  -3.209  -2.236
  255   1HA   GLY  35          HA2       GLY  35  16.300  -3.921  -0.790
  256   2HA   GLY  35          HA1       GLY  35  16.444  -2.281  -0.197
  257    H    LEU  36           HN       LEU  36  13.300  -3.772  -0.364
  258    HA   LEU  36           HA       LEU  36  13.034  -3.550   2.462
  259   1HB   LEU  36          HB2       LEU  36  11.123  -3.068   1.138
  260   2HB   LEU  36          HB1       LEU  36  11.152  -4.566   0.297
  261    HG   LEU  36           HG       LEU  36  10.425  -4.306   3.220
  262   1HD1  LEU  36          HD11      LEU  36   8.125  -4.424   2.431
  263   2HD1  LEU  36          HD12      LEU  36   8.706  -4.446   0.766
  264   3HD1  LEU  36          HD13      LEU  36   8.947  -3.009   1.765
  265   1HD2  LEU  36          HD21      LEU  36   9.878  -6.506   1.211
  266   2HD2  LEU  36          HD22      LEU  36   9.342  -6.476   2.893
  267   3HD2  LEU  36          HD23      LEU  36  11.061  -6.598   2.515
  268    H    ASP  37           HN       ASP  37  13.889  -4.864   3.836
  269    HA   ASP  37           HA       ASP  37  13.631  -7.750   3.382
  270   1HB   ASP  37          HB2       ASP  37  15.872  -8.267   4.049
  271   2HB   ASP  37          HB1       ASP  37  15.996  -7.022   2.818
  272    H    SER  38           HN       SER  38  14.256  -5.168   5.772
  273    HA   SER  38           HA       SER  38  13.251  -7.049   7.745
  274   1HB   SER  38          HB2       SER  38  14.725  -5.550   9.324
  275   2HB   SER  38          HB1       SER  38  15.413  -6.891   8.399
  276    HG   SER  38           HG       SER  38  16.262  -5.549   6.981
  277    H    LEU  39           HN       LEU  39  13.888  -3.590   8.271
  278    HA   LEU  39           HA       LEU  39  11.476  -3.259   9.709
  279   1HB   LEU  39          HB2       LEU  39  13.407  -1.730   9.946
  280   2HB   LEU  39          HB1       LEU  39  13.081  -1.100   8.340
  281    HG   LEU  39           HG       LEU  39  10.771  -0.519   9.213
  282   1HD1  LEU  39          HD11      LEU  39  10.757  -1.843  11.205
  283   2HD1  LEU  39          HD12      LEU  39  10.565  -0.138  11.612
  284   3HD1  LEU  39          HD13      LEU  39  12.117  -0.933  11.861
  285   1HD2  LEU  39          HD21      LEU  39  12.448   1.132   8.724
  286   2HD2  LEU  39          HD22      LEU  39  13.143   0.952  10.350
  287   3HD2  LEU  39          HD23      LEU  39  11.492   1.572  10.136
  288    H    MET  40           HN       MET  40  12.357  -2.707   6.428
  289    HA   MET  40           HA       MET  40   9.994  -1.410   5.505
  290   1HB   MET  40          HB2       MET  40  11.984  -3.119   4.037
  291   2HB   MET  40          HB1       MET  40  10.726  -2.127   3.308
  292   1HG   MET  40          HG2       MET  40  11.742  -0.120   4.213
  293   2HG   MET  40          HG1       MET  40  12.997  -1.089   4.983
  294   1HE   MET  40          HE1       MET  40  14.925   0.726   2.094
  295   2HE   MET  40          HE2       MET  40  14.866   0.415   3.830
  296   3HE   MET  40          HE3       MET  40  13.608   1.384   3.063
  297    H    GLY  41           HN       GLY  41  10.677  -4.758   6.160
  298   1HA   GLY  41          HA2       GLY  41   8.238  -5.566   4.816
  299   2HA   GLY  41          HA1       GLY  41   9.351  -6.607   5.699
  300    H    VAL  42           HN       VAL  42   9.130  -4.374   7.858
  301    HA   VAL  42           HA       VAL  42   6.924  -5.695   9.239
  302    HB   VAL  42           HB       VAL  42   8.985  -3.754  10.344
  303   1HG1  VAL  42          HG11      VAL  42   6.921  -3.698  11.629
  304   2HG1  VAL  42          HG12      VAL  42   8.204  -4.476  12.558
  305   3HG1  VAL  42          HG13      VAL  42   6.954  -5.453  11.789
  306   1HG2  VAL  42          HG21      VAL  42   8.821  -6.751  10.618
  307   2HG2  VAL  42          HG22      VAL  42   9.982  -5.708  11.440
  308   3HG2  VAL  42          HG23      VAL  42  10.018  -5.856   9.682
  309    H    GLU  43           HN       GLU  43   7.968  -2.351   8.473
  310    HA   GLU  43           HA       GLU  43   5.677  -1.361   9.730
  311   1HB   GLU  43          HB2       GLU  43   7.727   0.025   9.348
  312   2HB   GLU  43          HB1       GLU  43   7.219   0.208   7.667
  313   1HG   GLU  43          HG2       GLU  43   5.250   1.357   8.267
  314   2HG   GLU  43          HG1       GLU  43   5.428   0.927   9.962
  315    H    VAL  44           HN       VAL  44   6.224  -2.416   6.488
  316    HA   VAL  44           HA       VAL  44   3.833  -1.405   5.308
  317    HB   VAL  44           HB       VAL  44   5.440  -3.912   4.648
  318   1HG1  VAL  44          HG11      VAL  44   4.260  -3.933   2.507
  319   2HG1  VAL  44          HG12      VAL  44   3.242  -2.593   3.055
  320   3HG1  VAL  44          HG13      VAL  44   3.150  -4.163   3.862
  321   1HG2  VAL  44          HG21      VAL  44   6.250  -2.595   2.768
  322   2HG2  VAL  44          HG22      VAL  44   6.653  -1.866   4.321
  323   3HG2  VAL  44          HG23      VAL  44   5.334  -1.197   3.346
  324    H    ARG  45           HN       ARG  45   4.564  -4.243   7.196
  325    HA   ARG  45           HA       ARG  45   1.922  -5.245   6.978
  326   1HB   ARG  45          HB2       ARG  45   4.281  -6.017   8.630
  327   2HB   ARG  45          HB1       ARG  45   2.721  -6.753   8.937
  328   1HG   ARG  45          HG2       ARG  45   2.660  -7.438   6.541
  329   2HG   ARG  45          HG1       ARG  45   4.302  -6.816   6.376
  330   1HD   ARG  45          HD2       ARG  45   3.441  -8.945   8.315
  331   2HD   ARG  45          HD1       ARG  45   4.208  -9.249   6.757
  332    HE   ARG  45           HE       ARG  45   6.082  -7.876   7.649
  333   1HH1  ARG  45          HH11      ARG  45   3.875  -9.430   9.985
  334   2HH1  ARG  45          HH12      ARG  45   5.104  -9.946  11.042
  335   1HH2  ARG  45          HH21      ARG  45   7.840  -8.633   9.133
  336   2HH2  ARG  45          HH22      ARG  45   7.426  -9.465  10.536
  337    H    GLN  46           HN       GLN  46   3.504  -3.047   9.123
  338    HA   GLN  46           HA       GLN  46   1.451  -3.163  11.078
  339   1HB   GLN  46          HB2       GLN  46   3.346  -0.881  10.416
  340   2HB   GLN  46          HB1       GLN  46   2.323  -0.934  11.842
  341   1HG   GLN  46          HG2       GLN  46   3.540  -2.824  12.696
  342   2HG   GLN  46          HG1       GLN  46   4.489  -2.924  11.211
  343   1HE2  GLN  46          HE21      GLN  46   3.971  -1.137  14.180
  344   2HE2  GLN  46          HE22      GLN  46   5.425  -0.208  14.047
  345    H    ILE  47           HN       ILE  47   1.588  -1.919   7.995
  346    HA   ILE  47           HA       ILE  47  -0.717  -0.177   8.334
  347    HB   ILE  47           HB       ILE  47   0.896  -0.881   5.860
  348   1HG1  ILE  47          HG12      ILE  47   0.951   1.633   7.518
  349   2HG1  ILE  47          HG11      ILE  47   2.126   0.316   7.631
  350   1HG2  ILE  47          HG21      ILE  47  -1.365  -0.184   5.318
  351   2HG2  ILE  47          HG22      ILE  47  -0.197   1.051   4.843
  352   3HG2  ILE  47          HG23      ILE  47  -1.166   1.264   6.302
  353   1HD1  ILE  47          HD11      ILE  47   2.976   2.176   6.297
  354   2HD1  ILE  47          HD12      ILE  47   1.612   2.007   5.193
  355   3HD1  ILE  47          HD13      ILE  47   2.802   0.711   5.331
  356    H    LEU  48           HN       LEU  48   0.239  -2.920   6.265
  357    HA   LEU  48           HA       LEU  48  -2.466  -3.359   5.506
  358   1HB   LEU  48          HB2       LEU  48   0.025  -4.955   4.970
  359   2HB   LEU  48          HB1       LEU  48  -1.552  -5.513   4.463
  360    HG   LEU  48           HG       LEU  48  -0.544  -4.527   2.576
  361   1HD1  LEU  48          HD11      LEU  48  -2.025  -2.676   2.031
  362   2HD1  LEU  48          HD12      LEU  48  -2.435  -2.525   3.737
  363   3HD1  LEU  48          HD13      LEU  48  -2.889  -3.989   2.851
  364   1HD2  LEU  48          HD21      LEU  48   1.208  -3.224   3.649
  365   2HD2  LEU  48          HD22      LEU  48   0.011  -2.067   4.230
  366   3HD2  LEU  48          HD23      LEU  48   0.312  -2.230   2.499
  367    H    GLU  49           HN       GLU  49  -0.280  -5.244   7.510
  368    HA   GLU  49           HA       GLU  49  -2.168  -7.247   8.198
  369   1HB   GLU  49          HB2       GLU  49   0.192  -7.720   8.161
  370   2HB   GLU  49          HB1       GLU  49   0.519  -6.444   9.308
  371   1HG   GLU  49          HG2       GLU  49  -0.919  -7.856  10.918
  372   2HG   GLU  49          HG1       GLU  49  -0.639  -9.157   9.759
  373    H    ARG  50           HN       ARG  50  -1.122  -4.283   9.686
  374    HA   ARG  50           HA       ARG  50  -2.540  -5.002  12.117
  375   1HB   ARG  50          HB2       ARG  50  -0.160  -4.208  12.004
  376   2HB   ARG  50          HB1       ARG  50  -0.815  -2.609  11.693
  377   1HG   ARG  50          HG2       ARG  50  -1.595  -2.388  13.854
  378   2HG   ARG  50          HG1       ARG  50  -1.691  -4.141  14.107
  379   1HD   ARG  50          HD2       ARG  50   0.824  -2.486  13.886
  380   2HD   ARG  50          HD1       ARG  50   0.210  -3.284  15.339
  381    HE   ARG  50           HE       ARG  50   0.397  -5.285  13.511
  382   1HH1  ARG  50          HH11      ARG  50   2.772  -3.096  15.007
  383   2HH1  ARG  50          HH12      ARG  50   4.115  -4.064  14.625
  384   1HH2  ARG  50          HH21      ARG  50   2.263  -6.608  12.921
  385   2HH2  ARG  50          HH22      ARG  50   3.810  -6.132  13.439
  386    H    GLU  51           HN       GLU  51  -3.014  -2.761   9.462
  387    HA   GLU  51           HA       GLU  51  -5.156  -1.446  11.035
  388   1HB   GLU  51          HB2       GLU  51  -4.437  -0.829   8.184
  389   2HB   GLU  51          HB1       GLU  51  -5.394   0.132   9.284
  390   1HG   GLU  51          HG2       GLU  51  -3.373   0.595  10.578
  391   2HG   GLU  51          HG1       GLU  51  -2.443  -0.331   9.390
  392    H    HIS  52           HN       HIS  52  -4.625  -2.804   7.877
  393    HA   HIS  52           HA       HIS  52  -7.434  -2.772   7.174
  394   1HB   HIS  52          HB2       HIS  52  -5.079  -3.848   5.623
  395   2HB   HIS  52          HB1       HIS  52  -6.704  -3.545   5.040
  396    HD1  HIS  52           HD1      HIS  52  -3.538  -1.721   5.952
  397    HD2  HIS  52           HD2      HIS  52  -7.285  -1.017   4.299
  398    HE1  HIS  52           HE1      HIS  52  -3.298   0.350   4.642
  399    HE2  HIS  52           HE2      HIS  52  -5.450   0.462   3.342
  400    H    ASP  53           HN       ASP  53  -5.401  -4.955   8.668
  401    HA   ASP  53           HA       ASP  53  -5.219  -7.125   8.992
  402   1HB   ASP  53          HB2       ASP  53  -7.485  -6.930   9.969
  403   2HB   ASP  53          HB1       ASP  53  -8.185  -7.246   8.382
  404    H    LEU  54           HN       LEU  54  -4.081  -6.648   6.907
  405    HA   LEU  54           HA       LEU  54  -4.720  -8.898   5.129
  406   1HB   LEU  54          HB2       LEU  54  -3.609  -6.191   4.412
  407   2HB   LEU  54          HB1       LEU  54  -3.149  -7.591   3.481
  408    HG   LEU  54           HG       LEU  54  -5.572  -7.929   2.939
  409   1HD1  LEU  54          HD11      LEU  54  -6.569  -6.704   4.771
  410   2HD1  LEU  54          HD12      LEU  54  -7.095  -6.066   3.213
  411   3HD1  LEU  54          HD13      LEU  54  -5.877  -5.205   4.157
  412   1HD2  LEU  54          HD21      LEU  54  -4.041  -6.907   1.377
  413   2HD2  LEU  54          HD22      LEU  54  -4.314  -5.326   2.113
  414   3HD2  LEU  54          HD23      LEU  54  -5.630  -6.150   1.274
  415    H    VAL  55           HN       VAL  55  -3.448 -10.401   6.007
  416    HA   VAL  55           HA       VAL  55  -0.780  -9.653   6.791
  417    HB   VAL  55           HB       VAL  55  -2.011 -12.438   6.750
  418   1HG1  VAL  55          HG11      VAL  55  -0.107 -13.082   8.180
  419   2HG1  VAL  55          HG12      VAL  55   0.561 -11.461   8.022
  420   3HG1  VAL  55          HG13      VAL  55   0.442 -12.503   6.609
  421   1HG2  VAL  55          HG21      VAL  55  -1.594 -10.518   9.043
  422   2HG2  VAL  55          HG22      VAL  55  -2.184 -12.174   9.186
  423   3HG2  VAL  55          HG23      VAL  55  -3.142 -10.966   8.329
  424    H    LEU  56           HN       LEU  56  -0.090  -8.908   4.926
  425    HA   LEU  56           HA       LEU  56   0.420 -10.790   2.760
  426   1HB   LEU  56          HB2       LEU  56   0.986  -7.825   2.968
  427   2HB   LEU  56          HB1       LEU  56   1.208  -8.810   1.543
  428    HG   LEU  56           HG       LEU  56  -1.459  -8.180   2.810
  429   1HD1  LEU  56          HD11      LEU  56  -0.160  -7.128   0.302
  430   2HD1  LEU  56          HD12      LEU  56  -0.448  -6.223   1.789
  431   3HD1  LEU  56          HD13      LEU  56  -1.811  -6.795   0.822
  432   1HD2  LEU  56          HD21      LEU  56  -2.406  -9.177   0.791
  433   2HD2  LEU  56          HD22      LEU  56  -1.429 -10.353   1.673
  434   3HD2  LEU  56          HD23      LEU  56  -0.787  -9.581   0.223
  435    HA   PRO  57           HA       PRO  57   4.288 -11.156   5.043
  436   1HB   PRO  57          HB2       PRO  57   4.779 -13.293   3.077
  437   2HB   PRO  57          HB1       PRO  57   4.715 -13.396   4.840
  438   1HG   PRO  57          HG2       PRO  57   2.775 -14.446   3.331
  439   2HG   PRO  57          HG1       PRO  57   2.404 -13.640   4.870
  440   1HD   PRO  57          HD2       PRO  57   2.212 -12.569   2.080
  441   2HD   PRO  57          HD1       PRO  57   1.025 -12.466   3.407
  442    H    ILE  58           HN       ILE  58   6.578 -11.236   4.289
  443    HA   ILE  58           HA       ILE  58   7.119  -9.134   2.508
  444    HB   ILE  58           HB       ILE  58   8.867 -11.188   3.874
  445   1HG1  ILE  58          HG12      ILE  58   9.868  -9.146   4.947
  446   2HG1  ILE  58          HG11      ILE  58   8.664  -8.192   4.100
  447   1HG2  ILE  58          HG21      ILE  58   9.989 -10.876   1.774
  448   2HG2  ILE  58          HG22      ILE  58  10.903 -10.112   3.077
  449   3HG2  ILE  58          HG23      ILE  58   9.940  -9.125   1.977
  450   1HD1  ILE  58          HD11      ILE  58   6.895  -9.349   5.338
  451   2HD1  ILE  58          HD12      ILE  58   8.047  -8.572   6.426
  452   3HD1  ILE  58          HD13      ILE  58   8.113 -10.316   6.168
  453    H    ARG  59           HN       ARG  59   6.734 -12.445   2.042
  454    HA   ARG  59           HA       ARG  59   8.097 -12.745  -0.433
  455   1HB   ARG  59          HB2       ARG  59   5.752 -14.429   0.493
  456   2HB   ARG  59          HB1       ARG  59   6.902 -14.847  -0.760
  457   1HG   ARG  59          HG2       ARG  59   7.685 -16.108   0.980
  458   2HG   ARG  59          HG1       ARG  59   8.631 -14.636   1.213
  459   1HD   ARG  59          HD2       ARG  59   6.871 -13.874   2.846
  460   2HD   ARG  59          HD1       ARG  59   6.113 -15.439   2.660
  461    HE   ARG  59           HE       ARG  59   8.879 -15.412   3.474
  462   1HH1  ARG  59          HH11      ARG  59   5.503 -16.042   4.286
  463   2HH1  ARG  59          HH12      ARG  59   5.776 -16.237   5.961
  464   1HH2  ARG  59          HH21      ARG  59   9.278 -15.756   5.787
  465   2HH2  ARG  59          HH22      ARG  59   7.988 -16.045   6.866
  466    H    GLU  60           HN       GLU  60   4.984 -11.479   0.417
  467    HA   GLU  60           HA       GLU  60   4.129 -11.375  -2.407
  468   1HB   GLU  60          HB2       GLU  60   2.639 -10.514   0.087
  469   2HB   GLU  60          HB1       GLU  60   1.981 -10.645  -1.531
  470   1HG   GLU  60          HG2       GLU  60   2.915 -12.908   0.209
  471   2HG   GLU  60          HG1       GLU  60   1.246 -12.467  -0.140
  472    H    VAL  61           HN       VAL  61   5.003  -9.456   0.354
  473    HA   VAL  61           HA       VAL  61   4.329  -6.954  -0.721
  474    HB   VAL  61           HB       VAL  61   6.229  -7.658   1.540
  475   1HG1  VAL  61          HG11      VAL  61   6.749  -5.437   0.672
  476   2HG1  VAL  61          HG12      VAL  61   6.001  -5.343   2.266
  477   3HG1  VAL  61          HG13      VAL  61   5.051  -4.983   0.821
  478   1HG2  VAL  61          HG21      VAL  61   3.378  -6.699   1.545
  479   2HG2  VAL  61          HG22      VAL  61   4.376  -6.972   2.973
  480   3HG2  VAL  61          HG23      VAL  61   3.935  -8.328   1.933
  481    H    ARG  62           HN       ARG  62   7.272  -8.848  -0.936
  482    HA   ARG  62           HA       ARG  62   8.899  -6.758  -1.754
  483   1HB   ARG  62          HB2       ARG  62   9.164  -9.677  -1.871
  484   2HB   ARG  62          HB1       ARG  62  10.225  -8.749  -2.916
  485   1HG   ARG  62          HG2       ARG  62  10.923  -7.439  -0.931
  486   2HG   ARG  62          HG1       ARG  62   9.952  -8.522   0.066
  487   1HD   ARG  62          HD2       ARG  62  11.274 -10.413  -0.559
  488   2HD   ARG  62          HD1       ARG  62  12.134  -9.453  -1.769
  489    HE   ARG  62           HE       ARG  62  12.647  -8.130   0.512
  490   1HH1  ARG  62          HH11      ARG  62  12.996 -11.560  -0.315
  491   2HH1  ARG  62          HH12      ARG  62  14.334 -11.785   0.718
  492   1HH2  ARG  62          HH21      ARG  62  14.501  -8.442   1.814
  493   2HH2  ARG  62          HH22      ARG  62  15.271  -9.964   1.898
  494    H    GLN  63           HN       GLN  63   6.424  -8.170  -3.601
  495    HA   GLN  63           HA       GLN  63   7.749  -7.244  -6.041
  496   1HB   GLN  63          HB2       GLN  63   6.078  -8.575  -7.378
  497   2HB   GLN  63          HB1       GLN  63   7.151  -9.559  -6.402
  498   1HG   GLN  63          HG2       GLN  63   4.481  -8.835  -5.313
  499   2HG   GLN  63          HG1       GLN  63   4.570 -10.023  -6.607
  500   1HE2  GLN  63          HE21      GLN  63   7.170  -9.767  -4.381
  501   2HE2  GLN  63          HE22      GLN  63   6.809 -11.204  -3.475
  502    H    LEU  64           HN       LEU  64   6.044  -5.967  -3.857
  503    HA   LEU  64           HA       LEU  64   3.994  -4.754  -5.420
  504   1HB   LEU  64          HB2       LEU  64   5.260  -3.811  -2.836
  505   2HB   LEU  64          HB1       LEU  64   3.823  -3.118  -3.555
  506    HG   LEU  64           HG       LEU  64   4.063  -5.928  -2.491
  507   1HD1  LEU  64          HD11      LEU  64   2.573  -5.157  -0.714
  508   2HD1  LEU  64          HD12      LEU  64   2.657  -3.518  -1.363
  509   3HD1  LEU  64          HD13      LEU  64   4.106  -4.288  -0.712
  510   1HD2  LEU  64          HD21      LEU  64   1.626  -6.013  -2.781
  511   2HD2  LEU  64          HD22      LEU  64   2.465  -5.791  -4.317
  512   3HD2  LEU  64          HD23      LEU  64   1.669  -4.421  -3.542
  513    H    THR  65           HN       THR  65   4.343  -3.288  -6.999
  514    HA   THR  65           HA       THR  65   7.009  -2.350  -7.487
  515    HB   THR  65           HB       THR  65   5.899  -1.668  -9.636
  516    HG1  THR  65           HG1      THR  65   3.825  -2.249  -9.917
  517   1HG2  THR  65          HG21      THR  65   7.050  -3.813  -9.316
  518   2HG2  THR  65          HG22      THR  65   5.630  -3.983 -10.374
  519   3HG2  THR  65          HG23      THR  65   5.542  -4.471  -8.672
  520    H    LEU  66           HN       LEU  66   5.932  -1.115  -5.326
  521    HA   LEU  66           HA       LEU  66   5.589   0.835  -4.291
  522   1HB   LEU  66          HB2       LEU  66   7.646   1.345  -5.754
  523   2HB   LEU  66          HB1       LEU  66   6.553   2.246  -6.777
  524    HG   LEU  66           HG       LEU  66   7.846   3.675  -5.207
  525   1HD1  LEU  66          HD11      LEU  66   5.709   4.471  -6.022
  526   2HD1  LEU  66          HD12      LEU  66   5.977   4.999  -4.353
  527   3HD1  LEU  66          HD13      LEU  66   4.892   3.644  -4.700
  528   1HD2  LEU  66          HD21      LEU  66   7.295   3.645  -2.828
  529   2HD2  LEU  66          HD22      LEU  66   8.007   2.114  -3.349
  530   3HD2  LEU  66          HD23      LEU  66   6.265   2.240  -3.089
  531    H    ARG  67           HN       ARG  67   4.504   1.448  -7.639
  532    HA   ARG  67           HA       ARG  67   2.323   2.939  -6.534
  533   1HB   ARG  67          HB2       ARG  67   3.176   2.434  -9.341
  534   2HB   ARG  67          HB1       ARG  67   1.524   2.969  -9.041
  535   1HG   ARG  67          HG2       ARG  67   3.999   4.393  -8.078
  536   2HG   ARG  67          HG1       ARG  67   3.039   4.846  -9.495
  537   1HD   ARG  67          HD2       ARG  67   1.076   5.172  -8.074
  538   2HD   ARG  67          HD1       ARG  67   1.989   4.667  -6.676
  539    HE   ARG  67           HE       ARG  67   3.207   6.649  -6.721
  540   1HH1  ARG  67          HH11      ARG  67   0.755   6.676  -9.290
  541   2HH1  ARG  67          HH12      ARG  67   0.524   8.363  -9.240
  542   1HH2  ARG  67          HH21      ARG  67   2.843   9.014  -6.641
  543   2HH2  ARG  67          HH22      ARG  67   1.764   9.697  -7.735
  544    H    LYS  68           HN       LYS  68   2.822  -0.250  -7.263
  545    HA   LYS  68           HA       LYS  68   0.136  -1.091  -7.501
  546   1HB   LYS  68          HB2       LYS  68   2.131  -2.522  -7.903
  547   2HB   LYS  68          HB1       LYS  68   2.432  -2.548  -6.173
  548   1HG   LYS  68          HG2       LYS  68   0.281  -3.675  -5.818
  549   2HG   LYS  68          HG1       LYS  68   0.000  -3.673  -7.560
  550   1HD   LYS  68          HD2       LYS  68   2.292  -5.044  -6.147
  551   2HD   LYS  68          HD1       LYS  68   0.843  -5.834  -6.750
  552   1HE   LYS  68          HE2       LYS  68   1.417  -5.180  -9.033
  553   2HE   LYS  68          HE1       LYS  68   2.855  -4.350  -8.444
  554   1HZ   LYS  68          HZ1       LYS  68   3.766  -6.426  -7.732
  555   2HZ   LYS  68          HZ2       LYS  68   3.313  -6.587  -9.336
  556   3HZ   LYS  68          HZ3       LYS  68   2.345  -7.242  -8.102
  557    H    LEU  69           HN       LEU  69   2.032   0.109  -4.916
  558    HA   LEU  69           HA       LEU  69   0.556  -0.846  -2.698
  559   1HB   LEU  69          HB2       LEU  69   2.336   1.539  -3.012
  560   2HB   LEU  69          HB1       LEU  69   1.352   1.388  -1.577
  561    HG   LEU  69           HG       LEU  69   3.560   0.645  -1.099
  562   1HD1  LEU  69          HD11      LEU  69   1.794  -0.525   0.017
  563   2HD1  LEU  69          HD12      LEU  69   3.136  -1.624  -0.311
  564   3HD1  LEU  69          HD13      LEU  69   1.682  -1.683  -1.305
  565   1HD2  LEU  69          HD21      LEU  69   4.599  -1.267  -2.221
  566   2HD2  LEU  69          HD22      LEU  69   4.317   0.070  -3.338
  567   3HD2  LEU  69          HD23      LEU  69   3.248  -1.333  -3.353
  568    H    GLN  70           HN       GLN  70  -0.184   1.751  -4.935
  569    HA   GLN  70           HA       GLN  70  -2.298   2.473  -3.106
  570   1HB   GLN  70          HB2       GLN  70  -2.846   4.349  -4.664
  571   2HB   GLN  70          HB1       GLN  70  -1.278   4.431  -3.884
  572   1HG   GLN  70          HG2       GLN  70  -0.178   3.812  -5.852
  573   2HG   GLN  70          HG1       GLN  70  -1.708   3.498  -6.723
  574   1HE2  GLN  70          HE21      GLN  70  -1.412   5.029  -8.279
  575   2HE2  GLN  70          HE22      GLN  70  -1.346   6.731  -7.945
  576    H    GLU  71           HN       GLU  71  -1.963   0.193  -5.231
  577    HA   GLU  71           HA       GLU  71  -4.808   0.204  -5.918
  578   1HB   GLU  71          HB2       GLU  71  -2.636  -1.799  -6.606
  579   2HB   GLU  71          HB1       GLU  71  -4.301  -1.877  -7.157
  580   1HG   GLU  71          HG2       GLU  71  -3.946   0.281  -8.330
  581   2HG   GLU  71          HG1       GLU  71  -2.244   0.189  -7.875
  582    H    MET  72           HN       MET  72  -2.320  -1.410  -4.124
  583    HA   MET  72           HA       MET  72  -4.114  -3.294  -2.825
  584   1HB   MET  72          HB2       MET  72  -1.164  -2.731  -2.433
  585   2HB   MET  72          HB1       MET  72  -2.050  -4.017  -1.629
  586   1HG   MET  72          HG2       MET  72  -1.713  -3.785  -4.611
  587   2HG   MET  72          HG1       MET  72  -0.690  -4.761  -3.566
  588   1HE   MET  72          HE1       MET  72  -2.721  -5.978  -1.481
  589   2HE   MET  72          HE2       MET  72  -1.491  -6.938  -2.304
  590   3HE   MET  72          HE3       MET  72  -3.164  -7.491  -2.271
  591    H    SER  73           HN       SER  73  -3.948  -0.180  -2.491
  592    HA   SER  73           HA       SER  73  -3.146   0.440   0.100
  593   1HB   SER  73          HB2       SER  73  -4.548   2.500  -0.353
  594   2HB   SER  73          HB1       SER  73  -3.292   2.120  -1.515
  595    HG   SER  73           HG       SER  73  -5.747   2.470  -2.265
  596    H    SER  74           HN       SER  74  -5.984  -0.905  -1.176
  597    HA   SER  74           HA       SER  74  -7.782  -1.874  -0.346
  598   1HB   SER  74          HB2       SER  74  -6.432  -1.681   2.350
  599   2HB   SER  74          HB1       SER  74  -7.736  -2.780   1.894
  600    HG   SER  74           HG       SER  74  -5.147  -2.736   0.689
  601    H    LYS  75           HN       LYS  75  -8.917  -0.117  -0.970
  602    HA   LYS  75           HA       LYS  75 -10.263   1.288   1.211
  603   1HB   LYS  75          HB2       LYS  75  -9.250   2.547  -1.362
  604   2HB   LYS  75          HB1       LYS  75 -10.445   3.286  -0.324
  605   1HG   LYS  75          HG2       LYS  75  -8.760   3.460   1.459
  606   2HG   LYS  75          HG1       LYS  75  -7.562   2.727   0.381
  607   1HD   LYS  75          HD2       LYS  75  -7.775   4.550  -1.185
  608   2HD   LYS  75          HD1       LYS  75  -9.105   5.239  -0.263
  609   1HE   LYS  75          HE2       LYS  75  -7.578   5.683   1.599
  610   2HE   LYS  75          HE1       LYS  75  -6.251   4.971   0.677
  611   1HZ   LYS  75          HZ1       LYS  75  -7.817   7.295  -0.297
  612   2HZ   LYS  75          HZ2       LYS  75  -6.285   6.794  -0.856
  613   3HZ   LYS  75          HZ3       LYS  75  -6.461   7.485   0.645
  614    H    ALA  76           HN       ALA  76 -12.204   0.248   0.982
  615    HA   ALA  76           HA       ALA  76 -13.171  -0.440  -1.626
  616   1HB   ALA  76          HB1       ALA  76 -13.763  -1.808   0.318
  617   2HB   ALA  76          HB2       ALA  76 -15.206  -1.154  -0.459
  618   3HB   ALA  76          HB3       ALA  76 -14.600  -0.434   1.035
  619    H    GLY  77           HN       GLY  77 -13.747   1.121  -2.952
  620   1HA   GLY  77          HA2       GLY  77 -14.660   3.686  -2.008
  621   2HA   GLY  77          HA1       GLY  77 -14.448   3.199  -3.680
  622    H    SER  78           HN       SER  78 -16.348   1.205  -1.681
  623    HA   SER  78           HA       SER  78 -18.832   2.420  -2.544
  624   1HB   SER  78          HB2       SER  78 -18.134  -0.515  -2.883
  625   2HB   SER  78          HB1       SER  78 -19.678   0.240  -3.282
  626    HG   SER  78           HG       SER  78 -17.820   1.640  -4.492
  627    H    ASP  79           HN       ASP  79 -20.215   2.454  -0.885
  628    HA   ASP  79           HA       ASP  79 -19.425   1.021   1.573
  629   1HB   ASP  79          HB2       ASP  79 -19.377   3.575   1.516
  630   2HB   ASP  79          HB1       ASP  79 -21.127   3.512   1.371
  631    H    THR  80           HN       THR  80 -22.228   2.324  -0.175
  632    HA   THR  80           HA       THR  80 -24.133   0.794   1.289
  633    HB   THR  80           HB       THR  80 -24.534   2.134  -1.388
  634    HG1  THR  80           HG1      THR  80 -24.860   3.299   1.186
  635   1HG2  THR  80          HG21      THR  80 -26.825   2.427  -0.554
  636   2HG2  THR  80          HG22      THR  80 -26.380   1.613   0.948
  637   3HG2  THR  80          HG23      THR  80 -26.372   0.722  -0.574
  638    H    GLU  81           HN       GLU  81 -22.657   0.555  -1.915
  639    HA   GLU  81           HA       GLU  81 -23.953  -2.048  -2.251
  640   1HB   GLU  81          HB2       GLU  81 -23.711  -1.703  -4.676
  641   2HB   GLU  81          HB1       GLU  81 -24.699  -0.458  -3.928
  642   1HG   GLU  81          HG2       GLU  81 -22.794   1.077  -3.978
  643   2HG   GLU  81          HG1       GLU  81 -21.817  -0.178  -4.737
  644    H    LEU  82           HN       LEU  82 -22.671  -3.565  -3.553
  645    HA   LEU  82           HA       LEU  82 -19.782  -3.231  -3.326
  646   1HB   LEU  82          HB2       LEU  82 -21.362  -5.636  -2.374
  647   2HB   LEU  82          HB1       LEU  82 -19.624  -5.612  -2.554
  648    HG   LEU  82           HG       LEU  82 -21.199  -3.924  -0.602
  649   1HD1  LEU  82          HD11      LEU  82 -20.230  -5.387   1.101
  650   2HD1  LEU  82          HD12      LEU  82 -19.490  -6.367  -0.165
  651   3HD1  LEU  82          HD13      LEU  82 -21.247  -6.288  -0.023
  652   1HD2  LEU  82          HD21      LEU  82 -18.221  -4.299  -0.942
  653   2HD2  LEU  82          HD22      LEU  82 -19.004  -3.400   0.358
  654   3HD2  LEU  82          HD23      LEU  82 -19.131  -2.832  -1.308
  655    H    ALA  83           HN       ALA  83 -19.023  -5.670  -4.378
  656    HA   ALA  83           HA       ALA  83 -19.745  -5.286  -7.110
  657   1HB   ALA  83          HB1       ALA  83 -18.165  -7.093  -7.556
  658   2HB   ALA  83          HB2       ALA  83 -18.062  -7.437  -5.829
  659   3HB   ALA  83          HB3       ALA  83 -17.467  -5.901  -6.461
  660    H    ALA  84           HN       ALA  84 -21.041  -6.488  -8.375
  661    HA   ALA  84           HA       ALA  84 -22.242  -8.921  -7.348
  662   1HB   ALA  84          HB1       ALA  84 -24.490  -8.123  -7.948
  663   2HB   ALA  84          HB2       ALA  84 -23.823  -6.534  -8.326
  664   3HB   ALA  84          HB3       ALA  84 -23.780  -7.138  -6.669
  665    HA   PRO  85           HA       PRO  85 -21.388  -9.915 -11.581
  666   1HB   PRO  85          HB2       PRO  85 -22.825 -12.211 -11.795
  667   2HB   PRO  85          HB1       PRO  85 -21.294 -12.122 -10.913
  668   1HG   PRO  85          HG2       PRO  85 -24.096 -12.036  -9.860
  669   2HG   PRO  85          HG1       PRO  85 -22.692 -12.918  -9.230
  670   1HD   PRO  85          HD2       PRO  85 -23.541 -10.584  -8.158
  671   2HD   PRO  85          HD1       PRO  85 -21.827 -11.047  -8.187
  672    H    LYS  86           HN       LYS  86 -24.354  -9.337 -10.396
  673    HA   LYS  86           HA       LYS  86 -25.683  -9.273 -13.014
  674   1HB   LYS  86          HB2       LYS  86 -26.856  -8.796 -10.261
  675   2HB   LYS  86          HB1       LYS  86 -27.770  -8.826 -11.762
  676   1HG   LYS  86          HG2       LYS  86 -27.140 -11.182 -12.081
  677   2HG   LYS  86          HG1       LYS  86 -26.274 -11.139 -10.543
  678   1HD   LYS  86          HD2       LYS  86 -28.382 -10.574  -9.400
  679   2HD   LYS  86          HD1       LYS  86 -29.228 -10.677 -10.947
  680   1HE   LYS  86          HE2       LYS  86 -28.563 -13.028 -11.145
  681   2HE   LYS  86          HE1       LYS  86 -27.738 -12.920  -9.592
  682   1HZ   LYS  86          HZ1       LYS  86 -29.921 -13.910  -9.349
  683   2HZ   LYS  86          HZ2       LYS  86 -30.656 -12.596 -10.062
  684   3HZ   LYS  86          HZ3       LYS  86 -29.914 -12.430  -8.551
  685    H    SER  87           HN       SER  87 -25.388  -7.508 -14.111
  686    HA   SER  87           HA       SER  87 -24.524  -5.082 -12.872
  687   1HB   SER  87          HB2       SER  87 -25.233  -5.628 -15.756
  688   2HB   SER  87          HB1       SER  87 -24.213  -4.327 -15.133
  689    HG   SER  87           HG       SER  87 -22.980  -6.264 -14.201
  690    H    LYS  88           HN       LYS  88 -27.320  -6.116 -14.812
  691    HA   LYS  88           HA       LYS  88 -28.826  -3.776 -13.807
  692   1HB   LYS  88          HB2       LYS  88 -29.303  -5.195 -16.438
  693   2HB   LYS  88          HB1       LYS  88 -29.983  -3.664 -15.908
  694   1HG   LYS  88          HG2       LYS  88 -27.730  -2.662 -16.027
  695   2HG   LYS  88          HG1       LYS  88 -27.111  -4.195 -16.643
  696   1HD   LYS  88          HD2       LYS  88 -27.483  -2.767 -18.512
  697   2HD   LYS  88          HD1       LYS  88 -28.759  -3.986 -18.524
  698   1HE   LYS  88          HE2       LYS  88 -29.737  -1.848 -19.004
  699   2HE   LYS  88          HE1       LYS  88 -30.254  -2.358 -17.400
  700   1HZ   LYS  88          HZ1       LYS  88 -28.551  -0.866 -16.439
  701   2HZ   LYS  88          HZ2       LYS  88 -29.604   0.001 -17.426
  702   3HZ   LYS  88          HZ3       LYS  88 -28.083  -0.433 -17.987
  703    H    ASN  89           HN       ASN  89 -29.204  -6.905 -15.382
  704    HA   ASN  89           HA       ASN  89 -31.181  -7.715 -13.415
  705   1HB   ASN  89          HB2       ASN  89 -31.339  -8.065 -16.426
  706   2HB   ASN  89          HB1       ASN  89 -32.277  -9.026 -15.299
  707   1HD2  ASN  89          HD21      ASN  89 -34.187  -8.381 -15.970
  708   2HD2  ASN  89          HD22      ASN  89 -34.846  -6.786 -15.825
  Start of MODEL    6
    1   1H    GLY   1          HT1       GLY   1 -18.580   9.785  13.688
    2   2H    GLY   1          HT2       GLY   1 -18.036  11.406  13.774
    3   3H    GLY   1          HT3       GLY   1 -17.010  10.168  13.240
    4   1HA   GLY   1          HA1       GLY   1 -19.477  10.907  11.824
    5   2HA   GLY   1          HA2       GLY   1 -17.877  11.525  11.416
    6    H    ASP   2           HN       ASP   2 -17.655  10.512   9.457
    7    HA   ASP   2           HA       ASP   2 -17.203   7.631   9.610
    8   1HB   ASP   2          HB2       ASP   2 -19.418   7.847   8.571
    9   2HB   ASP   2          HB1       ASP   2 -18.791   9.028   7.425
   10    H    GLY   3           HN       GLY   3 -15.467   6.968   8.337
   11   1HA   GLY   3          HA2       GLY   3 -14.322   8.131   6.234
   12   2HA   GLY   3          HA1       GLY   3 -13.763   9.146   7.554
   13    H    GLU   4           HN       GLU   4 -13.960   5.783   6.525
   14    HA   GLU   4           HA       GLU   4 -11.564   5.241   8.066
   15   1HB   GLU   4          HB2       GLU   4 -13.376   3.499   7.925
   16   2HB   GLU   4          HB1       GLU   4 -13.091   3.396   6.196
   17   1HG   GLU   4          HG2       GLU   4 -12.000   1.550   7.227
   18   2HG   GLU   4          HG1       GLU   4 -10.758   2.671   6.678
   19    H    ALA   5           HN       ALA   5 -10.136   6.483   7.116
   20    HA   ALA   5           HA       ALA   5  -9.723   6.337   4.236
   21   1HB   ALA   5          HB1       ALA   5  -8.442   8.108   6.325
   22   2HB   ALA   5          HB2       ALA   5  -9.776   8.561   5.265
   23   3HB   ALA   5          HB3       ALA   5  -8.185   8.221   4.582
   24    H    GLN   6           HN       GLN   6  -8.582   5.181   7.206
   25    HA   GLN   6           HA       GLN   6  -7.062   3.662   7.847
   26   1HB   GLN   6          HB2       GLN   6  -7.945   2.345   5.972
   27   2HB   GLN   6          HB1       GLN   6  -6.828   3.128   4.875
   28   1HG   GLN   6          HG2       GLN   6  -4.955   2.065   6.044
   29   2HG   GLN   6          HG1       GLN   6  -6.098   1.266   7.128
   30   1HE2  GLN   6          HE21      GLN   6  -4.203   0.087   5.241
   31   2HE2  GLN   6          HE22      GLN   6  -5.146  -0.837   4.123
   32    H    ARG   7           HN       ARG   7  -5.424   4.403   4.856
   33    HA   ARG   7           HA       ARG   7  -3.712   6.417   5.594
   34   1HB   ARG   7          HB2       ARG   7  -2.713   4.736   7.176
   35   2HB   ARG   7          HB1       ARG   7  -2.446   3.651   5.819
   36   1HG   ARG   7          HG2       ARG   7  -0.371   4.737   6.341
   37   2HG   ARG   7          HG1       ARG   7  -0.965   5.374   4.805
   38   1HD   ARG   7          HD2       ARG   7  -1.927   7.308   6.059
   39   2HD   ARG   7          HD1       ARG   7  -1.147   6.690   7.513
   40    HE   ARG   7           HE       ARG   7   0.155   7.859   5.163
   41   1HH1  ARG   7          HH11      ARG   7   0.550   6.434   8.391
   42   2HH1  ARG   7          HH12      ARG   7   2.024   7.237   8.694
   43   1HH2  ARG   7          HH21      ARG   7   2.229   8.947   5.628
   44   2HH2  ARG   7          HH22      ARG   7   2.934   8.716   7.165
   45    H    ASP   8           HN       ASP   8  -2.835   7.062   3.657
   46    HA   ASP   8           HA       ASP   8  -3.198   5.226   1.450
   47   1HB   ASP   8          HB2       ASP   8  -3.723   7.658   1.123
   48   2HB   ASP   8          HB1       ASP   8  -2.010   8.009   1.370
   49    H    LEU   9           HN       LEU   9  -1.713   3.923   0.859
   50    HA   LEU   9           HA       LEU   9   0.623   3.774   2.394
   51   1HB   LEU   9          HB2       LEU   9  -0.428   2.106   0.168
   52   2HB   LEU   9          HB1       LEU   9   1.200   1.853   0.745
   53    HG   LEU   9           HG       LEU   9   0.265   1.427   3.023
   54   1HD1  LEU   9          HD11      LEU   9  -1.798   2.642   2.800
   55   2HD1  LEU   9          HD12      LEU   9  -2.094   0.961   3.279
   56   3HD1  LEU   9          HD13      LEU   9  -2.360   1.476   1.603
   57   1HD2  LEU   9          HD21      LEU   9  -0.582  -0.803   2.507
   58   2HD2  LEU   9          HD22      LEU   9   0.842  -0.403   1.545
   59   3HD2  LEU   9          HD23      LEU   9  -0.762  -0.338   0.815
   60    H    VAL  10           HN       VAL  10   0.116   5.561  -0.438
   61    HA   VAL  10           HA       VAL  10   2.829   5.241  -1.180
   62    HB   VAL  10           HB       VAL  10   0.707   7.133  -2.260
   63   1HG1  VAL  10          HG11      VAL  10   2.917   8.245  -2.426
   64   2HG1  VAL  10          HG12      VAL  10   2.307   7.772  -4.012
   65   3HG1  VAL  10          HG13      VAL  10   3.565   6.815  -3.229
   66   1HG2  VAL  10          HG21      VAL  10   0.490   4.774  -2.840
   67   2HG2  VAL  10          HG22      VAL  10   2.146   4.753  -3.425
   68   3HG2  VAL  10          HG23      VAL  10   0.934   5.728  -4.252
   69    H    LYS  11           HN       LYS  11   0.948   7.504   0.707
   70    HA   LYS  11           HA       LYS  11   3.346   9.108   1.116
   71   1HB   LYS  11          HB2       LYS  11   0.609   9.561   2.374
   72   2HB   LYS  11          HB1       LYS  11   1.998  10.634   2.460
   73   1HG   LYS  11          HG2       LYS  11   0.601  11.623   0.868
   74   2HG   LYS  11          HG1       LYS  11   1.811  10.774  -0.097
   75   1HD   LYS  11          HD2       LYS  11   0.207   8.843  -0.188
   76   2HD   LYS  11          HD1       LYS  11  -0.997   9.909   0.525
   77   1HE   LYS  11          HE2       LYS  11  -0.776  11.420  -1.378
   78   2HE   LYS  11          HE1       LYS  11   0.431  10.341  -2.091
   79   1HZ   LYS  11          HZ1       LYS  11  -2.462   9.836  -1.686
   80   2HZ   LYS  11          HZ2       LYS  11  -1.370   8.588  -1.820
   81   3HZ   LYS  11          HZ3       LYS  11  -1.537   9.659  -3.116
   82    H    ALA  12           HN       ALA  12   2.689   6.337   2.029
   83    HA   ALA  12           HA       ALA  12   3.607   6.666   4.797
   84   1HB   ALA  12          HB1       ALA  12   1.399   5.594   4.703
   85   2HB   ALA  12          HB2       ALA  12   2.622   4.474   5.299
   86   3HB   ALA  12          HB3       ALA  12   2.047   4.349   3.639
   87    H    VAL  13           HN       VAL  13   3.612   4.098   2.313
   88    HA   VAL  13           HA       VAL  13   6.076   3.018   3.226
   89    HB   VAL  13           HB       VAL  13   4.469   2.433   0.728
   90   1HG1  VAL  13          HG11      VAL  13   6.753   0.873   1.944
   91   2HG1  VAL  13          HG12      VAL  13   6.759   1.751   0.409
   92   3HG1  VAL  13          HG13      VAL  13   5.733   0.330   0.605
   93   1HG2  VAL  13          HG21      VAL  13   3.241   1.963   2.773
   94   2HG2  VAL  13          HG22      VAL  13   4.591   1.009   3.388
   95   3HG2  VAL  13          HG23      VAL  13   3.692   0.459   1.973
   96    H    ALA  14           HN       ALA  14   5.112   4.776   0.292
   97    HA   ALA  14           HA       ALA  14   7.727   4.799  -0.785
   98   1HB   ALA  14          HB1       ALA  14   5.722   5.161  -2.153
   99   2HB   ALA  14          HB2       ALA  14   6.905   6.449  -2.370
  100   3HB   ALA  14          HB3       ALA  14   5.465   6.721  -1.371
  101    H    HIS  15           HN       HIS  15   6.047   6.768   1.456
  102    HA   HIS  15           HA       HIS  15   7.828   8.979   1.455
  103   1HB   HIS  15          HB2       HIS  15   5.482   9.071   2.287
  104   2HB   HIS  15          HB1       HIS  15   5.947   8.054   3.640
  105    HD1  HIS  15           HD1      HIS  15   6.503   9.290   5.714
  106    HD2  HIS  15           HD2      HIS  15   7.030  11.638   2.322
  107    HE1  HIS  15           HE1      HIS  15   7.067  11.557   6.550
  108    HE2  HIS  15           HE2      HIS  15   7.253  12.999   4.518
  109    H    ILE  16           HN       ILE  16   8.030   5.812   2.802
  110    HA   ILE  16           HA       ILE  16   9.945   6.340   4.857
  111    HB   ILE  16           HB       ILE  16   9.376   3.795   3.289
  112   1HG1  ILE  16          HG12      ILE  16   7.453   4.480   4.595
  113   2HG1  ILE  16          HG11      ILE  16   8.171   3.044   5.310
  114   1HG2  ILE  16          HG21      ILE  16  10.539   2.551   5.051
  115   2HG2  ILE  16          HG22      ILE  16  11.031   4.077   5.789
  116   3HG2  ILE  16          HG23      ILE  16  11.610   3.646   4.177
  117   1HD1  ILE  16          HD11      ILE  16   8.500   5.872   6.289
  118   2HD1  ILE  16          HD12      ILE  16   9.229   4.439   7.017
  119   3HD1  ILE  16          HD13      ILE  16   7.478   4.630   7.011
  120    H    LEU  17           HN       LEU  17  10.064   5.615   1.451
  121    HA   LEU  17           HA       LEU  17  12.960   5.493   1.403
  122   1HB   LEU  17          HB2       LEU  17  10.978   5.430  -0.873
  123   2HB   LEU  17          HB1       LEU  17  12.698   5.142  -1.018
  124    HG   LEU  17           HG       LEU  17  10.735   3.415   0.488
  125   1HD1  LEU  17          HD11      LEU  17  10.473   3.241  -1.918
  126   2HD1  LEU  17          HD12      LEU  17  11.188   1.770  -1.258
  127   3HD1  LEU  17          HD13      LEU  17  12.201   2.941  -2.098
  128   1HD2  LEU  17          HD21      LEU  17  12.930   3.393   1.546
  129   2HD2  LEU  17          HD22      LEU  17  13.687   3.043  -0.008
  130   3HD2  LEU  17          HD23      LEU  17  12.613   1.857   0.738
  131    H    GLY  18           HN       GLY  18  10.402   7.686   0.553
  132   1HA   GLY  18          HA2       GLY  18  10.872  10.079   0.779
  133   2HA   GLY  18          HA1       GLY  18  12.428   9.772   0.020
  134    H    ILE  19           HN       ILE  19   9.468   8.281  -1.053
  135    HA   ILE  19           HA       ILE  19   9.522   9.964  -3.417
  136    HB   ILE  19           HB       ILE  19   8.479   7.769  -4.471
  137   1HG1  ILE  19          HG12      ILE  19  10.385   6.689  -2.386
  138   2HG1  ILE  19          HG11      ILE  19   8.665   6.359  -2.516
  139   1HG2  ILE  19          HG21      ILE  19  10.684   7.269  -5.456
  140   2HG2  ILE  19          HG22      ILE  19  11.445   8.295  -4.241
  141   3HG2  ILE  19          HG23      ILE  19  10.322   8.991  -5.420
  142   1HD1  ILE  19          HD11      ILE  19   9.988   4.481  -3.294
  143   2HD1  ILE  19          HD12      ILE  19  10.786   5.514  -4.481
  144   3HD1  ILE  19          HD13      ILE  19   9.060   5.179  -4.622
  145    H    ARG  20           HN       ARG  20   7.555   9.997  -4.594
  146    HA   ARG  20           HA       ARG  20   5.020   9.312  -3.443
  147   1HB   ARG  20          HB2       ARG  20   5.602  11.131  -1.917
  148   2HB   ARG  20          HB1       ARG  20   5.979  12.175  -3.276
  149   1HG   ARG  20          HG2       ARG  20   3.556  11.910  -3.961
  150   2HG   ARG  20          HG1       ARG  20   3.296  11.208  -2.358
  151   1HD   ARG  20          HD2       ARG  20   2.837  13.605  -2.376
  152   2HD   ARG  20          HD1       ARG  20   4.201  13.211  -1.321
  153    HE   ARG  20           HE       ARG  20   5.172  13.799  -3.876
  154   1HH1  ARG  20          HH11      ARG  20   3.680  15.504  -1.169
  155   2HH1  ARG  20          HH12      ARG  20   4.409  16.999  -1.522
  156   1HH2  ARG  20          HH21      ARG  20   6.191  15.753  -4.363
  157   2HH2  ARG  20          HH22      ARG  20   5.969  17.144  -3.411
  158    H    ASP  21           HN       ASP  21   6.780  11.672  -5.375
  159    HA   ASP  21           HA       ASP  21   4.746  11.776  -7.433
  160   1HB   ASP  21          HB2       ASP  21   7.512  13.021  -7.332
  161   2HB   ASP  21          HB1       ASP  21   6.359  13.267  -8.632
  162    H    LEU  22           HN       LEU  22   7.775  10.150  -6.942
  163    HA   LEU  22           HA       LEU  22   8.734   8.390  -8.010
  164   1HB   LEU  22          HB2       LEU  22   5.942   8.077  -9.119
  165   2HB   LEU  22          HB1       LEU  22   7.239   7.008  -9.587
  166    HG   LEU  22           HG       LEU  22   5.953   5.900  -7.970
  167   1HD1  LEU  22          HD11      LEU  22   7.529   5.504  -6.167
  168   2HD1  LEU  22          HD12      LEU  22   8.437   6.933  -6.667
  169   3HD1  LEU  22          HD13      LEU  22   8.298   5.549  -7.751
  170   1HD2  LEU  22          HD21      LEU  22   5.536   6.739  -5.720
  171   2HD2  LEU  22          HD22      LEU  22   4.797   7.757  -6.954
  172   3HD2  LEU  22          HD23      LEU  22   6.284   8.272  -6.160
  173    H    ALA  23           HN       ALA  23   9.125  10.895  -9.058
  174    HA   ALA  23           HA       ALA  23   8.745  10.781 -11.871
  175   1HB   ALA  23          HB1       ALA  23   8.625  12.917 -10.721
  176   2HB   ALA  23          HB2       ALA  23   9.901  12.941 -11.940
  177   3HB   ALA  23          HB3       ALA  23  10.313  12.764 -10.235
  178    H    GLY  24           HN       GLY  24  10.914   9.545  -9.787
  179   1HA   GLY  24          HA2       GLY  24  12.829   8.956 -11.936
  180   2HA   GLY  24          HA1       GLY  24  13.428   9.602 -10.410
  181    H    ILE  25           HN       ILE  25  10.723   7.412 -10.578
  182    HA   ILE  25           HA       ILE  25  12.395   5.162  -9.822
  183    HB   ILE  25           HB       ILE  25   9.922   6.077  -8.294
  184   1HG1  ILE  25          HG12      ILE  25  12.036   7.224  -7.634
  185   2HG1  ILE  25          HG11      ILE  25  11.307   6.292  -6.338
  186   1HG2  ILE  25          HG21      ILE  25   9.859   3.672  -8.554
  187   2HG2  ILE  25          HG22      ILE  25  10.213   4.085  -6.876
  188   3HG2  ILE  25          HG23      ILE  25  11.508   3.535  -7.941
  189   1HD1  ILE  25          HD11      ILE  25  12.925   4.516  -6.712
  190   2HD1  ILE  25          HD12      ILE  25  13.699   6.053  -6.332
  191   3HD1  ILE  25          HD13      ILE  25  13.679   5.463  -8.003
  192    H    ASN  26           HN       ASN  26  11.618   3.367 -10.757
  193    HA   ASN  26           HA       ASN  26   9.458   3.821 -12.650
  194   1HB   ASN  26          HB2       ASN  26  11.276   1.415 -12.373
  195   2HB   ASN  26          HB1       ASN  26  10.017   1.579 -13.588
  196   1HD2  ASN  26          HD21      ASN  26  13.158   2.509 -12.598
  197   2HD2  ASN  26          HD22      ASN  26  13.623   3.328 -14.047
  198    H    LEU  27           HN       LEU  27   7.630   2.567 -12.800
  199    HA   LEU  27           HA       LEU  27   6.780   1.610 -10.176
  200   1HB   LEU  27          HB2       LEU  27   5.174   2.315 -12.633
  201   2HB   LEU  27          HB1       LEU  27   4.529   1.960 -11.037
  202    HG   LEU  27           HG       LEU  27   6.274   4.316 -11.733
  203   1HD1  LEU  27          HD11      LEU  27   4.323   5.666 -11.324
  204   2HD1  LEU  27          HD12      LEU  27   3.340   4.217 -11.091
  205   3HD1  LEU  27          HD13      LEU  27   4.060   4.558 -12.672
  206   1HD2  LEU  27          HD21      LEU  27   6.641   3.543  -9.454
  207   2HD2  LEU  27          HD22      LEU  27   4.901   3.605  -9.151
  208   3HD2  LEU  27          HD23      LEU  27   5.790   5.089  -9.473
  209    H    ASP  28           HN       ASP  28   8.310   0.359 -12.482
  210    HA   ASP  28           HA       ASP  28   6.776  -2.146 -12.710
  211   1HB   ASP  28          HB2       ASP  28   9.188  -1.247 -14.314
  212   2HB   ASP  28          HB1       ASP  28   8.255  -2.713 -14.572
  213    H    SER  29           HN       SER  29   9.004  -0.643 -10.889
  214    HA   SER  29           HA       SER  29  10.941  -2.755 -10.684
  215   1HB   SER  29          HB2       SER  29  10.669  -0.165  -9.144
  216   2HB   SER  29          HB1       SER  29  12.076  -1.226  -9.182
  217    HG   SER  29           HG       SER  29  11.894  -0.821 -11.597
  218    H    SER  30           HN       SER  30  10.959  -4.194  -9.122
  219    HA   SER  30           HA       SER  30   8.753  -4.602  -7.391
  220   1HB   SER  30          HB2       SER  30  11.501  -5.797  -7.606
  221   2HB   SER  30          HB1       SER  30  10.298  -6.432  -6.501
  222    HG   SER  30           HG       SER  30   8.972  -6.423  -8.676
  223    H    LEU  31           HN       LEU  31   8.773  -4.465  -5.061
  224    HA   LEU  31           HA       LEU  31   9.880  -2.113  -4.009
  225   1HB   LEU  31          HB2       LEU  31   7.828  -3.208  -3.141
  226   2HB   LEU  31          HB1       LEU  31   8.814  -4.497  -2.487
  227    HG   LEU  31           HG       LEU  31   9.859  -2.916  -0.916
  228   1HD1  LEU  31          HD11      LEU  31   8.980  -0.663  -0.700
  229   2HD1  LEU  31          HD12      LEU  31   7.962  -0.944  -2.130
  230   3HD1  LEU  31          HD13      LEU  31   9.721  -0.934  -2.287
  231   1HD2  LEU  31          HD21      LEU  31   7.840  -4.092  -0.238
  232   2HD2  LEU  31          HD22      LEU  31   6.854  -2.792  -0.902
  233   3HD2  LEU  31          HD23      LEU  31   7.915  -2.481   0.475
  234    H    ALA  32           HN       ALA  32  11.066  -5.317  -4.117
  235    HA   ALA  32           HA       ALA  32  13.012  -4.949  -2.127
  236   1HB   ALA  32          HB1       ALA  32  14.081  -6.999  -2.989
  237   2HB   ALA  32          HB2       ALA  32  13.012  -6.942  -4.394
  238   3HB   ALA  32          HB3       ALA  32  12.342  -7.186  -2.779
  239    H    ASP  33           HN       ASP  33  12.871  -4.196  -5.518
  240    HA   ASP  33           HA       ASP  33  15.678  -3.713  -5.738
  241   1HB   ASP  33          HB2       ASP  33  13.399  -3.138  -7.624
  242   2HB   ASP  33          HB1       ASP  33  15.062  -2.678  -7.957
  243    H    LEU  34           HN       LEU  34  12.908  -2.069  -4.770
  244    HA   LEU  34           HA       LEU  34  13.744   0.610  -5.296
  245   1HB   LEU  34          HB2       LEU  34  11.728  -0.380  -3.289
  246   2HB   LEU  34          HB1       LEU  34  11.879   1.259  -3.890
  247    HG   LEU  34           HG       LEU  34  11.060  -1.140  -5.514
  248   1HD1  LEU  34          HD11      LEU  34   9.434  -0.490  -3.896
  249   2HD1  LEU  34          HD12      LEU  34   8.873  -0.136  -5.532
  250   3HD1  LEU  34          HD13      LEU  34   9.447   1.176  -4.484
  251   1HD2  LEU  34          HD21      LEU  34  12.234   0.508  -6.848
  252   2HD2  LEU  34          HD22      LEU  34  11.148   1.774  -6.249
  253   3HD2  LEU  34          HD23      LEU  34  10.515   0.447  -7.236
  254    H    GLY  35           HN       GLY  35  13.455  -1.277  -2.310
  255   1HA   GLY  35          HA2       GLY  35  15.856  -0.883  -1.168
  256   2HA   GLY  35          HA1       GLY  35  15.113   0.690  -0.941
  257    H    LEU  36           HN       LEU  36  13.902  -2.615  -0.679
  258    HA   LEU  36           HA       LEU  36  12.870  -1.836   1.902
  259   1HB   LEU  36          HB2       LEU  36  11.059  -2.799   1.207
  260   2HB   LEU  36          HB1       LEU  36  11.769  -3.546  -0.166
  261    HG   LEU  36           HG       LEU  36  12.401  -5.469   1.434
  262   1HD1  LEU  36          HD11      LEU  36  12.176  -4.263   3.544
  263   2HD1  LEU  36          HD12      LEU  36  11.096  -5.657   3.485
  264   3HD1  LEU  36          HD13      LEU  36  10.455  -4.034   3.237
  265   1HD2  LEU  36          HD21      LEU  36  10.577  -5.579  -0.153
  266   2HD2  LEU  36          HD22      LEU  36   9.515  -4.793   1.012
  267   3HD2  LEU  36          HD23      LEU  36  10.166  -6.402   1.360
  268    H    ASP  37           HN       ASP  37  14.063  -2.049   3.458
  269    HA   ASP  37           HA       ASP  37  15.904  -4.302   3.697
  270   1HB   ASP  37          HB2       ASP  37  16.921  -2.171   4.148
  271   2HB   ASP  37          HB1       ASP  37  15.622  -1.719   5.243
  272    H    SER  38           HN       SER  38  13.931  -2.554   6.076
  273    HA   SER  38           HA       SER  38  12.824  -5.121   6.949
  274   1HB   SER  38          HB2       SER  38  13.958  -3.045   8.831
  275   2HB   SER  38          HB1       SER  38  13.249  -4.598   9.275
  276    HG   SER  38           HG       SER  38  15.682  -4.035   7.983
  277    H    LEU  39           HN       LEU  39  12.755  -1.631   7.745
  278    HA   LEU  39           HA       LEU  39  10.157  -1.606   8.780
  279   1HB   LEU  39          HB2       LEU  39  11.755   0.196   9.121
  280   2HB   LEU  39          HB1       LEU  39  11.654   0.623   7.422
  281    HG   LEU  39           HG       LEU  39   9.215   1.079   7.787
  282   1HD1  LEU  39          HD11      LEU  39   8.470   1.539  10.063
  283   2HD1  LEU  39          HD12      LEU  39   9.988   0.885  10.684
  284   3HD1  LEU  39          HD13      LEU  39   8.867  -0.162   9.816
  285   1HD2  LEU  39          HD21      LEU  39   9.602   3.247   8.765
  286   2HD2  LEU  39          HD22      LEU  39  10.828   2.797   7.566
  287   3HD2  LEU  39          HD23      LEU  39  11.214   2.723   9.300
  288    H    MET  40           HN       MET  40  11.304  -1.334   5.531
  289    HA   MET  40           HA       MET  40   8.945  -0.384   4.264
  290   1HB   MET  40          HB2       MET  40  11.162  -1.991   3.041
  291   2HB   MET  40          HB1       MET  40  10.038  -0.909   2.219
  292   1HG   MET  40          HG2       MET  40  12.078   0.254   2.312
  293   2HG   MET  40          HG1       MET  40  11.088   0.947   3.587
  294   1HE   MET  40          HE1       MET  40  14.281   1.274   3.339
  295   2HE   MET  40          HE2       MET  40  14.756   1.108   5.030
  296   3HE   MET  40          HE3       MET  40  13.321   2.041   4.604
  297    H    GLY  41           HN       GLY  41   9.523  -3.300   5.724
  298   1HA   GLY  41          HA2       GLY  41   7.312  -4.494   4.199
  299   2HA   GLY  41          HA1       GLY  41   8.639  -5.461   4.852
  300    H    VAL  42           HN       VAL  42   8.830  -3.957   7.315
  301    HA   VAL  42           HA       VAL  42   6.907  -5.371   8.851
  302    HB   VAL  42           HB       VAL  42   8.760  -3.123   9.733
  303   1HG1  VAL  42          HG11      VAL  42   8.440  -3.995  11.994
  304   2HG1  VAL  42          HG12      VAL  42   7.277  -5.165  11.374
  305   3HG1  VAL  42          HG13      VAL  42   6.921  -3.442  11.289
  306   1HG2  VAL  42          HG21      VAL  42   9.120  -6.110   9.909
  307   2HG2  VAL  42          HG22      VAL  42  10.201  -4.904  10.606
  308   3HG2  VAL  42          HG23      VAL  42  10.015  -5.014   8.855
  309    H    GLU  43           HN       GLU  43   7.209  -1.902   7.986
  310    HA   GLU  43           HA       GLU  43   4.963  -1.273   9.589
  311   1HB   GLU  43          HB2       GLU  43   6.765   0.379   8.933
  312   2HB   GLU  43          HB1       GLU  43   6.024   0.443   7.337
  313   1HG   GLU  43          HG2       GLU  43   3.930   1.184   8.323
  314   2HG   GLU  43          HG1       GLU  43   4.639   1.110   9.925
  315    H    VAL  44           HN       VAL  44   5.435  -2.227   6.297
  316    HA   VAL  44           HA       VAL  44   2.876  -1.658   5.221
  317    HB   VAL  44           HB       VAL  44   4.755  -3.963   4.566
  318   1HG1  VAL  44          HG11      VAL  44   2.435  -2.863   2.973
  319   2HG1  VAL  44          HG12      VAL  44   2.493  -4.431   3.782
  320   3HG1  VAL  44          HG13      VAL  44   3.566  -4.105   2.424
  321   1HG2  VAL  44          HG21      VAL  44   5.780  -1.792   4.227
  322   2HG2  VAL  44          HG22      VAL  44   4.403  -1.276   3.254
  323   3HG2  VAL  44          HG23      VAL  44   5.456  -2.571   2.681
  324    H    ARG  45           HN       ARG  45   4.142  -4.505   6.872
  325    HA   ARG  45           HA       ARG  45   1.747  -5.917   6.967
  326   1HB   ARG  45          HB2       ARG  45   4.233  -5.983   8.606
  327   2HB   ARG  45          HB1       ARG  45   2.865  -6.936   9.136
  328   1HG   ARG  45          HG2       ARG  45   2.851  -8.049   6.922
  329   2HG   ARG  45          HG1       ARG  45   4.288  -7.122   6.491
  330   1HD   ARG  45          HD2       ARG  45   4.131  -8.931   8.886
  331   2HD   ARG  45          HD1       ARG  45   4.709  -9.457   7.304
  332    HE   ARG  45           HE       ARG  45   6.335  -7.514   7.606
  333   1HH1  ARG  45          HH11      ARG  45   5.124  -9.373  10.384
  334   2HH1  ARG  45          HH12      ARG  45   6.625  -9.419  11.176
  335   1HH2  ARG  45          HH21      ARG  45   8.447  -7.631   8.720
  336   2HH2  ARG  45          HH22      ARG  45   8.528  -8.470  10.197
  337    H    GLN  46           HN       GLN  46   3.030  -3.496   9.177
  338    HA   GLN  46           HA       GLN  46   0.876  -3.797  11.008
  339   1HB   GLN  46          HB2       GLN  46   2.793  -1.488  10.689
  340   2HB   GLN  46          HB1       GLN  46   1.680  -1.692  12.034
  341   1HG   GLN  46          HG2       GLN  46   2.814  -3.772  12.645
  342   2HG   GLN  46          HG1       GLN  46   3.942  -3.538  11.308
  343   1HE2  GLN  46          HE21      GLN  46   5.685  -3.446  12.661
  344   2HE2  GLN  46          HE22      GLN  46   6.039  -2.080  13.656
  345    H    ILE  47           HN       ILE  47   0.832  -2.522   7.980
  346    HA   ILE  47           HA       ILE  47  -1.407  -0.770   8.642
  347    HB   ILE  47           HB       ILE  47  -0.056  -1.218   5.947
  348   1HG1  ILE  47          HG12      ILE  47   0.038   1.172   7.807
  349   2HG1  ILE  47          HG11      ILE  47   1.323  -0.015   7.617
  350   1HG2  ILE  47          HG21      ILE  47  -1.394   0.696   5.176
  351   2HG2  ILE  47          HG22      ILE  47  -2.210   0.755   6.739
  352   3HG2  ILE  47          HG23      ILE  47  -2.419  -0.646   5.686
  353   1HD1  ILE  47          HD11      ILE  47   1.588   0.663   5.281
  354   2HD1  ILE  47          HD12      ILE  47   1.819   2.009   6.396
  355   3HD1  ILE  47          HD13      ILE  47   0.311   1.867   5.488
  356    H    LEU  48           HN       LEU  48  -0.651  -3.404   6.381
  357    HA   LEU  48           HA       LEU  48  -3.398  -3.793   5.763
  358   1HB   LEU  48          HB2       LEU  48  -0.978  -5.444   5.070
  359   2HB   LEU  48          HB1       LEU  48  -2.592  -5.892   4.582
  360    HG   LEU  48           HG       LEU  48  -1.562  -4.882   2.725
  361   1HD1  LEU  48          HD11      LEU  48  -3.866  -4.265   2.990
  362   2HD1  LEU  48          HD12      LEU  48  -2.955  -2.936   2.264
  363   3HD1  LEU  48          HD13      LEU  48  -3.402  -2.871   3.968
  364   1HD2  LEU  48          HD21      LEU  48   0.265  -3.708   3.800
  365   2HD2  LEU  48          HD22      LEU  48  -0.863  -2.530   4.473
  366   3HD2  LEU  48          HD23      LEU  48  -0.614  -2.615   2.729
  367    H    GLU  49           HN       GLU  49  -1.157  -5.605   7.809
  368    HA   GLU  49           HA       GLU  49  -2.948  -7.723   8.402
  369   1HB   GLU  49          HB2       GLU  49  -0.471  -7.821   8.638
  370   2HB   GLU  49          HB1       GLU  49  -0.586  -6.703   9.982
  371   1HG   GLU  49          HG2       GLU  49  -2.204  -8.556  10.916
  372   2HG   GLU  49          HG1       GLU  49  -1.267  -9.575   9.819
  373    H    ARG  50           HN       ARG  50  -2.110  -4.702   9.869
  374    HA   ARG  50           HA       ARG  50  -3.512  -5.128  12.312
  375   1HB   ARG  50          HB2       ARG  50  -1.546  -3.665  12.042
  376   2HB   ARG  50          HB1       ARG  50  -2.526  -2.562  11.103
  377   1HG   ARG  50          HG2       ARG  50  -3.960  -2.221  13.096
  378   2HG   ARG  50          HG1       ARG  50  -2.843  -3.238  14.016
  379   1HD   ARG  50          HD2       ARG  50  -1.008  -1.710  13.409
  380   2HD   ARG  50          HD1       ARG  50  -2.164  -0.680  12.577
  381    HE   ARG  50           HE       ARG  50  -1.765  -0.980  15.420
  382   1HH1  ARG  50          HH11      ARG  50  -3.979   0.293  12.911
  383   2HH1  ARG  50          HH12      ARG  50  -4.535   1.540  13.891
  384   1HH2  ARG  50          HH21      ARG  50  -2.588   0.822  16.723
  385   2HH2  ARG  50          HH22      ARG  50  -3.783   1.851  16.011
  386    H    GLU  51           HN       GLU  51  -4.270  -3.260   9.346
  387    HA   GLU  51           HA       GLU  51  -6.763  -2.404  10.545
  388   1HB   GLU  51          HB2       GLU  51  -5.719  -1.865   7.771
  389   2HB   GLU  51          HB1       GLU  51  -7.152  -1.143   8.480
  390   1HG   GLU  51          HG2       GLU  51  -4.290  -0.725   9.262
  391   2HG   GLU  51          HG1       GLU  51  -5.425   0.446   8.593
  392    H    HIS  52           HN       HIS  52  -5.817  -4.662   7.966
  393    HA   HIS  52           HA       HIS  52  -8.688  -5.281   7.717
  394   1HB   HIS  52          HB2       HIS  52  -6.635  -5.069   5.538
  395   2HB   HIS  52          HB1       HIS  52  -8.124  -5.962   5.303
  396    HD1  HIS  52           HD1      HIS  52 -10.095  -4.653   4.575
  397    HD2  HIS  52           HD2      HIS  52  -7.069  -2.256   6.084
  398    HE1  HIS  52           HE1      HIS  52 -10.787  -2.292   4.084
  399    HE2  HIS  52           HE2      HIS  52  -8.729  -0.961   4.645
  400    H    ASP  53           HN       ASP  53  -6.034  -6.500   8.960
  401    HA   ASP  53           HA       ASP  53  -5.365  -8.499   9.667
  402   1HB   ASP  53          HB2       ASP  53  -7.879  -8.792  10.050
  403   2HB   ASP  53          HB1       ASP  53  -7.917  -9.698   8.546
  404    H    LEU  54           HN       LEU  54  -4.988  -7.587   6.817
  405    HA   LEU  54           HA       LEU  54  -4.564 -10.081   5.405
  406   1HB   LEU  54          HB2       LEU  54  -4.137  -7.213   4.649
  407   2HB   LEU  54          HB1       LEU  54  -3.278  -8.454   3.777
  408    HG   LEU  54           HG       LEU  54  -5.474  -9.447   3.133
  409   1HD1  LEU  54          HD11      LEU  54  -6.837  -8.584   4.929
  410   2HD1  LEU  54          HD12      LEU  54  -7.478  -8.106   3.355
  411   3HD1  LEU  54          HD13      LEU  54  -6.583  -6.944   4.341
  412   1HD2  LEU  54          HD21      LEU  54  -5.023  -6.577   2.353
  413   2HD2  LEU  54          HD22      LEU  54  -5.999  -7.747   1.465
  414   3HD2  LEU  54          HD23      LEU  54  -4.259  -7.990   1.625
  415    H    VAL  55           HN       VAL  55  -3.034 -11.261   6.381
  416    HA   VAL  55           HA       VAL  55  -0.541 -10.048   7.095
  417    HB   VAL  55           HB       VAL  55  -1.242 -13.003   6.891
  418   1HG1  VAL  55          HG11      VAL  55   1.166 -12.625   6.772
  419   2HG1  VAL  55          HG12      VAL  55   0.734 -13.374   8.307
  420   3HG1  VAL  55          HG13      VAL  55   1.099 -11.649   8.240
  421   1HG2  VAL  55          HG21      VAL  55  -1.197 -11.199   9.311
  422   2HG2  VAL  55          HG22      VAL  55  -1.466 -12.943   9.336
  423   3HG2  VAL  55          HG23      VAL  55  -2.632 -11.882   8.548
  424    H    LEU  56           HN       LEU  56   0.171  -9.150   5.274
  425    HA   LEU  56           HA       LEU  56   0.707 -10.863   2.983
  426   1HB   LEU  56          HB2       LEU  56   1.198  -7.911   3.364
  427   2HB   LEU  56          HB1       LEU  56   1.454  -8.797   1.884
  428    HG   LEU  56           HG       LEU  56  -1.228  -8.301   3.182
  429   1HD1  LEU  56          HD11      LEU  56  -1.640  -6.898   1.223
  430   2HD1  LEU  56          HD12      LEU  56   0.014  -7.179   0.676
  431   3HD1  LEU  56          HD13      LEU  56  -0.284  -6.303   2.178
  432   1HD2  LEU  56          HD21      LEU  56  -1.159 -10.453   2.027
  433   2HD2  LEU  56          HD22      LEU  56  -0.534  -9.662   0.579
  434   3HD2  LEU  56          HD23      LEU  56  -2.162  -9.296   1.151
  435    HA   PRO  57           HA       PRO  57   4.666 -11.309   5.054
  436   1HB   PRO  57          HB2       PRO  57   5.085 -13.321   2.958
  437   2HB   PRO  57          HB1       PRO  57   5.106 -13.532   4.716
  438   1HG   PRO  57          HG2       PRO  57   3.117 -14.523   3.213
  439   2HG   PRO  57          HG1       PRO  57   2.809 -13.846   4.826
  440   1HD   PRO  57          HD2       PRO  57   2.430 -12.588   2.135
  441   2HD   PRO  57          HD1       PRO  57   1.338 -12.593   3.540
  442    H    ILE  58           HN       ILE  58   6.878 -11.216   4.195
  443    HA   ILE  58           HA       ILE  58   7.054  -9.081   2.375
  444    HB   ILE  58           HB       ILE  58   9.101 -10.706   3.897
  445   1HG1  ILE  58          HG12      ILE  58   9.646  -8.514   4.914
  446   2HG1  ILE  58          HG11      ILE  58   8.417  -7.762   3.914
  447   1HG2  ILE  58          HG21      ILE  58  10.199 -10.291   1.785
  448   2HG2  ILE  58          HG22      ILE  58  10.926  -9.323   3.071
  449   3HG2  ILE  58          HG23      ILE  58   9.833  -8.573   1.909
  450   1HD1  ILE  58          HD11      ILE  58   6.702  -9.077   5.059
  451   2HD1  ILE  58          HD12      ILE  58   7.645  -8.096   6.184
  452   3HD1  ILE  58          HD13      ILE  58   7.952  -9.827   6.054
  453    H    ARG  59           HN       ARG  59   6.936 -12.359   1.947
  454    HA   ARG  59           HA       ARG  59   8.313 -12.664  -0.513
  455   1HB   ARG  59          HB2       ARG  59   5.945 -14.266   0.512
  456   2HB   ARG  59          HB1       ARG  59   6.910 -14.698  -0.885
  457   1HG   ARG  59          HG2       ARG  59   7.694 -16.082   0.820
  458   2HG   ARG  59          HG1       ARG  59   8.893 -14.793   0.733
  459   1HD   ARG  59          HD2       ARG  59   7.747 -13.674   2.627
  460   2HD   ARG  59          HD1       ARG  59   6.649 -15.041   2.737
  461    HE   ARG  59           HE       ARG  59   9.483 -15.588   2.905
  462   1HH1  ARG  59          HH11      ARG  59   6.378 -15.298   4.573
  463   2HH1  ARG  59          HH12      ARG  59   6.950 -15.787   6.098
  464   1HH2  ARG  59          HH21      ARG  59  10.310 -16.284   5.032
  465   2HH2  ARG  59          HH22      ARG  59   9.246 -16.308   6.362
  466    H    GLU  60           HN       GLU  60   5.227 -11.348   0.326
  467    HA   GLU  60           HA       GLU  60   4.409 -11.083  -2.477
  468   1HB   GLU  60          HB2       GLU  60   2.997 -10.247   0.073
  469   2HB   GLU  60          HB1       GLU  60   2.323 -10.172  -1.544
  470   1HG   GLU  60          HG2       GLU  60   3.050 -12.659  -0.018
  471   2HG   GLU  60          HG1       GLU  60   1.427 -12.048  -0.324
  472    H    VAL  61           HN       VAL  61   5.235  -9.282   0.396
  473    HA   VAL  61           HA       VAL  61   4.801  -6.693  -0.450
  474    HB   VAL  61           HB       VAL  61   6.825  -7.710   1.573
  475   1HG1  VAL  61          HG11      VAL  61   5.771  -4.909   1.205
  476   2HG1  VAL  61          HG12      VAL  61   7.417  -5.450   0.875
  477   3HG1  VAL  61          HG13      VAL  61   6.793  -5.477   2.526
  478   1HG2  VAL  61          HG21      VAL  61   4.533  -8.300   2.098
  479   2HG2  VAL  61          HG22      VAL  61   4.037  -6.620   1.907
  480   3HG2  VAL  61          HG23      VAL  61   5.132  -7.075   3.215
  481    H    ARG  62           HN       ARG  62   7.653  -8.697  -1.053
  482    HA   ARG  62           HA       ARG  62   9.281  -6.542  -1.898
  483   1HB   ARG  62          HB2       ARG  62   9.572  -9.483  -2.453
  484   2HB   ARG  62          HB1       ARG  62  10.780  -8.284  -2.895
  485   1HG   ARG  62          HG2       ARG  62  11.039  -7.656  -0.584
  486   2HG   ARG  62          HG1       ARG  62   9.775  -8.784  -0.116
  487   1HD   ARG  62          HD2       ARG  62  11.693  -9.987   0.363
  488   2HD   ARG  62          HD1       ARG  62  11.251 -10.579  -1.233
  489    HE   ARG  62           HE       ARG  62  13.183  -8.419  -1.083
  490   1HH1  ARG  62          HH11      ARG  62  12.544 -11.811  -1.861
  491   2HH1  ARG  62          HH12      ARG  62  14.164 -12.217  -2.141
  492   1HH2  ARG  62          HH21      ARG  62  15.417  -8.928  -1.509
  493   2HH2  ARG  62          HH22      ARG  62  15.870 -10.503  -1.966
  494    H    GLN  63           HN       GLN  63   6.637  -7.861  -3.525
  495    HA   GLN  63           HA       GLN  63   7.773  -6.969  -6.073
  496   1HB   GLN  63          HB2       GLN  63   5.323  -8.689  -5.636
  497   2HB   GLN  63          HB1       GLN  63   5.840  -8.075  -7.193
  498   1HG   GLN  63          HG2       GLN  63   6.603 -10.245  -7.195
  499   2HG   GLN  63          HG1       GLN  63   8.028  -9.331  -6.717
  500   1HE2  GLN  63          HE21      GLN  63   5.280 -10.071  -4.664
  501   2HE2  GLN  63          HE22      GLN  63   6.173 -11.116  -3.610
  502    H    LEU  64           HN       LEU  64   6.193  -5.671  -3.637
  503    HA   LEU  64           HA       LEU  64   4.050  -4.379  -4.996
  504   1HB   LEU  64          HB2       LEU  64   5.495  -3.555  -2.472
  505   2HB   LEU  64          HB1       LEU  64   3.980  -2.881  -3.037
  506    HG   LEU  64           HG       LEU  64   4.431  -5.721  -2.141
  507   1HD1  LEU  64          HD11      LEU  64   2.939  -3.454  -0.846
  508   2HD1  LEU  64          HD12      LEU  64   4.452  -4.174  -0.293
  509   3HD1  LEU  64          HD13      LEU  64   2.967  -5.123  -0.272
  510   1HD2  LEU  64          HD21      LEU  64   2.747  -5.617  -3.901
  511   2HD2  LEU  64          HD22      LEU  64   1.894  -4.345  -3.024
  512   3HD2  LEU  64          HD23      LEU  64   1.997  -5.969  -2.344
  513    H    THR  65           HN       THR  65   4.407  -3.135  -6.694
  514    HA   THR  65           HA       THR  65   6.932  -1.966  -7.277
  515    HB   THR  65           HB       THR  65   5.682  -1.337  -9.364
  516    HG1  THR  65           HG1      THR  65   3.596  -1.343  -9.126
  517   1HG2  THR  65          HG21      THR  65   5.416  -4.151  -8.391
  518   2HG2  THR  65          HG22      THR  65   6.887  -3.463  -9.090
  519   3HG2  THR  65          HG23      THR  65   5.425  -3.659 -10.090
  520    H    LEU  66           HN       LEU  66   5.804  -0.777  -5.048
  521    HA   LEU  66           HA       LEU  66   5.549   1.170  -4.027
  522   1HB   LEU  66          HB2       LEU  66   7.455   1.720  -5.697
  523   2HB   LEU  66          HB1       LEU  66   6.244   2.637  -6.561
  524    HG   LEU  66           HG       LEU  66   7.663   4.026  -5.089
  525   1HD1  LEU  66          HD11      LEU  66   4.783   3.902  -4.250
  526   2HD1  LEU  66          HD12      LEU  66   5.419   4.774  -5.643
  527   3HD1  LEU  66          HD13      LEU  66   5.868   5.275  -4.009
  528   1HD2  LEU  66          HD21      LEU  66   7.385   3.863  -2.659
  529   2HD2  LEU  66          HD22      LEU  66   8.069   2.387  -3.345
  530   3HD2  LEU  66          HD23      LEU  66   6.368   2.438  -2.881
  531    H    ARG  67           HN       ARG  67   4.203   1.718  -7.294
  532    HA   ARG  67           HA       ARG  67   2.037   3.179  -6.091
  533   1HB   ARG  67          HB2       ARG  67   2.597   2.398  -8.926
  534   2HB   ARG  67          HB1       ARG  67   1.039   3.077  -8.464
  535   1HG   ARG  67          HG2       ARG  67   3.701   4.388  -7.989
  536   2HG   ARG  67          HG1       ARG  67   2.594   4.771  -9.311
  537   1HD   ARG  67          HD2       ARG  67   0.858   5.352  -7.633
  538   2HD   ARG  67          HD1       ARG  67   2.014   5.000  -6.379
  539    HE   ARG  67           HE       ARG  67   2.931   7.015  -6.611
  540   1HH1  ARG  67          HH11      ARG  67   1.210   6.436  -9.737
  541   2HH1  ARG  67          HH12      ARG  67   1.617   7.979 -10.326
  542   1HH2  ARG  67          HH21      ARG  67   3.390   9.167  -7.544
  543   2HH2  ARG  67          HH22      ARG  67   2.869   9.464  -9.143
  544    H    LYS  68           HN       LYS  68   2.677  -0.008  -6.759
  545    HA   LYS  68           HA       LYS  68   0.025  -0.995  -6.785
  546   1HB   LYS  68          HB2       LYS  68   2.029  -2.250  -7.490
  547   2HB   LYS  68          HB1       LYS  68   2.542  -2.332  -5.817
  548   1HG   LYS  68          HG2       LYS  68   0.692  -3.728  -5.233
  549   2HG   LYS  68          HG1       LYS  68  -0.042  -3.502  -6.822
  550   1HD   LYS  68          HD2       LYS  68   2.630  -4.752  -6.344
  551   2HD   LYS  68          HD1       LYS  68   1.141  -5.695  -6.536
  552   1HE   LYS  68          HE2       LYS  68   2.440  -3.868  -8.601
  553   2HE   LYS  68          HE1       LYS  68   2.367  -5.621  -8.646
  554   1HZ   LYS  68          HZ1       LYS  68  -0.065  -3.875  -8.746
  555   2HZ   LYS  68          HZ2       LYS  68  -0.014  -5.534  -8.983
  556   3HZ   LYS  68          HZ3       LYS  68   0.707  -4.499 -10.082
  557    H    LEU  69           HN       LEU  69   1.987   0.314  -4.429
  558    HA   LEU  69           HA       LEU  69   0.851  -0.834  -2.065
  559   1HB   LEU  69          HB2       LEU  69   2.398   1.702  -2.478
  560   2HB   LEU  69          HB1       LEU  69   1.570   1.447  -0.963
  561    HG   LEU  69           HG       LEU  69   3.875   0.884  -0.716
  562   1HD1  LEU  69          HD11      LEU  69   2.194  -1.595  -0.783
  563   2HD1  LEU  69          HD12      LEU  69   2.345  -0.444   0.547
  564   3HD1  LEU  69          HD13      LEU  69   3.731  -1.418   0.061
  565   1HD2  LEU  69          HD21      LEU  69   4.953  -0.922  -1.968
  566   2HD2  LEU  69          HD22      LEU  69   4.448   0.394  -3.029
  567   3HD2  LEU  69          HD23      LEU  69   3.504  -1.092  -2.957
  568    H    GLN  70           HN       GLN  70   0.008   2.119  -3.837
  569    HA   GLN  70           HA       GLN  70  -2.273   2.558  -2.113
  570   1HB   GLN  70          HB2       GLN  70  -2.926   4.318  -3.789
  571   2HB   GLN  70          HB1       GLN  70  -1.334   4.552  -3.083
  572   1HG   GLN  70          HG2       GLN  70  -0.258   3.801  -5.041
  573   2HG   GLN  70          HG1       GLN  70  -1.777   3.259  -5.773
  574   1HE2  GLN  70          HE21      GLN  70  -1.445   4.537  -7.592
  575   2HE2  GLN  70          HE22      GLN  70  -1.604   6.247  -7.560
  576    H    GLU  71           HN       GLU  71  -1.550   1.011  -5.048
  577    HA   GLU  71           HA       GLU  71  -4.072   0.707  -6.170
  578   1HB   GLU  71          HB2       GLU  71  -1.927   0.412  -7.314
  579   2HB   GLU  71          HB1       GLU  71  -1.612  -1.010  -6.352
  580   1HG   GLU  71          HG2       GLU  71  -3.562  -2.080  -7.425
  581   2HG   GLU  71          HG1       GLU  71  -3.698  -0.656  -8.468
  582    H    MET  72           HN       MET  72  -2.326  -1.293  -3.852
  583    HA   MET  72           HA       MET  72  -4.879  -2.646  -3.366
  584   1HB   MET  72          HB2       MET  72  -3.698  -4.702  -2.677
  585   2HB   MET  72          HB1       MET  72  -3.351  -4.287  -4.342
  586   1HG   MET  72          HG2       MET  72  -1.166  -3.448  -3.692
  587   2HG   MET  72          HG1       MET  72  -1.525  -3.797  -2.001
  588   1HE   MET  72          HE1       MET  72  -2.579  -6.013  -5.084
  589   2HE   MET  72          HE2       MET  72  -1.202  -7.107  -5.228
  590   3HE   MET  72          HE3       MET  72  -1.007  -5.390  -5.586
  591    H    SER  73           HN       SER  73  -4.068  -0.256  -2.252
  592    HA   SER  73           HA       SER  73  -2.967  -0.404   0.329
  593   1HB   SER  73          HB2       SER  73  -4.076   1.802   0.644
  594   2HB   SER  73          HB1       SER  73  -3.251   1.684  -0.905
  595    HG   SER  73           HG       SER  73  -5.102   1.929  -1.898
  596    H    SER  74           HN       SER  74  -6.047  -1.109  -0.979
  597    HA   SER  74           HA       SER  74  -7.814  -2.280  -0.240
  598   1HB   SER  74          HB2       SER  74  -6.264  -2.608   2.334
  599   2HB   SER  74          HB1       SER  74  -7.711  -3.515   1.879
  600    HG   SER  74           HG       SER  74  -5.225  -3.483   0.486
  601    H    LYS  75           HN       LYS  75  -7.298   0.682   0.410
  602    HA   LYS  75           HA       LYS  75  -9.355   0.944   2.425
  603   1HB   LYS  75          HB2       LYS  75  -9.018   3.437   2.127
  604   2HB   LYS  75          HB1       LYS  75  -7.650   2.549   2.768
  605   1HG   LYS  75          HG2       LYS  75  -6.625   2.587   0.513
  606   2HG   LYS  75          HG1       LYS  75  -7.982   3.577  -0.042
  607   1HD   LYS  75          HD2       LYS  75  -7.416   5.342   1.421
  608   2HD   LYS  75          HD1       LYS  75  -6.279   4.333   2.310
  609   1HE   LYS  75          HE2       LYS  75  -5.047   5.835   0.935
  610   2HE   LYS  75          HE1       LYS  75  -4.873   4.212   0.295
  611   1HZ   LYS  75          HZ1       LYS  75  -6.715   6.283  -0.797
  612   2HZ   LYS  75          HZ2       LYS  75  -6.390   4.757  -1.494
  613   3HZ   LYS  75          HZ3       LYS  75  -5.175   5.921  -1.359
  614    H    ALA  76           HN       ALA  76 -11.373   1.562   2.097
  615    HA   ALA  76           HA       ALA  76 -12.291   1.050  -0.589
  616   1HB   ALA  76          HB1       ALA  76 -13.249  -0.186   1.291
  617   2HB   ALA  76          HB2       ALA  76 -14.471   0.765   0.444
  618   3HB   ALA  76          HB3       ALA  76 -13.828   1.329   1.986
  619    H    GLY  77           HN       GLY  77 -14.579   2.302  -0.873
  620   1HA   GLY  77          HA2       GLY  77 -15.483   4.590  -0.570
  621   2HA   GLY  77          HA1       GLY  77 -13.841   5.148  -0.891
  622    H    SER  78           HN       SER  78 -16.766   4.697  -2.298
  623    HA   SER  78           HA       SER  78 -15.558   4.693  -4.929
  624   1HB   SER  78          HB2       SER  78 -17.292   3.023  -5.687
  625   2HB   SER  78          HB1       SER  78 -16.041   2.370  -4.632
  626    HG   SER  78           HG       SER  78 -17.720   2.998  -2.915
  627    H    ASP  79           HN       ASP  79 -17.361   5.155  -6.589
  628    HA   ASP  79           HA       ASP  79 -18.875   7.435  -5.657
  629   1HB   ASP  79          HB2       ASP  79 -17.579   7.410  -7.812
  630   2HB   ASP  79          HB1       ASP  79 -18.692   6.200  -8.424
  631    H    THR  80           HN       THR  80 -19.915   5.544  -4.295
  632    HA   THR  80           HA       THR  80 -21.791   4.522  -3.626
  633    HB   THR  80           HB       THR  80 -23.067   5.651  -6.138
  634    HG1  THR  80           HG1      THR  80 -22.228   6.697  -3.802
  635   1HG2  THR  80          HG21      THR  80 -25.201   5.325  -4.935
  636   2HG2  THR  80          HG22      THR  80 -24.335   4.574  -3.594
  637   3HG2  THR  80          HG23      THR  80 -24.378   3.785  -5.172
  638    H    GLU  81           HN       GLU  81 -21.536   4.034  -7.123
  639    HA   GLU  81           HA       GLU  81 -21.122   1.227  -6.675
  640   1HB   GLU  81          HB2       GLU  81 -22.762   0.592  -8.431
  641   2HB   GLU  81          HB1       GLU  81 -23.539   1.296  -7.026
  642   1HG   GLU  81          HG2       GLU  81 -23.831   3.390  -8.216
  643   2HG   GLU  81          HG1       GLU  81 -22.973   2.732  -9.610
  644    H    LEU  82           HN       LEU  82 -20.327   0.251  -8.810
  645    HA   LEU  82           HA       LEU  82 -18.828   2.390 -10.117
  646   1HB   LEU  82          HB2       LEU  82 -17.404   0.891  -8.777
  647   2HB   LEU  82          HB1       LEU  82 -17.963  -0.477  -9.716
  648    HG   LEU  82           HG       LEU  82 -16.902   0.487 -11.728
  649   1HD1  LEU  82          HD11      LEU  82 -15.852   2.578  -9.824
  650   2HD1  LEU  82          HD12      LEU  82 -17.005   2.843 -11.132
  651   3HD1  LEU  82          HD13      LEU  82 -15.348   2.365 -11.501
  652   1HD2  LEU  82          HD21      LEU  82 -15.694  -1.125 -10.361
  653   2HD2  LEU  82          HD22      LEU  82 -15.070   0.182  -9.355
  654   3HD2  LEU  82          HD23      LEU  82 -14.589   0.066 -11.049
  655    H    ALA  83           HN       ALA  83 -20.424   2.733 -11.600
  656    HA   ALA  83           HA       ALA  83 -20.188   1.292 -13.997
  657   1HB   ALA  83          HB1       ALA  83 -22.566   0.648 -14.203
  658   2HB   ALA  83          HB2       ALA  83 -22.839   1.126 -12.528
  659   3HB   ALA  83          HB3       ALA  83 -21.781  -0.236 -12.894
  660    H    ALA  84           HN       ALA  84 -21.781   2.366 -15.587
  661    HA   ALA  84           HA       ALA  84 -22.343   5.100 -14.720
  662   1HB   ALA  84          HB1       ALA  84 -21.350   4.141 -17.421
  663   2HB   ALA  84          HB2       ALA  84 -20.410   5.060 -16.246
  664   3HB   ALA  84          HB3       ALA  84 -21.807   5.799 -17.031
  665    HA   PRO  85           HA       PRO  85 -26.488   4.197 -16.047
  666   1HB   PRO  85          HB2       PRO  85 -26.519   6.869 -17.351
  667   2HB   PRO  85          HB1       PRO  85 -27.597   6.217 -16.113
  668   1HG   PRO  85          HG2       PRO  85 -25.775   8.062 -15.496
  669   2HG   PRO  85          HG1       PRO  85 -26.137   6.726 -14.384
  670   1HD   PRO  85          HD2       PRO  85 -23.814   7.071 -16.240
  671   2HD   PRO  85          HD1       PRO  85 -23.851   6.438 -14.579
  672    H    LYS  86           HN       LYS  86 -26.771   2.820 -17.685
  673    HA   LYS  86           HA       LYS  86 -25.554   3.337 -20.280
  674   1HB   LYS  86          HB2       LYS  86 -27.086   0.935 -19.246
  675   2HB   LYS  86          HB1       LYS  86 -26.291   1.042 -20.808
  676   1HG   LYS  86          HG2       LYS  86 -24.131   1.196 -19.725
  677   2HG   LYS  86          HG1       LYS  86 -24.912   1.172 -18.140
  678   1HD   LYS  86          HD2       LYS  86 -25.768  -1.061 -18.575
  679   2HD   LYS  86          HD1       LYS  86 -25.070  -1.030 -20.197
  680   1HE   LYS  86          HE2       LYS  86 -23.691  -2.304 -18.601
  681   2HE   LYS  86          HE1       LYS  86 -22.838  -0.914 -19.267
  682   1HZ   LYS  86          HZ1       LYS  86 -24.152  -0.986 -16.585
  683   2HZ   LYS  86          HZ2       LYS  86 -23.226   0.292 -17.252
  684   3HZ   LYS  86          HZ3       LYS  86 -22.495  -1.153 -16.889
  685    H    SER  87           HN       SER  87 -28.675   2.504 -18.849
  686    HA   SER  87           HA       SER  87 -29.949   3.378 -21.270
  687   1HB   SER  87          HB2       SER  87 -32.030   2.490 -19.987
  688   2HB   SER  87          HB1       SER  87 -30.860   1.338 -20.625
  689    HG   SER  87           HG       SER  87 -30.213   0.853 -18.677
  690    H    LYS  88           HN       LYS  88 -29.816   5.523 -21.292
  691    HA   LYS  88           HA       LYS  88 -31.292   6.931 -19.172
  692   1HB   LYS  88          HB2       LYS  88 -29.269   8.032 -21.147
  693   2HB   LYS  88          HB1       LYS  88 -30.179   9.008 -20.003
  694   1HG   LYS  88          HG2       LYS  88 -29.109   7.770 -18.149
  695   2HG   LYS  88          HG1       LYS  88 -28.143   6.888 -19.331
  696   1HD   LYS  88          HD2       LYS  88 -26.850   8.719 -18.401
  697   2HD   LYS  88          HD1       LYS  88 -27.180   9.024 -20.104
  698   1HE   LYS  88          HE2       LYS  88 -29.033  10.511 -19.466
  699   2HE   LYS  88          HE1       LYS  88 -28.683  10.212 -17.768
  700   1HZ   LYS  88          HZ1       LYS  88 -26.518  11.269 -18.052
  701   2HZ   LYS  88          HZ2       LYS  88 -27.756  12.301 -18.572
  702   3HZ   LYS  88          HZ3       LYS  88 -26.822  11.461 -19.710
  703    H    ASN  89           HN       ASN  89 -31.528   5.603 -22.058
  704    HA   ASN  89           HA       ASN  89 -33.408   7.515 -23.197
  705   1HB   ASN  89          HB2       ASN  89 -31.729   6.469 -24.703
  706   2HB   ASN  89          HB1       ASN  89 -32.349   4.882 -24.266
  707   1HD2  ASN  89          HD21      ASN  89 -34.150   7.846 -24.944
  708   2HD2  ASN  89          HD22      ASN  89 -34.998   7.197 -26.310
  Start of MODEL    7
    1   1H    GLY   1          HT1       GLY   1 -11.030   4.089  17.553
    2   2H    GLY   1          HT2       GLY   1 -11.885   4.745  18.895
    3   3H    GLY   1          HT3       GLY   1 -10.474   5.464  18.338
    4   1HA   GLY   1          HA1       GLY   1 -12.924   5.282  16.730
    5   2HA   GLY   1          HA2       GLY   1 -12.414   6.696  17.650
    6    H    ASP   2           HN       ASP   2 -12.754   7.034  15.017
    7    HA   ASP   2           HA       ASP   2 -10.082   6.811  13.836
    8   1HB   ASP   2          HB2       ASP   2 -12.013   5.958  12.499
    9   2HB   ASP   2          HB1       ASP   2 -12.683   7.583  12.488
   10    H    GLY   3           HN       GLY   3  -9.083   8.447  14.918
   11   1HA   GLY   3          HA2       GLY   3 -10.077  11.174  14.394
   12   2HA   GLY   3          HA1       GLY   3  -8.942  10.729  15.674
   13    H    GLU   4           HN       GLU   4  -7.272   9.089  14.380
   14    HA   GLU   4           HA       GLU   4  -5.849  10.860  12.570
   15   1HB   GLU   4          HB2       GLU   4  -5.073   8.157  13.707
   16   2HB   GLU   4          HB1       GLU   4  -4.028   9.221  12.779
   17   1HG   GLU   4          HG2       GLU   4  -4.172  10.895  14.574
   18   2HG   GLU   4          HG1       GLU   4  -5.170   9.777  15.504
   19    H    ALA   5           HN       ALA   5  -6.995  10.755  10.745
   20    HA   ALA   5           HA       ALA   5  -8.277   8.526   9.657
   21   1HB   ALA   5          HB1       ALA   5  -8.436   9.842   7.619
   22   2HB   ALA   5          HB2       ALA   5  -7.234  10.972   8.243
   23   3HB   ALA   5          HB3       ALA   5  -8.803  10.826   9.035
   24    H    GLN   6           HN       GLN   6  -7.682   6.998   8.253
   25    HA   GLN   6           HA       GLN   6  -4.960   6.247   8.083
   26   1HB   GLN   6          HB2       GLN   6  -6.819   4.614   8.027
   27   2HB   GLN   6          HB1       GLN   6  -7.304   5.236   6.455
   28   1HG   GLN   6          HG2       GLN   6  -5.064   4.571   5.581
   29   2HG   GLN   6          HG1       GLN   6  -4.744   3.804   7.131
   30   1HE2  GLN   6          HE21      GLN   6  -5.952   1.994   7.698
   31   2HE2  GLN   6          HE22      GLN   6  -6.740   1.016   6.496
   32    H    ARG   7           HN       ARG   7  -3.528   7.162   6.868
   33    HA   ARG   7           HA       ARG   7  -4.162   8.762   4.600
   34   1HB   ARG   7          HB2       ARG   7  -1.810   9.133   4.420
   35   2HB   ARG   7          HB1       ARG   7  -2.179   9.091   6.133
   36   1HG   ARG   7          HG2       ARG   7  -1.428   6.658   6.085
   37   2HG   ARG   7          HG1       ARG   7  -0.780   7.001   4.478
   38   1HD   ARG   7          HD2       ARG   7  -0.014   8.276   7.094
   39   2HD   ARG   7          HD1       ARG   7   0.993   7.295   6.034
   40    HE   ARG   7           HE       ARG   7   0.035   9.615   4.707
   41   1HH1  ARG   7          HH11      ARG   7   2.641   8.461   6.832
   42   2HH1  ARG   7          HH12      ARG   7   3.500   9.935   6.710
   43   1HH2  ARG   7          HH21      ARG   7   1.254  11.505   4.538
   44   2HH2  ARG   7          HH22      ARG   7   2.755  11.664   5.384
   45    H    ASP   8           HN       ASP   8  -3.208   8.283   2.469
   46    HA   ASP   8           HA       ASP   8  -4.082   5.737   1.542
   47   1HB   ASP   8          HB2       ASP   8  -2.231   7.612   0.053
   48   2HB   ASP   8          HB1       ASP   8  -3.262   6.365  -0.641
   49    H    LEU   9           HN       LEU   9  -2.801   4.072   0.598
   50    HA   LEU   9           HA       LEU   9  -0.826   3.236   2.369
   51   1HB   LEU   9          HB2       LEU   9  -2.039   2.168  -0.076
   52   2HB   LEU   9          HB1       LEU   9  -0.445   1.550   0.306
   53    HG   LEU   9           HG       LEU   9  -2.396   0.199   1.154
   54   1HD1  LEU   9          HD11      LEU   9  -0.146  -0.071   2.020
   55   2HD1  LEU   9          HD12      LEU   9  -1.329  -0.222   3.322
   56   3HD1  LEU   9          HD13      LEU   9  -0.399   1.268   3.143
   57   1HD2  LEU   9          HD21      LEU   9  -3.445   0.936   3.246
   58   2HD2  LEU   9          HD22      LEU   9  -3.815   2.035   1.917
   59   3HD2  LEU   9          HD23      LEU   9  -2.602   2.481   3.118
   60    H    VAL  10           HN       VAL  10  -0.474   4.445  -0.907
   61    HA   VAL  10           HA       VAL  10   2.335   4.141  -0.792
   62    HB   VAL  10           HB       VAL  10   0.611   5.729  -2.724
   63   1HG1  VAL  10          HG11      VAL  10   2.606   6.110  -4.095
   64   2HG1  VAL  10          HG12      VAL  10   3.615   5.388  -2.841
   65   3HG1  VAL  10          HG13      VAL  10   2.772   6.905  -2.529
   66   1HG2  VAL  10          HG21      VAL  10   0.518   3.332  -2.954
   67   2HG2  VAL  10          HG22      VAL  10   2.278   3.235  -2.978
   68   3HG2  VAL  10          HG23      VAL  10   1.417   4.014  -4.302
   69    H    LYS  11           HN       LYS  11   0.265   6.586   0.413
   70    HA   LYS  11           HA       LYS  11   2.261   8.636   0.550
   71   1HB   LYS  11          HB2       LYS  11  -0.185   8.381   2.311
   72   2HB   LYS  11          HB1       LYS  11   0.701   9.848   1.923
   73   1HG   LYS  11          HG2       LYS  11  -0.930   8.212  -0.017
   74   2HG   LYS  11          HG1       LYS  11  -1.444   9.707   0.747
   75   1HD   LYS  11          HD2       LYS  11   0.260  10.942  -0.429
   76   2HD   LYS  11          HD1       LYS  11   0.946   9.450  -1.073
   77   1HE   LYS  11          HE2       LYS  11  -0.443  10.631  -2.739
   78   2HE   LYS  11          HE1       LYS  11  -1.068   9.031  -2.361
   79   1HZ   LYS  11          HZ1       LYS  11  -2.760  10.094  -0.926
   80   2HZ   LYS  11          HZ2       LYS  11  -2.847  10.605  -2.495
   81   3HZ   LYS  11          HZ3       LYS  11  -2.148  11.622  -1.325
   82    H    ALA  12           HN       ALA  12   1.443   5.856   2.403
   83    HA   ALA  12           HA       ALA  12   3.037   6.668   4.703
   84   1HB   ALA  12          HB1       ALA  12   0.885   5.568   5.095
   85   2HB   ALA  12          HB2       ALA  12   2.226   4.620   5.736
   86   3HB   ALA  12          HB3       ALA  12   1.456   4.145   4.224
   87    H    VAL  13           HN       VAL  13   2.954   4.118   2.239
   88    HA   VAL  13           HA       VAL  13   5.328   2.838   3.138
   89    HB   VAL  13           HB       VAL  13   3.880   2.590   0.480
   90   1HG1  VAL  13          HG11      VAL  13   6.213   1.892   0.249
   91   2HG1  VAL  13          HG12      VAL  13   5.125   0.506   0.154
   92   3HG1  VAL  13          HG13      VAL  13   6.033   0.812   1.634
   93   1HG2  VAL  13          HG21      VAL  13   3.851   0.830   2.935
   94   2HG2  VAL  13          HG22      VAL  13   3.009   0.501   1.419
   95   3HG2  VAL  13          HG23      VAL  13   2.548   1.892   2.401
   96    H    ALA  14           HN       ALA  14   4.691   5.079   0.432
   97    HA   ALA  14           HA       ALA  14   7.370   4.974  -0.500
   98   1HB   ALA  14          HB1       ALA  14   5.256   7.064  -1.070
   99   2HB   ALA  14          HB2       ALA  14   5.435   5.563  -1.946
  100   3HB   ALA  14          HB3       ALA  14   6.715   6.775  -2.024
  101    H    HIS  15           HN       HIS  15   5.780   6.636   1.962
  102    HA   HIS  15           HA       HIS  15   7.450   8.865   2.414
  103   1HB   HIS  15          HB2       HIS  15   5.302   8.648   3.538
  104   2HB   HIS  15          HB1       HIS  15   5.815   7.171   4.328
  105    HD1  HIS  15           HD1      HIS  15   6.396   7.507   6.720
  106    HD2  HIS  15           HD2      HIS  15   7.039  10.954   4.470
  107    HE1  HIS  15           HE1      HIS  15   7.147   9.256   8.353
  108    HE2  HIS  15           HE2      HIS  15   7.297  11.380   7.001
  109    H    ILE  16           HN       ILE  16   7.845   5.475   3.052
  110    HA   ILE  16           HA       ILE  16  10.065   5.813   4.844
  111    HB   ILE  16           HB       ILE  16   8.945   3.345   3.484
  112   1HG1  ILE  16          HG12      ILE  16   7.421   4.305   5.122
  113   2HG1  ILE  16          HG11      ILE  16   8.081   2.787   5.729
  114   1HG2  ILE  16          HG21      ILE  16  10.308   2.018   5.034
  115   2HG2  ILE  16          HG22      ILE  16  11.079   3.498   5.613
  116   3HG2  ILE  16          HG23      ILE  16  11.291   2.987   3.936
  117   1HD1  ILE  16          HD11      ILE  16   8.969   5.557   6.521
  118   2HD1  ILE  16          HD12      ILE  16   9.644   4.049   7.133
  119   3HD1  ILE  16          HD13      ILE  16   7.966   4.470   7.482
  120    H    LEU  17           HN       LEU  17   9.595   4.903   1.412
  121    HA   LEU  17           HA       LEU  17  12.314   4.427   0.910
  122   1HB   LEU  17          HB2       LEU  17   9.885   4.889  -0.771
  123   2HB   LEU  17          HB1       LEU  17  11.465   4.679  -1.482
  124    HG   LEU  17           HG       LEU  17  10.082   2.715  -1.569
  125   1HD1  LEU  17          HD11      LEU  17  12.535   2.403   0.157
  126   2HD1  LEU  17          HD12      LEU  17  12.479   2.428  -1.606
  127   3HD1  LEU  17          HD13      LEU  17  11.756   1.085  -0.716
  128   1HD2  LEU  17          HD21      LEU  17   8.803   2.851   0.468
  129   2HD2  LEU  17          HD22      LEU  17  10.256   2.636   1.439
  130   3HD2  LEU  17          HD23      LEU  17   9.666   1.313   0.431
  131    H    GLY  18           HN       GLY  18  10.271   7.241   0.829
  132   1HA   GLY  18          HA2       GLY  18  11.143   9.444   0.990
  133   2HA   GLY  18          HA1       GLY  18  12.619   8.889   0.203
  134    H    ILE  19           HN       ILE  19   9.236   8.454  -0.674
  135    HA   ILE  19           HA       ILE  19   9.520  10.117  -3.007
  136    HB   ILE  19           HB       ILE  19   8.205   8.075  -4.126
  137   1HG1  ILE  19          HG12      ILE  19  10.182   6.784  -2.235
  138   2HG1  ILE  19          HG11      ILE  19   8.451   6.505  -2.340
  139   1HG2  ILE  19          HG21      ILE  19  10.278   7.526  -5.337
  140   2HG2  ILE  19          HG22      ILE  19  11.170   8.531  -4.184
  141   3HG2  ILE  19          HG23      ILE  19   9.920   9.242  -5.223
  142   1HD1  ILE  19          HD11      ILE  19   9.701   4.643  -3.251
  143   2HD1  ILE  19          HD12      ILE  19  10.521   5.721  -4.379
  144   3HD1  ILE  19          HD13      ILE  19   8.786   5.445  -4.530
  145    H    ARG  20           HN       ARG  20   7.409  10.374  -4.066
  146    HA   ARG  20           HA       ARG  20   5.105   9.845  -2.337
  147   1HB   ARG  20          HB2       ARG  20   6.181  12.047  -1.710
  148   2HB   ARG  20          HB1       ARG  20   5.830  12.568  -3.354
  149   1HG   ARG  20          HG2       ARG  20   4.107  13.463  -2.034
  150   2HG   ARG  20          HG1       ARG  20   3.427  12.048  -2.848
  151   1HD   ARG  20          HD2       ARG  20   3.718  10.712  -0.867
  152   2HD   ARG  20          HD1       ARG  20   4.486  12.066  -0.035
  153    HE   ARG  20           HE       ARG  20   1.735  12.258  -1.037
  154   1HH1  ARG  20          HH11      ARG  20   4.040  12.593   1.695
  155   2HH1  ARG  20          HH12      ARG  20   2.850  13.210   2.730
  156   1HH2  ARG  20          HH21      ARG  20   0.167  13.004   0.435
  157   2HH2  ARG  20          HH22      ARG  20   0.574  13.437   2.025
  158    H    ASP  21           HN       ASP  21   6.089  11.837  -5.083
  159    HA   ASP  21           HA       ASP  21   3.718  11.135  -6.624
  160   1HB   ASP  21          HB2       ASP  21   6.039  12.944  -7.259
  161   2HB   ASP  21          HB1       ASP  21   4.671  12.664  -8.327
  162    H    LEU  22           HN       LEU  22   7.042  10.333  -6.471
  163    HA   LEU  22           HA       LEU  22   8.234   8.712  -7.464
  164   1HB   LEU  22          HB2       LEU  22   5.497   7.820  -8.291
  165   2HB   LEU  22          HB1       LEU  22   6.893   7.064  -9.020
  166    HG   LEU  22           HG       LEU  22   6.081   5.732  -7.195
  167   1HD1  LEU  22          HD11      LEU  22   8.671   7.117  -6.632
  168   2HD1  LEU  22          HD12      LEU  22   8.426   5.750  -7.696
  169   3HD1  LEU  22          HD13      LEU  22   8.186   5.564  -5.949
  170   1HD2  LEU  22          HD21      LEU  22   6.629   8.139  -5.439
  171   2HD2  LEU  22          HD22      LEU  22   6.195   6.532  -4.864
  172   3HD2  LEU  22          HD23      LEU  22   5.042   7.474  -5.806
  173    H    ALA  23           HN       ALA  23   7.449  11.275  -8.685
  174    HA   ALA  23           HA       ALA  23   7.404  10.879 -11.452
  175   1HB   ALA  23          HB1       ALA  23   6.438  12.869 -10.460
  176   2HB   ALA  23          HB2       ALA  23   7.688  13.315 -11.622
  177   3HB   ALA  23          HB3       ALA  23   8.027  13.388  -9.892
  178    H    GLY  24           HN       GLY  24   9.156   9.703 -12.058
  179   1HA   GLY  24          HA2       GLY  24  11.397  10.264 -13.126
  180   2HA   GLY  24          HA1       GLY  24  11.765  10.872 -11.503
  181    H    ILE  25           HN       ILE  25  10.027   8.480 -10.615
  182    HA   ILE  25           HA       ILE  25  12.379   6.786 -10.372
  183    HB   ILE  25           HB       ILE  25   9.881   6.883  -8.627
  184   1HG1  ILE  25          HG12      ILE  25  11.542   7.443  -6.802
  185   2HG1  ILE  25          HG11      ILE  25  12.759   7.632  -8.048
  186   1HG2  ILE  25          HG21      ILE  25  12.266   5.052  -8.361
  187   2HG2  ILE  25          HG22      ILE  25  10.630   4.582  -8.804
  188   3HG2  ILE  25          HG23      ILE  25  10.956   5.208  -7.187
  189   1HD1  ILE  25          HD11      ILE  25  11.469   9.483  -9.003
  190   2HD1  ILE  25          HD12      ILE  25  11.890   9.772  -7.316
  191   3HD1  ILE  25          HD13      ILE  25  10.255   9.276  -7.743
  192    H    ASN  26           HN       ASN  26  12.377   4.811 -11.011
  193    HA   ASN  26           HA       ASN  26  10.534   4.045 -13.043
  194   1HB   ASN  26          HB2       ASN  26  12.925   3.498 -13.161
  195   2HB   ASN  26          HB1       ASN  26  12.770   2.493 -11.726
  196   1HD2  ASN  26          HD21      ASN  26  12.169   2.772 -15.086
  197   2HD2  ASN  26          HD22      ASN  26  11.668   1.138 -15.353
  198    H    LEU  27           HN       LEU  27   8.619   3.188 -12.658
  199    HA   LEU  27           HA       LEU  27   8.033   1.895 -10.084
  200   1HB   LEU  27          HB2       LEU  27   6.256   2.850 -12.322
  201   2HB   LEU  27          HB1       LEU  27   5.674   2.019 -10.891
  202    HG   LEU  27           HG       LEU  27   7.088   4.688 -10.906
  203   1HD1  LEU  27          HD11      LEU  27   4.204   3.991 -10.413
  204   2HD1  LEU  27          HD12      LEU  27   4.837   4.807 -11.845
  205   3HD1  LEU  27          HD13      LEU  27   4.920   5.594 -10.271
  206   1HD2  LEU  27          HD21      LEU  27   5.825   3.110  -8.674
  207   2HD2  LEU  27          HD22      LEU  27   6.422   4.763  -8.549
  208   3HD2  LEU  27          HD23      LEU  27   7.546   3.447  -8.871
  209    H    ASP  28           HN       ASP  28   9.490   0.804 -12.498
  210    HA   ASP  28           HA       ASP  28   7.960  -1.690 -12.673
  211   1HB   ASP  28          HB2       ASP  28  10.284  -0.700 -14.358
  212   2HB   ASP  28          HB1       ASP  28   9.488  -2.260 -14.555
  213    H    SER  29           HN       SER  29   9.830  -0.323 -10.639
  214    HA   SER  29           HA       SER  29  11.768  -2.452 -10.326
  215   1HB   SER  29          HB2       SER  29  11.532   0.245  -8.963
  216   2HB   SER  29          HB1       SER  29  12.837  -0.919  -8.730
  217    HG   SER  29           HG       SER  29  12.170   0.125 -11.280
  218    H    SER  30           HN       SER  30  10.873  -4.049  -9.266
  219    HA   SER  30           HA       SER  30   8.794  -3.913  -7.386
  220   1HB   SER  30          HB2       SER  30  10.964  -5.933  -7.882
  221   2HB   SER  30          HB1       SER  30   9.569  -6.269  -6.883
  222    HG   SER  30           HG       SER  30   9.763  -5.761  -9.659
  223    H    LEU  31           HN       LEU  31   8.928  -4.043  -5.082
  224    HA   LEU  31           HA       LEU  31  11.058  -2.647  -3.899
  225   1HB   LEU  31          HB2       LEU  31   8.913  -4.306  -2.544
  226   2HB   LEU  31          HB1       LEU  31  10.213  -3.513  -1.679
  227    HG   LEU  31           HG       LEU  31   9.396  -1.318  -2.411
  228   1HD1  LEU  31          HD11      LEU  31   8.353  -1.950  -4.481
  229   2HD1  LEU  31          HD12      LEU  31   7.202  -1.110  -3.428
  230   3HD1  LEU  31          HD13      LEU  31   7.140  -2.873  -3.599
  231   1HD2  LEU  31          HD21      LEU  31   7.312  -3.033  -1.086
  232   2HD2  LEU  31          HD22      LEU  31   7.397  -1.273  -1.021
  233   3HD2  LEU  31          HD23      LEU  31   8.674  -2.248  -0.284
  234    H    ALA  32           HN       ALA  32  10.823  -5.899  -4.717
  235    HA   ALA  32           HA       ALA  32  12.729  -6.891  -2.913
  236   1HB   ALA  32          HB1       ALA  32  12.921  -8.832  -4.384
  237   2HB   ALA  32          HB2       ALA  32  12.126  -7.936  -5.674
  238   3HB   ALA  32          HB3       ALA  32  11.227  -8.353  -4.219
  239    H    ASP  33           HN       ASP  33  12.913  -5.266  -5.972
  240    HA   ASP  33           HA       ASP  33  15.623  -5.866  -6.476
  241   1HB   ASP  33          HB2       ASP  33  14.085  -5.145  -8.279
  242   2HB   ASP  33          HB1       ASP  33  13.977  -3.551  -7.544
  243    H    LEU  34           HN       LEU  34  13.793  -3.414  -4.925
  244    HA   LEU  34           HA       LEU  34  15.793  -1.480  -4.417
  245   1HB   LEU  34          HB2       LEU  34  13.362  -2.037  -2.731
  246   2HB   LEU  34          HB1       LEU  34  14.212  -0.517  -2.915
  247    HG   LEU  34           HG       LEU  34  12.584  -1.871  -5.060
  248   1HD1  LEU  34          HD11      LEU  34  11.245  -1.100  -3.250
  249   2HD1  LEU  34          HD12      LEU  34  10.972  -0.137  -4.707
  250   3HD1  LEU  34          HD13      LEU  34  11.941   0.523  -3.367
  251   1HD2  LEU  34          HD21      LEU  34  13.883   0.853  -5.011
  252   2HD2  LEU  34          HD22      LEU  34  12.807   0.232  -6.269
  253   3HD2  LEU  34          HD23      LEU  34  14.378  -0.528  -5.999
  254    H    GLY  35           HN       GLY  35  14.298  -3.982  -2.386
  255   1HA   GLY  35          HA2       GLY  35  15.664  -5.466  -1.064
  256   2HA   GLY  35          HA1       GLY  35  16.793  -4.138  -0.830
  257    H    LEU  36           HN       LEU  36  13.575  -5.320  -0.006
  258    HA   LEU  36           HA       LEU  36  13.415  -3.297   2.096
  259   1HB   LEU  36          HB2       LEU  36  11.106  -3.753   2.285
  260   2HB   LEU  36          HB1       LEU  36  11.450  -3.640   0.583
  261    HG   LEU  36           HG       LEU  36  11.517  -6.278   0.725
  262   1HD1  LEU  36          HD11      LEU  36  11.292  -6.462   3.154
  263   2HD1  LEU  36          HD12      LEU  36   9.922  -7.204   2.325
  264   3HD1  LEU  36          HD13      LEU  36   9.742  -5.617   3.070
  265   1HD2  LEU  36          HD21      LEU  36   9.075  -6.301   0.351
  266   2HD2  LEU  36          HD22      LEU  36  10.009  -5.153  -0.608
  267   3HD2  LEU  36          HD23      LEU  36   9.085  -4.583   0.805
  268    H    ASP  37           HN       ASP  37  13.218  -3.759   4.139
  269    HA   ASP  37           HA       ASP  37  12.370  -5.753   5.660
  270   1HB   ASP  37          HB2       ASP  37  14.101  -7.284   6.324
  271   2HB   ASP  37          HB1       ASP  37  14.095  -7.315   4.571
  272    H    SER  38           HN       SER  38  14.612  -3.394   5.002
  273    HA   SER  38           HA       SER  38  15.910  -2.842   7.368
  274   1HB   SER  38          HB2       SER  38  14.866  -0.782   5.432
  275   2HB   SER  38          HB1       SER  38  16.313  -0.678   6.444
  276    HG   SER  38           HG       SER  38  17.189  -2.390   5.322
  277    H    LEU  39           HN       LEU  39  12.667  -2.119   6.484
  278    HA   LEU  39           HA       LEU  39  11.645  -1.661   9.071
  279   1HB   LEU  39          HB2       LEU  39  12.914   0.438   8.771
  280   2HB   LEU  39          HB1       LEU  39  11.972   0.789   7.345
  281    HG   LEU  39           HG       LEU  39   9.920   0.732   8.817
  282   1HD1  LEU  39          HD11      LEU  39  11.986   0.882  10.994
  283   2HD1  LEU  39          HD12      LEU  39  10.854  -0.437  10.705
  284   3HD1  LEU  39          HD13      LEU  39  10.253   1.148  11.199
  285   1HD2  LEU  39          HD21      LEU  39  10.866   2.752   7.937
  286   2HD2  LEU  39          HD22      LEU  39  11.995   2.864   9.293
  287   3HD2  LEU  39          HD23      LEU  39  10.251   3.029   9.565
  288    H    MET  40           HN       MET  40  11.590  -0.654   5.801
  289    HA   MET  40           HA       MET  40   9.142  -0.140   4.890
  290   1HB   MET  40          HB2       MET  40  10.887  -2.221   3.603
  291   2HB   MET  40          HB1       MET  40   9.703  -1.168   2.823
  292   1HG   MET  40          HG2       MET  40  11.065   0.728   3.130
  293   2HG   MET  40          HG1       MET  40  12.143  -0.137   4.226
  294   1HE   MET  40          HE1       MET  40  14.513   0.458   1.209
  295   2HE   MET  40          HE2       MET  40  14.305   0.592   2.957
  296   3HE   MET  40          HE3       MET  40  13.315   1.568   1.874
  297    H    GLY  41           HN       GLY  41  10.218  -3.521   5.036
  298   1HA   GLY  41          HA2       GLY  41   7.625  -4.493   4.286
  299   2HA   GLY  41          HA1       GLY  41   8.999  -5.473   4.755
  300    H    VAL  42           HN       VAL  42   8.904  -3.610   7.282
  301    HA   VAL  42           HA       VAL  42   7.158  -5.432   8.745
  302    HB   VAL  42           HB       VAL  42   8.985  -3.271   9.848
  303   1HG1  VAL  42          HG11      VAL  42   7.690  -5.627  11.200
  304   2HG1  VAL  42          HG12      VAL  42   7.226  -3.938  11.375
  305   3HG1  VAL  42          HG13      VAL  42   8.798  -4.486  11.966
  306   1HG2  VAL  42          HG21      VAL  42  10.588  -5.064  10.377
  307   2HG2  VAL  42          HG22      VAL  42  10.335  -4.888   8.642
  308   3HG2  VAL  42          HG23      VAL  42   9.569  -6.215   9.513
  309    H    GLU  43           HN       GLU  43   7.658  -1.996   8.101
  310    HA   GLU  43           HA       GLU  43   5.393  -1.285   9.632
  311   1HB   GLU  43          HB2       GLU  43   7.281   0.300   9.217
  312   2HB   GLU  43          HB1       GLU  43   6.762   0.425   7.541
  313   1HG   GLU  43          HG2       GLU  43   4.729   1.461   8.138
  314   2HG   GLU  43          HG1       GLU  43   4.947   1.064   9.839
  315    H    VAL  44           HN       VAL  44   5.856  -2.128   6.267
  316    HA   VAL  44           HA       VAL  44   3.305  -1.381   5.290
  317    HB   VAL  44           HB       VAL  44   4.990  -3.817   4.518
  318   1HG1  VAL  44          HG11      VAL  44   3.679  -3.887   2.462
  319   2HG1  VAL  44          HG12      VAL  44   2.667  -2.571   3.060
  320   3HG1  VAL  44          HG13      VAL  44   2.650  -4.140   3.878
  321   1HG2  VAL  44          HG21      VAL  44   4.698  -1.133   3.165
  322   2HG2  VAL  44          HG22      VAL  44   5.653  -2.504   2.579
  323   3HG2  VAL  44          HG23      VAL  44   6.101  -1.699   4.075
  324    H    ARG  45           HN       ARG  45   4.396  -4.275   6.948
  325    HA   ARG  45           HA       ARG  45   1.886  -5.536   7.049
  326   1HB   ARG  45          HB2       ARG  45   4.445  -5.880   8.545
  327   2HB   ARG  45          HB1       ARG  45   3.042  -6.804   9.038
  328   1HG   ARG  45          HG2       ARG  45   2.892  -7.735   6.763
  329   2HG   ARG  45          HG1       ARG  45   4.319  -6.804   6.308
  330   1HD   ARG  45          HD2       ARG  45   4.289  -8.817   8.539
  331   2HD   ARG  45          HD1       ARG  45   4.726  -9.210   6.876
  332    HE   ARG  45           HE       ARG  45   6.380  -7.245   7.294
  333   1HH1  ARG  45          HH11      ARG  45   5.502  -9.696   9.724
  334   2HH1  ARG  45          HH12      ARG  45   7.082  -9.910  10.307
  335   1HH2  ARG  45          HH21      ARG  45   8.621  -7.567   8.131
  336   2HH2  ARG  45          HH22      ARG  45   8.880  -8.708   9.361
  337    H    GLN  46           HN       GLN  46   3.468  -3.254   9.200
  338    HA   GLN  46           HA       GLN  46   1.416  -3.421  11.167
  339   1HB   GLN  46          HB2       GLN  46   3.663  -1.462  10.786
  340   2HB   GLN  46          HB1       GLN  46   2.494  -1.316  12.094
  341   1HG   GLN  46          HG2       GLN  46   4.306  -3.668  11.598
  342   2HG   GLN  46          HG1       GLN  46   4.519  -2.434  12.842
  343   1HE2  GLN  46          HE21      GLN  46   2.652  -5.178  11.833
  344   2HE2  GLN  46          HE22      GLN  46   1.836  -5.451  13.325
  345    H    ILE  47           HN       ILE  47   1.474  -1.963   8.195
  346    HA   ILE  47           HA       ILE  47  -0.640  -0.111   8.930
  347    HB   ILE  47           HB       ILE  47   0.363  -0.865   6.154
  348   1HG1  ILE  47          HG12      ILE  47   0.910   1.652   7.737
  349   2HG1  ILE  47          HG11      ILE  47   2.050   0.318   7.580
  350   1HG2  ILE  47          HG21      ILE  47  -1.461   1.382   7.042
  351   2HG2  ILE  47          HG22      ILE  47  -1.941  -0.053   6.137
  352   3HG2  ILE  47          HG23      ILE  47  -0.865   1.134   5.398
  353   1HD1  ILE  47          HD11      ILE  47   0.988   2.010   5.327
  354   2HD1  ILE  47          HD12      ILE  47   2.149   0.688   5.172
  355   3HD1  ILE  47          HD13      ILE  47   2.586   2.144   6.063
  356    H    LEU  48           HN       LEU  48  -0.264  -2.738   6.588
  357    HA   LEU  48           HA       LEU  48  -3.000  -3.039   6.151
  358   1HB   LEU  48          HB2       LEU  48  -0.701  -4.846   5.526
  359   2HB   LEU  48          HB1       LEU  48  -2.341  -5.301   5.146
  360    HG   LEU  48           HG       LEU  48  -1.408  -4.478   3.169
  361   1HD1  LEU  48          HD11      LEU  48  -2.752  -2.517   2.621
  362   2HD1  LEU  48          HD12      LEU  48  -3.084  -2.289   4.338
  363   3HD1  LEU  48          HD13      LEU  48  -3.660  -3.740   3.513
  364   1HD2  LEU  48          HD21      LEU  48  -0.355  -2.278   2.925
  365   2HD2  LEU  48          HD22      LEU  48   0.527  -3.313   4.046
  366   3HD2  LEU  48          HD23      LEU  48  -0.507  -2.024   4.663
  367    H    GLU  49           HN       GLU  49  -0.934  -4.982   8.315
  368    HA   GLU  49           HA       GLU  49  -3.136  -6.677   8.950
  369   1HB   GLU  49          HB2       GLU  49  -0.898  -7.620   9.049
  370   2HB   GLU  49          HB1       GLU  49  -0.408  -6.429  10.243
  371   1HG   GLU  49          HG2       GLU  49  -1.927  -7.392  11.866
  372   2HG   GLU  49          HG1       GLU  49  -2.507  -8.542  10.668
  373    H    ARG  50           HN       ARG  50  -1.801  -3.798  10.349
  374    HA   ARG  50           HA       ARG  50  -3.225  -4.094  12.820
  375   1HB   ARG  50          HB2       ARG  50  -1.153  -2.755  12.599
  376   2HB   ARG  50          HB1       ARG  50  -2.026  -1.601  11.603
  377   1HG   ARG  50          HG2       ARG  50  -3.502  -1.127  13.530
  378   2HG   ARG  50          HG1       ARG  50  -2.524  -2.226  14.510
  379   1HD   ARG  50          HD2       ARG  50  -0.539  -0.840  13.998
  380   2HD   ARG  50          HD1       ARG  50  -1.576   0.281  13.123
  381    HE   ARG  50           HE       ARG  50  -1.922  -0.298  15.984
  382   1HH1  ARG  50          HH11      ARG  50  -1.762   2.075  13.302
  383   2HH1  ARG  50          HH12      ARG  50  -1.905   3.427  14.302
  384   1HH2  ARG  50          HH21      ARG  50  -2.105   1.605  17.367
  385   2HH2  ARG  50          HH22      ARG  50  -2.030   3.163  16.673
  386    H    GLU  51           HN       GLU  51  -3.686  -2.205   9.869
  387    HA   GLU  51           HA       GLU  51  -6.075  -0.933  10.743
  388   1HB   GLU  51          HB2       GLU  51  -4.876  -1.255   8.005
  389   2HB   GLU  51          HB1       GLU  51  -6.264  -0.247   8.361
  390   1HG   GLU  51          HG2       GLU  51  -3.512   0.103   9.533
  391   2HG   GLU  51          HG1       GLU  51  -4.156   1.003   8.163
  392    H    HIS  52           HN       HIS  52  -5.481  -3.567   8.384
  393    HA   HIS  52           HA       HIS  52  -8.370  -4.130   8.528
  394   1HB   HIS  52          HB2       HIS  52  -6.628  -3.933   6.096
  395   2HB   HIS  52          HB1       HIS  52  -8.094  -4.885   6.073
  396    HD1  HIS  52           HD1      HIS  52 -10.162  -3.694   5.470
  397    HD2  HIS  52           HD2      HIS  52  -7.145  -1.109   6.686
  398    HE1  HIS  52           HE1      HIS  52 -11.022  -1.387   5.027
  399    HE2  HIS  52           HE2      HIS  52  -9.321   0.115   6.069
  400    H    ASP  53           HN       ASP  53  -5.592  -5.416   9.441
  401    HA   ASP  53           HA       ASP  53  -4.794  -7.448   9.914
  402   1HB   ASP  53          HB2       ASP  53  -7.035  -7.827  10.915
  403   2HB   ASP  53          HB1       ASP  53  -7.639  -8.413   9.374
  404    H    LEU  54           HN       LEU  54  -4.731  -6.460   7.171
  405    HA   LEU  54           HA       LEU  54  -4.693  -8.877   5.576
  406   1HB   LEU  54          HB2       LEU  54  -4.192  -6.001   4.988
  407   2HB   LEU  54          HB1       LEU  54  -3.378  -7.171   3.970
  408    HG   LEU  54           HG       LEU  54  -5.608  -8.097   3.364
  409   1HD1  LEU  54          HD11      LEU  54  -6.879  -7.410   5.304
  410   2HD1  LEU  54          HD12      LEU  54  -7.605  -6.785   3.819
  411   3HD1  LEU  54          HD13      LEU  54  -6.653  -5.718   4.857
  412   1HD2  LEU  54          HD21      LEU  54  -6.226  -6.244   1.887
  413   2HD2  LEU  54          HD22      LEU  54  -4.485  -6.518   1.918
  414   3HD2  LEU  54          HD23      LEU  54  -5.182  -5.168   2.815
  415    H    VAL  55           HN       VAL  55  -3.181 -10.283   6.016
  416    HA   VAL  55           HA       VAL  55  -0.582  -9.359   6.868
  417    HB   VAL  55           HB       VAL  55  -1.508 -12.208   6.374
  418   1HG1  VAL  55          HG11      VAL  55   0.916 -11.970   6.328
  419   2HG1  VAL  55          HG12      VAL  55   0.418 -12.834   7.781
  420   3HG1  VAL  55          HG13      VAL  55   0.880 -11.138   7.881
  421   1HG2  VAL  55          HG21      VAL  55  -1.777 -12.379   8.802
  422   2HG2  VAL  55          HG22      VAL  55  -2.850 -11.155   8.120
  423   3HG2  VAL  55          HG23      VAL  55  -1.377 -10.671   8.964
  424    H    LEU  56           HN       LEU  56   0.204  -8.357   5.107
  425    HA   LEU  56           HA       LEU  56   0.566  -9.954   2.705
  426   1HB   LEU  56          HB2       LEU  56   1.316  -7.085   3.232
  427   2HB   LEU  56          HB1       LEU  56   1.476  -7.903   1.699
  428    HG   LEU  56           HG       LEU  56  -1.129  -7.218   3.073
  429   1HD1  LEU  56          HD11      LEU  56   0.144  -6.184   0.549
  430   2HD1  LEU  56          HD12      LEU  56  -0.053  -5.302   2.065
  431   3HD1  LEU  56          HD13      LEU  56  -1.469  -5.773   1.127
  432   1HD2  LEU  56          HD21      LEU  56  -2.220  -8.107   1.066
  433   2HD2  LEU  56          HD22      LEU  56  -1.303  -9.361   1.899
  434   3HD2  LEU  56          HD23      LEU  56  -0.654  -8.620   0.437
  435    HA   PRO  57           HA       PRO  57   4.419 -10.998   4.677
  436   1HB   PRO  57          HB2       PRO  57   4.629 -12.971   2.575
  437   2HB   PRO  57          HB1       PRO  57   4.372 -13.226   4.304
  438   1HG   PRO  57          HG2       PRO  57   2.485 -13.741   2.425
  439   2HG   PRO  57          HG1       PRO  57   2.082 -13.229   4.077
  440   1HD   PRO  57          HD2       PRO  57   2.211 -11.638   1.561
  441   2HD   PRO  57          HD1       PRO  57   0.996 -11.605   2.857
  442    H    ILE  58           HN       ILE  58   6.625 -11.460   3.800
  443    HA   ILE  58           HA       ILE  58   7.411  -9.334   2.137
  444    HB   ILE  58           HB       ILE  58   8.919 -11.640   3.389
  445   1HG1  ILE  58          HG12      ILE  58  10.197  -9.725   4.442
  446   2HG1  ILE  58          HG11      ILE  58   9.043  -8.665   3.632
  447   1HG2  ILE  58          HG21      ILE  58   9.982 -11.385   1.232
  448   2HG2  ILE  58          HG22      ILE  58  11.035 -10.788   2.514
  449   3HG2  ILE  58          HG23      ILE  58  10.147  -9.650   1.498
  450   1HD1  ILE  58          HD11      ILE  58   7.234  -9.611   4.949
  451   2HD1  ILE  58          HD12      ILE  58   8.501  -8.981   6.002
  452   3HD1  ILE  58          HD13      ILE  58   8.360 -10.719   5.733
  453    H    ARG  59           HN       ARG  59   6.816 -12.683   1.596
  454    HA   ARG  59           HA       ARG  59   7.805 -12.684  -1.060
  455   1HB   ARG  59          HB2       ARG  59   6.609 -14.834  -1.424
  456   2HB   ARG  59          HB1       ARG  59   7.687 -14.834  -0.048
  457   1HG   ARG  59          HG2       ARG  59   4.795 -14.279   0.397
  458   2HG   ARG  59          HG1       ARG  59   5.309 -15.932   0.060
  459   1HD   ARG  59          HD2       ARG  59   6.390 -14.176   2.264
  460   2HD   ARG  59          HD1       ARG  59   5.192 -15.454   2.469
  461    HE   ARG  59           HE       ARG  59   7.678 -16.257   1.233
  462   1HH1  ARG  59          HH11      ARG  59   5.754 -16.143   4.243
  463   2HH1  ARG  59          HH12      ARG  59   6.828 -17.156   5.093
  464   1HH2  ARG  59          HH21      ARG  59   9.111 -17.689   2.445
  465   2HH2  ARG  59          HH22      ARG  59   8.721 -18.097   4.048
  466    H    GLU  60           HN       GLU  60   5.238 -11.019   0.035
  467    HA   GLU  60           HA       GLU  60   4.122 -11.029  -2.669
  468   1HB   GLU  60          HB2       GLU  60   2.724 -10.324  -0.085
  469   2HB   GLU  60          HB1       GLU  60   2.062  -9.965  -1.677
  470   1HG   GLU  60          HG2       GLU  60   2.200 -12.405  -2.181
  471   2HG   GLU  60          HG1       GLU  60   2.623 -12.658  -0.487
  472    H    VAL  61           HN       VAL  61   4.855  -8.948   0.099
  473    HA   VAL  61           HA       VAL  61   4.480  -6.509  -1.186
  474    HB   VAL  61           HB       VAL  61   6.406  -7.083   1.096
  475   1HG1  VAL  61          HG11      VAL  61   6.816  -4.898   0.098
  476   2HG1  VAL  61          HG12      VAL  61   6.118  -4.737   1.710
  477   3HG1  VAL  61          HG13      VAL  61   5.110  -4.484   0.282
  478   1HG2  VAL  61          HG21      VAL  61   4.166  -7.839   1.628
  479   2HG2  VAL  61          HG22      VAL  61   3.503  -6.275   1.157
  480   3HG2  VAL  61          HG23      VAL  61   4.560  -6.399   2.565
  481    H    ARG  62           HN       ARG  62   7.224  -8.645  -1.218
  482    HA   ARG  62           HA       ARG  62   9.169  -6.933  -2.171
  483   1HB   ARG  62          HB2       ARG  62   8.803  -9.816  -2.087
  484   2HB   ARG  62          HB1       ARG  62   9.897  -9.299  -3.348
  485   1HG   ARG  62          HG2       ARG  62  11.135  -8.013  -1.594
  486   2HG   ARG  62          HG1       ARG  62  10.099  -8.779  -0.389
  487   1HD   ARG  62          HD2       ARG  62  10.863 -10.991  -1.068
  488   2HD   ARG  62          HD1       ARG  62  11.845 -10.287  -2.351
  489    HE   ARG  62           HE       ARG  62  12.824  -9.063  -0.189
  490   1HH1  ARG  62          HH11      ARG  62  12.249 -12.526  -0.821
  491   2HH1  ARG  62          HH12      ARG  62  13.456 -13.049   0.254
  492   1HH2  ARG  62          HH21      ARG  62  14.518  -9.829   1.287
  493   2HH2  ARG  62          HH22      ARG  62  14.833 -11.481   1.406
  494    H    GLN  63           HN       GLN  63   6.446  -8.202  -3.893
  495    HA   GLN  63           HA       GLN  63   7.811  -7.625  -6.431
  496   1HB   GLN  63          HB2       GLN  63   5.451  -9.477  -6.038
  497   2HB   GLN  63          HB1       GLN  63   6.219  -9.119  -7.576
  498   1HG   GLN  63          HG2       GLN  63   7.440 -10.940  -7.210
  499   2HG   GLN  63          HG1       GLN  63   8.339  -9.947  -6.071
  500   1HE2  GLN  63          HE21      GLN  63   5.826  -9.919  -4.361
  501   2HE2  GLN  63          HE22      GLN  63   5.869 -11.442  -3.552
  502    H    LEU  64           HN       LEU  64   6.205  -6.040  -4.463
  503    HA   LEU  64           HA       LEU  64   4.162  -4.964  -6.215
  504   1HB   LEU  64          HB2       LEU  64   5.172  -3.928  -3.551
  505   2HB   LEU  64          HB1       LEU  64   3.744  -3.356  -4.397
  506    HG   LEU  64           HG       LEU  64   4.120  -6.091  -3.174
  507   1HD1  LEU  64          HD11      LEU  64   2.349  -3.805  -2.366
  508   2HD1  LEU  64          HD12      LEU  64   3.787  -4.373  -1.519
  509   3HD1  LEU  64          HD13      LEU  64   2.363  -5.408  -1.633
  510   1HD2  LEU  64          HD21      LEU  64   2.753  -6.242  -5.184
  511   2HD2  LEU  64          HD22      LEU  64   1.723  -4.933  -4.603
  512   3HD2  LEU  64          HD23      LEU  64   1.758  -6.473  -3.746
  513    H    THR  65           HN       THR  65   4.299  -2.708  -7.003
  514    HA   THR  65           HA       THR  65   7.085  -2.005  -7.602
  515    HB   THR  65           HB       THR  65   6.076  -1.018  -9.659
  516    HG1  THR  65           HG1      THR  65   3.910  -1.355 -10.031
  517   1HG2  THR  65          HG21      THR  65   5.595  -3.179 -10.710
  518   2HG2  THR  65          HG22      THR  65   5.326  -3.858  -9.094
  519   3HG2  THR  65          HG23      THR  65   6.946  -3.344  -9.555
  520    H    LEU  66           HN       LEU  66   5.950  -1.160  -5.279
  521    HA   LEU  66           HA       LEU  66   5.717   0.595  -3.895
  522   1HB   LEU  66          HB2       LEU  66   7.752   1.354  -5.278
  523   2HB   LEU  66          HB1       LEU  66   6.649   2.383  -6.154
  524    HG   LEU  66           HG       LEU  66   7.945   3.602  -4.448
  525   1HD1  LEU  66          HD11      LEU  66   5.021   3.453  -3.852
  526   2HD1  LEU  66          HD12      LEU  66   5.787   4.469  -5.076
  527   3HD1  LEU  66          HD13      LEU  66   6.094   4.768  -3.358
  528   1HD2  LEU  66          HD21      LEU  66   8.202   1.821  -2.816
  529   2HD2  LEU  66          HD22      LEU  66   6.472   1.866  -2.475
  530   3HD2  LEU  66          HD23      LEU  66   7.486   3.251  -2.069
  531    H    ARG  67           HN       ARG  67   4.659   2.006  -7.002
  532    HA   ARG  67           HA       ARG  67   2.419   3.262  -5.698
  533   1HB   ARG  67          HB2       ARG  67   3.304   3.083  -8.551
  534   2HB   ARG  67          HB1       ARG  67   1.656   3.588  -8.196
  535   1HG   ARG  67          HG2       ARG  67   4.149   4.928  -7.143
  536   2HG   ARG  67          HG1       ARG  67   3.165   5.506  -8.496
  537   1HD   ARG  67          HD2       ARG  67   1.202   5.528  -6.912
  538   2HD   ARG  67          HD1       ARG  67   2.329   5.187  -5.624
  539    HE   ARG  67           HE       ARG  67   3.365   7.340  -6.020
  540   1HH1  ARG  67          HH11      ARG  67   0.267   6.864  -7.662
  541   2HH1  ARG  67          HH12      ARG  67  -0.262   8.463  -7.455
  542   1HH2  ARG  67          HH21      ARG  67   2.614   9.603  -5.725
  543   2HH2  ARG  67          HH22      ARG  67   1.100  10.032  -6.407
  544    H    LYS  68           HN       LYS  68   2.923   0.193  -6.993
  545    HA   LYS  68           HA       LYS  68   0.267  -0.594  -7.515
  546   1HB   LYS  68          HB2       LYS  68   2.320  -1.902  -8.113
  547   2HB   LYS  68          HB1       LYS  68   2.480  -2.297  -6.402
  548   1HG   LYS  68          HG2       LYS  68   0.385  -3.457  -6.428
  549   2HG   LYS  68          HG1       LYS  68   0.141  -3.029  -8.122
  550   1HD   LYS  68          HD2       LYS  68   2.089  -4.309  -8.751
  551   2HD   LYS  68          HD1       LYS  68   2.426  -4.671  -7.055
  552   1HE   LYS  68          HE2       LYS  68   1.317  -6.551  -8.066
  553   2HE   LYS  68          HE1       LYS  68   0.275  -5.763  -6.876
  554   1HZ   LYS  68          HZ1       LYS  68  -0.955  -6.346  -8.810
  555   2HZ   LYS  68          HZ2       LYS  68   0.073  -5.481  -9.829
  556   3HZ   LYS  68          HZ3       LYS  68  -0.920  -4.660  -8.721
  557    H    LEU  69           HN       LEU  69   1.945   0.009  -4.610
  558    HA   LEU  69           HA       LEU  69   0.406  -1.381  -2.719
  559   1HB   LEU  69          HB2       LEU  69   1.938   1.173  -2.535
  560   2HB   LEU  69          HB1       LEU  69   0.830   0.792  -1.239
  561    HG   LEU  69           HG       LEU  69   3.087   0.175  -0.648
  562   1HD1  LEU  69          HD11      LEU  69   1.302  -1.147   0.267
  563   2HD1  LEU  69          HD12      LEU  69   2.727  -2.151  -0.014
  564   3HD1  LEU  69          HD13      LEU  69   1.359  -2.231  -1.124
  565   1HD2  LEU  69          HD21      LEU  69   4.294  -1.623  -1.808
  566   2HD2  LEU  69          HD22      LEU  69   4.023  -0.238  -2.866
  567   3HD2  LEU  69          HD23      LEU  69   3.023  -1.681  -3.030
  568    H    GLN  70           HN       GLN  70  -0.533   1.307  -4.660
  569    HA   GLN  70           HA       GLN  70  -2.792   1.956  -3.020
  570   1HB   GLN  70          HB2       GLN  70  -2.020   2.832  -5.782
  571   2HB   GLN  70          HB1       GLN  70  -3.494   3.422  -4.976
  572   1HG   GLN  70          HG2       GLN  70  -1.643   4.044  -3.165
  573   2HG   GLN  70          HG1       GLN  70  -0.620   3.998  -4.571
  574   1HE2  GLN  70          HE21      GLN  70  -1.032   5.458  -6.310
  575   2HE2  GLN  70          HE22      GLN  70  -1.924   6.894  -6.049
  576    H    GLU  71           HN       GLU  71  -2.183  -0.645  -4.962
  577    HA   GLU  71           HA       GLU  71  -5.005  -0.976  -5.646
  578   1HB   GLU  71          HB2       GLU  71  -2.743  -2.937  -6.086
  579   2HB   GLU  71          HB1       GLU  71  -4.345  -2.995  -6.797
  580   1HG   GLU  71          HG2       GLU  71  -3.753  -0.790  -7.908
  581   2HG   GLU  71          HG1       GLU  71  -2.091  -1.133  -7.425
  582    H    MET  72           HN       MET  72  -2.827  -1.455  -3.203
  583    HA   MET  72           HA       MET  72  -4.281  -3.754  -2.030
  584   1HB   MET  72          HB2       MET  72  -1.530  -2.759  -1.244
  585   2HB   MET  72          HB1       MET  72  -2.284  -4.282  -0.817
  586   1HG   MET  72          HG2       MET  72  -1.213  -3.479  -3.517
  587   2HG   MET  72          HG1       MET  72  -0.531  -4.645  -2.397
  588   1HE   MET  72          HE1       MET  72  -3.141  -7.568  -2.516
  589   2HE   MET  72          HE2       MET  72  -3.094  -6.223  -1.371
  590   3HE   MET  72          HE3       MET  72  -1.597  -7.019  -1.861
  591    H    SER  73           HN       SER  73  -4.606  -0.672  -2.065
  592    HA   SER  73           HA       SER  73  -3.728   0.251   0.404
  593   1HB   SER  73          HB2       SER  73  -5.064   2.273  -0.215
  594   2HB   SER  73          HB1       SER  73  -3.825   1.763  -1.362
  595    HG   SER  73           HG       SER  73  -5.985   2.333  -2.150
  596    H    SER  74           HN       SER  74  -6.560  -1.419  -0.563
  597    HA   SER  74           HA       SER  74  -8.399  -2.123   0.474
  598   1HB   SER  74          HB2       SER  74  -7.223  -0.900   2.992
  599   2HB   SER  74          HB1       SER  74  -8.574  -2.038   2.935
  600    HG   SER  74           HG       SER  74  -5.950  -2.531   1.984
  601    H    LYS  75           HN       LYS  75  -7.820   0.805  -0.373
  602    HA   LYS  75           HA       LYS  75 -10.302   1.981   0.663
  603   1HB   LYS  75          HB2       LYS  75  -8.031   3.264  -0.866
  604   2HB   LYS  75          HB1       LYS  75  -9.493   4.082  -0.364
  605   1HG   LYS  75          HG2       LYS  75  -8.828   3.611   2.003
  606   2HG   LYS  75          HG1       LYS  75  -7.277   3.033   1.370
  607   1HD   LYS  75          HD2       LYS  75  -6.883   5.167   0.297
  608   2HD   LYS  75          HD1       LYS  75  -8.458   5.748   0.830
  609   1HE   LYS  75          HE2       LYS  75  -7.668   5.418   3.185
  610   2HE   LYS  75          HE1       LYS  75  -6.062   5.096   2.525
  611   1HZ   LYS  75          HZ1       LYS  75  -7.639   7.556   2.098
  612   2HZ   LYS  75          HZ2       LYS  75  -6.130   7.310   1.468
  613   3HZ   LYS  75          HZ3       LYS  75  -6.342   7.447   3.166
  614    H    ALA  76           HN       ALA  76 -11.976   1.991  -0.662
  615    HA   ALA  76           HA       ALA  76 -11.741   0.854  -3.276
  616   1HB   ALA  76          HB1       ALA  76 -14.160   1.236  -3.421
  617   2HB   ALA  76          HB2       ALA  76 -14.101   2.197  -1.942
  618   3HB   ALA  76          HB3       ALA  76 -13.737   0.473  -1.885
  619    H    GLY  77           HN       GLY  77 -11.459   1.890  -5.143
  620   1HA   GLY  77          HA2       GLY  77 -10.941   4.702  -5.108
  621   2HA   GLY  77          HA1       GLY  77 -10.860   3.630  -6.502
  622    H    SER  78           HN       SER  78 -13.089   5.259  -4.378
  623    HA   SER  78           HA       SER  78 -14.728   5.831  -6.685
  624   1HB   SER  78          HB2       SER  78 -15.807   4.684  -4.096
  625   2HB   SER  78          HB1       SER  78 -16.792   5.288  -5.434
  626    HG   SER  78           HG       SER  78 -15.360   3.762  -6.676
  627    H    ASP  79           HN       ASP  79 -14.018   7.820  -6.682
  628    HA   ASP  79           HA       ASP  79 -14.131   9.596  -4.448
  629   1HB   ASP  79          HB2       ASP  79 -12.526  10.084  -6.140
  630   2HB   ASP  79          HB1       ASP  79 -13.725   9.945  -7.418
  631    H    THR  80           HN       THR  80 -15.901   9.222  -7.448
  632    HA   THR  80           HA       THR  80 -18.260  10.293  -6.080
  633    HB   THR  80           HB       THR  80 -17.460  10.883  -8.955
  634    HG1  THR  80           HG1      THR  80 -16.245  12.135  -7.401
  635   1HG2  THR  80          HG21      THR  80 -19.805  11.889  -7.327
  636   2HG2  THR  80          HG22      THR  80 -19.901  10.746  -8.665
  637   3HG2  THR  80          HG23      THR  80 -19.389  12.409  -8.960
  638    H    GLU  81           HN       GLU  81 -16.973   8.219  -8.658
  639    HA   GLU  81           HA       GLU  81 -19.296   6.487  -8.370
  640   1HB   GLU  81          HB2       GLU  81 -18.297   7.621 -10.994
  641   2HB   GLU  81          HB1       GLU  81 -19.376   6.232 -10.887
  642   1HG   GLU  81          HG2       GLU  81 -21.083   7.570  -9.853
  643   2HG   GLU  81          HG1       GLU  81 -19.999   8.954  -9.767
  644    H    LEU  82           HN       LEU  82 -18.789   4.431  -9.870
  645    HA   LEU  82           HA       LEU  82 -16.510   3.299  -8.666
  646   1HB   LEU  82          HB2       LEU  82 -18.271   2.231 -10.856
  647   2HB   LEU  82          HB1       LEU  82 -16.999   1.303 -10.090
  648    HG   LEU  82           HG       LEU  82 -19.448   2.408  -8.716
  649   1HD1  LEU  82          HD11      LEU  82 -18.680  -0.411  -9.446
  650   2HD1  LEU  82          HD12      LEU  82 -19.955   0.551 -10.193
  651   3HD1  LEU  82          HD13      LEU  82 -20.092   0.066  -8.504
  652   1HD2  LEU  82          HD21      LEU  82 -18.695   1.113  -6.783
  653   2HD2  LEU  82          HD22      LEU  82 -17.519   2.353  -7.218
  654   3HD2  LEU  82          HD23      LEU  82 -17.223   0.667  -7.648
  655    H    ALA  83           HN       ALA  83 -17.057   3.560 -12.203
  656    HA   ALA  83           HA       ALA  83 -14.150   3.975 -12.332
  657   1HB   ALA  83          HB1       ALA  83 -15.831   2.564 -14.401
  658   2HB   ALA  83          HB2       ALA  83 -14.761   1.778 -13.239
  659   3HB   ALA  83          HB3       ALA  83 -14.092   2.838 -14.478
  660    H    ALA  84           HN       ALA  84 -13.954   6.036 -12.530
  661    HA   ALA  84           HA       ALA  84 -13.903   8.096 -13.364
  662   1HB   ALA  84          HB1       ALA  84 -13.274   6.978 -15.468
  663   2HB   ALA  84          HB2       ALA  84 -14.180   8.464 -15.754
  664   3HB   ALA  84          HB3       ALA  84 -14.976   6.900 -15.922
  665    HA   PRO  85           HA       PRO  85 -18.070   9.369 -12.203
  666   1HB   PRO  85          HB2       PRO  85 -16.646  11.970 -12.074
  667   2HB   PRO  85          HB1       PRO  85 -17.634  11.173 -10.843
  668   1HG   PRO  85          HG2       PRO  85 -14.981  11.287 -10.605
  669   2HG   PRO  85          HG1       PRO  85 -15.889   9.848 -10.109
  670   1HD   PRO  85          HD2       PRO  85 -14.275  10.308 -12.581
  671   2HD   PRO  85          HD1       PRO  85 -14.399   8.857 -11.566
  672    H    LYS  86           HN       LYS  86 -19.607  10.305 -13.390
  673    HA   LYS  86           HA       LYS  86 -19.195  10.825 -16.139
  674   1HB   LYS  86          HB2       LYS  86 -21.564  11.693 -14.463
  675   2HB   LYS  86          HB1       LYS  86 -21.531  11.497 -16.206
  676   1HG   LYS  86          HG2       LYS  86 -21.263   9.294 -14.164
  677   2HG   LYS  86          HG1       LYS  86 -22.696   9.662 -15.121
  678   1HD   LYS  86          HD2       LYS  86 -21.484   9.111 -17.163
  679   2HD   LYS  86          HD1       LYS  86 -20.025   8.796 -16.222
  680   1HE   LYS  86          HE2       LYS  86 -22.636   7.310 -15.927
  681   2HE   LYS  86          HE1       LYS  86 -21.244   6.729 -16.834
  682   1HZ   LYS  86          HZ1       LYS  86 -19.968   6.627 -14.810
  683   2HZ   LYS  86          HZ2       LYS  86 -21.380   5.786 -14.577
  684   3HZ   LYS  86          HZ3       LYS  86 -21.212   7.317 -13.903
  685    H    SER  87           HN       SER  87 -19.610  12.911 -13.341
  686    HA   SER  87           HA       SER  87 -18.483  15.072 -14.927
  687   1HB   SER  87          HB2       SER  87 -20.927  15.339 -15.046
  688   2HB   SER  87          HB1       SER  87 -21.006  15.378 -13.286
  689    HG   SER  87           HG       SER  87 -20.672  17.432 -13.456
  690    H    LYS  88           HN       LYS  88 -19.296  13.799 -11.696
  691    HA   LYS  88           HA       LYS  88 -18.393  14.024  -9.665
  692   1HB   LYS  88          HB2       LYS  88 -16.116  13.940 -10.583
  693   2HB   LYS  88          HB1       LYS  88 -16.198  15.637 -11.025
  694   1HG   LYS  88          HG2       LYS  88 -16.271  16.248  -8.652
  695   2HG   LYS  88          HG1       LYS  88 -16.188  14.540  -8.213
  696   1HD   LYS  88          HD2       LYS  88 -14.009  14.351  -9.273
  697   2HD   LYS  88          HD1       LYS  88 -14.104  16.029  -9.805
  698   1HE   LYS  88          HE2       LYS  88 -12.682  15.779  -7.822
  699   2HE   LYS  88          HE1       LYS  88 -14.086  16.789  -7.503
  700   1HZ   LYS  88          HZ1       LYS  88 -13.554  15.145  -5.737
  701   2HZ   LYS  88          HZ2       LYS  88 -14.015  13.886  -6.784
  702   3HZ   LYS  88          HZ3       LYS  88 -15.120  15.040  -6.314
  703    H    ASN  89           HN       ASN  89 -18.663  16.887 -11.553
  704    HA   ASN  89           HA       ASN  89 -19.742  18.369  -9.274
  705   1HB   ASN  89          HB2       ASN  89 -18.005  19.548 -10.572
  706   2HB   ASN  89          HB1       ASN  89 -18.911  19.272 -12.051
  707   1HD2  ASN  89          HD21      ASN  89 -19.133  21.393 -12.515
  708   2HD2  ASN  89          HD22      ASN  89 -20.164  22.476 -11.663
  Start of MODEL    8
    1   1H    GLY   1          HT1       GLY   1  -7.531  12.418  12.187
    2   2H    GLY   1          HT2       GLY   1  -8.358  12.957  13.588
    3   3H    GLY   1          HT3       GLY   1  -7.015  11.942  13.720
    4   1HA   GLY   1          HA1       GLY   1  -6.883  14.654  12.601
    5   2HA   GLY   1          HA2       GLY   1  -6.478  14.227  14.261
    6    H    ASP   2           HN       ASP   2  -4.996  12.166  14.292
    7    HA   ASP   2           HA       ASP   2  -2.632  13.034  12.854
    8   1HB   ASP   2          HB2       ASP   2  -2.330  12.667  15.206
    9   2HB   ASP   2          HB1       ASP   2  -3.032  11.059  15.101
   10    H    GLY   3           HN       GLY   3  -4.781  10.296  13.030
   11   1HA   GLY   3          HA2       GLY   3  -4.333   9.427  10.441
   12   2HA   GLY   3          HA1       GLY   3  -3.223   8.516  11.470
   13    H    GLU   4           HN       GLU   4  -4.456   8.153  13.670
   14    HA   GLU   4           HA       GLU   4  -6.021   7.194  14.939
   15   1HB   GLU   4          HB2       GLU   4  -8.073   7.330  12.733
   16   2HB   GLU   4          HB1       GLU   4  -8.352   7.231  14.459
   17   1HG   GLU   4          HG2       GLU   4  -7.585   9.589  12.788
   18   2HG   GLU   4          HG1       GLU   4  -8.911   9.411  13.929
   19    H    ALA   5           HN       ALA   5  -6.307   6.094  11.647
   20    HA   ALA   5           HA       ALA   5  -6.073   3.322  12.554
   21   1HB   ALA   5          HB1       ALA   5  -7.697   2.703  10.793
   22   2HB   ALA   5          HB2       ALA   5  -7.951   4.412  10.438
   23   3HB   ALA   5          HB3       ALA   5  -8.423   3.757  12.007
   24    H    GLN   6           HN       GLN   6  -6.126   2.304   9.982
   25    HA   GLN   6           HA       GLN   6  -3.671   2.139   9.013
   26   1HB   GLN   6          HB2       GLN   6  -5.436   0.812   8.142
   27   2HB   GLN   6          HB1       GLN   6  -6.247   2.210   7.467
   28   1HG   GLN   6          HG2       GLN   6  -4.494   2.474   5.832
   29   2HG   GLN   6          HG1       GLN   6  -3.588   1.147   6.557
   30   1HE2  GLN   6          HE21      GLN   6  -4.256  -0.953   6.212
   31   2HE2  GLN   6          HE22      GLN   6  -5.417  -1.314   4.969
   32    H    ARG   7           HN       ARG   7  -2.184   3.419   8.336
   33    HA   ARG   7           HA       ARG   7  -2.695   6.152   7.659
   34   1HB   ARG   7          HB2       ARG   7  -0.280   6.391   7.596
   35   2HB   ARG   7          HB1       ARG   7  -0.726   5.437   9.001
   36   1HG   ARG   7          HG2       ARG   7  -0.193   3.395   7.561
   37   2HG   ARG   7          HG1       ARG   7   0.584   4.530   6.458
   38   1HD   ARG   7          HD2       ARG   7   1.281   4.000   9.348
   39   2HD   ARG   7          HD1       ARG   7   2.243   3.597   7.936
   40    HE   ARG   7           HE       ARG   7   1.706   6.405   8.230
   41   1HH1  ARG   7          HH11      ARG   7   4.019   3.762   8.981
   42   2HH1  ARG   7          HH12      ARG   7   5.225   4.805   9.510
   43   1HH2  ARG   7          HH21      ARG   7   3.425   7.827   9.013
   44   2HH2  ARG   7          HH22      ARG   7   4.914   7.139   9.530
   45    H    ASP   8           HN       ASP   8  -2.058   7.171   5.658
   46    HA   ASP   8           HA       ASP   8  -2.926   5.741   3.393
   47   1HB   ASP   8          HB2       ASP   8  -1.500   8.401   3.571
   48   2HB   ASP   8          HB1       ASP   8  -2.049   7.711   2.050
   49    H    LEU   9           HN       LEU   9  -2.021   4.507   2.117
   50    HA   LEU   9           HA       LEU   9   0.315   3.169   2.607
   51   1HB   LEU   9          HB2       LEU   9  -1.467   3.339   0.229
   52   2HB   LEU   9          HB1       LEU   9   0.025   2.438   0.120
   53    HG   LEU   9           HG       LEU   9  -1.953   1.049   0.568
   54   1HD1  LEU   9          HD11      LEU   9   0.111   1.082   2.753
   55   2HD1  LEU   9          HD12      LEU   9   0.235   0.255   1.199
   56   3HD1  LEU   9          HD13      LEU   9  -0.959  -0.269   2.387
   57   1HD2  LEU   9          HD21      LEU   9  -3.235   2.575   1.977
   58   2HD2  LEU   9          HD22      LEU   9  -2.024   2.426   3.256
   59   3HD2  LEU   9          HD23      LEU   9  -2.987   1.025   2.777
   60    H    VAL  10           HN       VAL  10  -0.100   5.419  -0.134
   61    HA   VAL  10           HA       VAL  10   2.701   5.134  -0.715
   62    HB   VAL  10           HB       VAL  10   0.537   6.836  -2.015
   63   1HG1  VAL  10          HG11      VAL  10   2.134   7.299  -3.814
   64   2HG1  VAL  10          HG12      VAL  10   3.403   6.454  -2.926
   65   3HG1  VAL  10          HG13      VAL  10   2.729   7.952  -2.287
   66   1HG2  VAL  10          HG21      VAL  10   2.004   4.363  -2.907
   67   2HG2  VAL  10          HG22      VAL  10   0.785   5.229  -3.838
   68   3HG2  VAL  10          HG23      VAL  10   0.343   4.435  -2.334
   69    H    LYS  11           HN       LYS  11   0.706   7.254   1.054
   70    HA   LYS  11           HA       LYS  11   2.528   9.413   1.158
   71   1HB   LYS  11          HB2       LYS  11   0.096   9.629   1.613
   72   2HB   LYS  11          HB1       LYS  11   0.304   8.688   3.076
   73   1HG   LYS  11          HG2       LYS  11   0.192  10.922   3.792
   74   2HG   LYS  11          HG1       LYS  11   1.902  10.489   3.835
   75   1HD   LYS  11          HD2       LYS  11   0.575  12.038   1.591
   76   2HD   LYS  11          HD1       LYS  11   1.441  12.782   2.926
   77   1HE   LYS  11          HE2       LYS  11   2.615  10.920   0.848
   78   2HE   LYS  11          HE1       LYS  11   2.811  12.666   0.891
   79   1HZ   LYS  11          HZ1       LYS  11   3.817  10.764   2.955
   80   2HZ   LYS  11          HZ2       LYS  11   3.997  12.453   2.989
   81   3HZ   LYS  11          HZ3       LYS  11   4.721  11.562   1.764
   82    H    ALA  12           HN       ALA  12   2.362   6.357   2.649
   83    HA   ALA  12           HA       ALA  12   4.253   7.109   4.754
   84   1HB   ALA  12          HB1       ALA  12   2.635   4.591   4.383
   85   2HB   ALA  12          HB2       ALA  12   2.266   5.910   5.495
   86   3HB   ALA  12          HB3       ALA  12   3.710   4.927   5.743
   87    H    VAL  13           HN       VAL  13   3.732   4.380   2.506
   88    HA   VAL  13           HA       VAL  13   6.265   3.231   2.842
   89    HB   VAL  13           HB       VAL  13   4.344   2.933   0.509
   90   1HG1  VAL  13          HG11      VAL  13   5.508   0.839   0.011
   91   2HG1  VAL  13          HG12      VAL  13   6.681   1.178   1.287
   92   3HG1  VAL  13          HG13      VAL  13   6.590   2.225  -0.132
   93   1HG2  VAL  13          HG21      VAL  13   4.760   1.237   2.969
   94   2HG2  VAL  13          HG22      VAL  13   3.664   0.859   1.640
   95   3HG2  VAL  13          HG23      VAL  13   3.375   2.279   2.645
   96    H    ALA  14           HN       ALA  14   5.089   5.412   0.296
   97    HA   ALA  14           HA       ALA  14   7.599   5.354  -1.043
   98   1HB   ALA  14          HB1       ALA  14   5.499   5.859  -2.253
   99   2HB   ALA  14          HB2       ALA  14   6.693   7.133  -2.478
  100   3HB   ALA  14          HB3       ALA  14   5.345   7.364  -1.359
  101    H    HIS  15           HN       HIS  15   6.237   7.141   1.535
  102    HA   HIS  15           HA       HIS  15   8.004   9.383   1.423
  103   1HB   HIS  15          HB2       HIS  15   5.753   9.256   2.631
  104   2HB   HIS  15          HB1       HIS  15   6.591   8.361   3.888
  105    HD1  HIS  15           HD1      HIS  15   5.613  10.529   5.307
  106    HD2  HIS  15           HD2      HIS  15   8.774  11.241   2.685
  107    HE1  HIS  15           HE1      HIS  15   6.563  12.731   5.966
  108    HE2  HIS  15           HE2      HIS  15   8.682  12.886   4.637
  109    H    ILE  16           HN       ILE  16   8.166   6.177   2.751
  110    HA   ILE  16           HA       ILE  16  10.364   6.469   4.477
  111    HB   ILE  16           HB       ILE  16   9.598   4.057   2.785
  112   1HG1  ILE  16          HG12      ILE  16   7.769   4.712   4.258
  113   2HG1  ILE  16          HG11      ILE  16   8.477   3.202   4.810
  114   1HG2  ILE  16          HG21      ILE  16  10.831   2.689   4.406
  115   2HG2  ILE  16          HG22      ILE  16  11.400   4.158   5.199
  116   3HG2  ILE  16          HG23      ILE  16  11.874   3.811   3.535
  117   1HD1  ILE  16          HD11      ILE  16   8.938   5.933   5.996
  118   2HD1  ILE  16          HD12      ILE  16   9.679   4.437   6.563
  119   3HD1  ILE  16          HD13      ILE  16   7.932   4.654   6.672
  120    H    LEU  17           HN       LEU  17  10.124   5.949   1.022
  121    HA   LEU  17           HA       LEU  17  13.004   5.845   0.635
  122   1HB   LEU  17          HB2       LEU  17  10.758   5.920  -1.376
  123   2HB   LEU  17          HB1       LEU  17  12.448   5.662  -1.752
  124    HG   LEU  17           HG       LEU  17  10.716   3.820  -0.117
  125   1HD1  LEU  17          HD11      LEU  17  11.777   3.561  -2.920
  126   2HD1  LEU  17          HD12      LEU  17  10.095   3.844  -2.467
  127   3HD1  LEU  17          HD13      LEU  17  10.882   2.326  -2.036
  128   1HD2  LEU  17          HD21      LEU  17  13.547   3.515  -1.107
  129   2HD2  LEU  17          HD22      LEU  17  12.607   2.276  -0.272
  130   3HD2  LEU  17          HD23      LEU  17  13.055   3.758   0.569
  131    H    GLY  18           HN       GLY  18  10.583   8.194   0.759
  132   1HA   GLY  18          HA2       GLY  18  10.974  10.513   0.821
  133   2HA   GLY  18          HA1       GLY  18  12.500  10.251  -0.016
  134    H    ILE  19           HN       ILE  19   9.443   8.914  -1.037
  135    HA   ILE  19           HA       ILE  19   9.333  10.778  -3.280
  136    HB   ILE  19           HB       ILE  19   8.261   8.649  -4.435
  137   1HG1  ILE  19          HG12      ILE  19  10.307   7.429  -2.575
  138   2HG1  ILE  19          HG11      ILE  19   8.581   7.118  -2.595
  139   1HG2  ILE  19          HG21      ILE  19  10.400   8.228  -5.580
  140   2HG2  ILE  19          HG22      ILE  19  11.213   9.238  -4.378
  141   3HG2  ILE  19          HG23      ILE  19   9.974   9.926  -5.448
  142   1HD1  ILE  19          HD11      ILE  19   8.800   6.061  -4.779
  143   2HD1  ILE  19          HD12      ILE  19   9.847   5.295  -3.584
  144   3HD1  ILE  19          HD13      ILE  19  10.528   6.406  -4.774
  145    H    ARG  20           HN       ARG  20   7.211  10.719  -4.344
  146    HA   ARG  20           HA       ARG  20   4.947   9.654  -2.893
  147   1HB   ARG  20          HB2       ARG  20   5.410  11.829  -1.741
  148   2HB   ARG  20          HB1       ARG  20   5.168  12.628  -3.291
  149   1HG   ARG  20          HG2       ARG  20   2.891  11.454  -3.311
  150   2HG   ARG  20          HG1       ARG  20   3.169  11.209  -1.584
  151   1HD   ARG  20          HD2       ARG  20   1.908  13.232  -1.885
  152   2HD   ARG  20          HD1       ARG  20   3.537  13.649  -1.346
  153    HE   ARG  20           HE       ARG  20   2.945  13.629  -4.196
  154   1HH1  ARG  20          HH11      ARG  20   3.582  15.521  -1.281
  155   2HH1  ARG  20          HH12      ARG  20   4.000  16.945  -2.099
  156   1HH2  ARG  20          HH21      ARG  20   3.596  15.554  -5.352
  157   2HH2  ARG  20          HH22      ARG  20   4.015  16.971  -4.492
  158    H    ASP  21           HN       ASP  21   6.127  11.890  -5.367
  159    HA   ASP  21           HA       ASP  21   3.755  11.609  -7.003
  160   1HB   ASP  21          HB2       ASP  21   6.416  12.862  -7.713
  161   2HB   ASP  21          HB1       ASP  21   4.924  12.997  -8.634
  162    H    LEU  22           HN       LEU  22   7.010  10.416  -7.057
  163    HA   LEU  22           HA       LEU  22   7.929   8.610  -8.060
  164   1HB   LEU  22          HB2       LEU  22   5.034   7.853  -8.379
  165   2HB   LEU  22          HB1       LEU  22   6.281   6.905  -9.160
  166    HG   LEU  22           HG       LEU  22   5.582   5.871  -7.108
  167   1HD1  LEU  22          HD11      LEU  22   7.786   5.660  -6.035
  168   2HD1  LEU  22          HD12      LEU  22   8.326   7.056  -6.981
  169   3HD1  LEU  22          HD13      LEU  22   7.849   5.580  -7.798
  170   1HD2  LEU  22          HD21      LEU  22   4.846   7.833  -5.835
  171   2HD2  LEU  22          HD22      LEU  22   6.511   8.382  -5.703
  172   3HD2  LEU  22          HD23      LEU  22   6.010   6.892  -4.914
  173    H    ALA  23           HN       ALA  23   7.216  11.099  -9.399
  174    HA   ALA  23           HA       ALA  23   6.826  10.275 -12.092
  175   1HB   ALA  23          HB1       ALA  23   6.831  12.701 -12.614
  176   2HB   ALA  23          HB2       ALA  23   7.205  13.036 -10.926
  177   3HB   ALA  23          HB3       ALA  23   5.671  12.276 -11.355
  178    H    GLY  24           HN       GLY  24   8.809   9.096 -12.290
  179   1HA   GLY  24          HA2       GLY  24  10.976   9.921 -13.532
  180   2HA   GLY  24          HA1       GLY  24  11.260  10.602 -11.921
  181    H    ILE  25           HN       ILE  25   9.793   8.278 -10.836
  182    HA   ILE  25           HA       ILE  25  12.153   6.646 -10.385
  183    HB   ILE  25           HB       ILE  25   9.380   6.419  -9.152
  184   1HG1  ILE  25          HG12      ILE  25  10.265   8.672  -8.757
  185   2HG1  ILE  25          HG11      ILE  25  10.191   7.742  -7.270
  186   1HG2  ILE  25          HG21      ILE  25  10.734   4.435  -8.814
  187   2HG2  ILE  25          HG22      ILE  25  10.513   5.294  -7.290
  188   3HG2  ILE  25          HG23      ILE  25  12.045   5.417  -8.158
  189   1HD1  ILE  25          HD11      ILE  25  12.592   7.352  -7.396
  190   2HD1  ILE  25          HD12      ILE  25  12.207   9.075  -7.383
  191   3HD1  ILE  25          HD13      ILE  25  12.670   8.285  -8.895
  192    H    ASN  26           HN       ASN  26  11.954   4.272 -10.574
  193    HA   ASN  26           HA       ASN  26  10.310   3.532 -12.871
  194   1HB   ASN  26          HB2       ASN  26  12.775   2.925 -12.802
  195   2HB   ASN  26          HB1       ASN  26  12.429   1.887 -11.427
  196   1HD2  ASN  26          HD21      ASN  26  13.523   1.133 -14.045
  197   2HD2  ASN  26          HD22      ASN  26  12.366   0.021 -14.698
  198    H    LEU  27           HN       LEU  27   8.455   2.449 -12.597
  199    HA   LEU  27           HA       LEU  27   7.756   1.525  -9.895
  200   1HB   LEU  27          HB2       LEU  27   6.037   2.225 -12.266
  201   2HB   LEU  27          HB1       LEU  27   5.426   1.622 -10.741
  202    HG   LEU  27           HG       LEU  27   6.880   4.241 -11.121
  203   1HD1  LEU  27          HD11      LEU  27   4.640   4.232 -12.118
  204   2HD1  LEU  27          HD12      LEU  27   4.707   5.254 -10.685
  205   3HD1  LEU  27          HD13      LEU  27   3.969   3.657 -10.592
  206   1HD2  LEU  27          HD21      LEU  27   5.531   3.051  -8.698
  207   2HD2  LEU  27          HD22      LEU  27   6.217   4.672  -8.806
  208   3HD2  LEU  27          HD23      LEU  27   7.266   3.258  -8.924
  209    H    ASP  28           HN       ASP  28   9.076   0.210 -12.499
  210    HA   ASP  28           HA       ASP  28   7.425  -2.224 -12.501
  211   1HB   ASP  28          HB2       ASP  28   9.931  -1.656 -14.129
  212   2HB   ASP  28          HB1       ASP  28   8.806  -2.985 -14.354
  213    H    SER  29           HN       SER  29   9.617  -0.894 -10.653
  214    HA   SER  29           HA       SER  29  11.421  -3.133 -10.361
  215   1HB   SER  29          HB2       SER  29  11.334  -0.485  -8.919
  216   2HB   SER  29          HB1       SER  29  12.642  -1.672  -8.866
  217    HG   SER  29           HG       SER  29  12.178  -1.261 -11.396
  218    H    SER  30           HN       SER  30  11.583  -4.321  -8.534
  219    HA   SER  30           HA       SER  30   9.173  -4.793  -7.110
  220   1HB   SER  30          HB2       SER  30  11.967  -5.864  -6.723
  221   2HB   SER  30          HB1       SER  30  10.512  -6.560  -6.022
  222    HG   SER  30           HG       SER  30  11.589  -7.180  -8.228
  223    H    LEU  31           HN       LEU  31   8.920  -4.617  -4.787
  224    HA   LEU  31           HA       LEU  31   9.762  -2.194  -3.659
  225   1HB   LEU  31          HB2       LEU  31   7.693  -3.313  -2.997
  226   2HB   LEU  31          HB1       LEU  31   8.598  -4.651  -2.340
  227    HG   LEU  31           HG       LEU  31   9.412  -3.284  -0.515
  228   1HD1  LEU  31          HD11      LEU  31   7.894  -1.066  -1.843
  229   2HD1  LEU  31          HD12      LEU  31   9.659  -1.237  -1.728
  230   3HD1  LEU  31          HD13      LEU  31   8.697  -0.992  -0.261
  231   1HD2  LEU  31          HD21      LEU  31   6.463  -2.872  -0.951
  232   2HD2  LEU  31          HD22      LEU  31   7.312  -2.757   0.591
  233   3HD2  LEU  31          HD23      LEU  31   7.217  -4.303  -0.252
  234    H    ALA  32           HN       ALA  32  11.032  -5.370  -3.531
  235    HA   ALA  32           HA       ALA  32  12.728  -4.958  -1.338
  236   1HB   ALA  32          HB1       ALA  32  13.895  -6.989  -2.045
  237   2HB   ALA  32          HB2       ALA  32  13.052  -6.928  -3.591
  238   3HB   ALA  32          HB3       ALA  32  12.144  -7.196  -2.099
  239    H    ASP  33           HN       ASP  33  12.983  -4.288  -4.710
  240    HA   ASP  33           HA       ASP  33  15.799  -3.903  -4.839
  241   1HB   ASP  33          HB2       ASP  33  14.054  -4.350  -6.722
  242   2HB   ASP  33          HB1       ASP  33  13.768  -2.620  -6.649
  243    H    LEU  34           HN       LEU  34  12.928  -2.010  -4.365
  244    HA   LEU  34           HA       LEU  34  13.891   0.616  -4.436
  245   1HB   LEU  34          HB2       LEU  34  11.672  -0.405  -2.687
  246   2HB   LEU  34          HB1       LEU  34  11.885   1.225  -3.286
  247    HG   LEU  34           HG       LEU  34  11.191  -1.192  -4.943
  248   1HD1  LEU  34          HD11      LEU  34   9.031  -0.125  -5.197
  249   2HD1  LEU  34          HD12      LEU  34   9.531   1.149  -4.065
  250   3HD1  LEU  34          HD13      LEU  34   9.415  -0.532  -3.521
  251   1HD2  LEU  34          HD21      LEU  34  11.402   1.707  -5.732
  252   2HD2  LEU  34          HD22      LEU  34  10.798   0.374  -6.732
  253   3HD2  LEU  34          HD23      LEU  34  12.489   0.396  -6.230
  254    H    GLY  35           HN       GLY  35  13.647  -1.685  -1.785
  255   1HA   GLY  35          HA2       GLY  35  15.811  -0.885  -0.331
  256   2HA   GLY  35          HA1       GLY  35  14.559   0.233   0.172
  257    H    LEU  36           HN       LEU  36  13.020  -2.629  -0.539
  258    HA   LEU  36           HA       LEU  36  12.795  -3.214   2.225
  259   1HB   LEU  36          HB2       LEU  36  10.770  -3.449   1.265
  260   2HB   LEU  36          HB1       LEU  36  11.361  -4.142  -0.214
  261    HG   LEU  36           HG       LEU  36  11.690  -6.311   0.984
  262   1HD1  LEU  36          HD11      LEU  36  10.375  -4.924   3.306
  263   2HD1  LEU  36          HD12      LEU  36  12.043  -5.491   3.233
  264   3HD1  LEU  36          HD13      LEU  36  10.717  -6.649   3.186
  265   1HD2  LEU  36          HD21      LEU  36   9.645  -5.889  -0.227
  266   2HD2  LEU  36          HD22      LEU  36   8.934  -5.143   1.206
  267   3HD2  LEU  36          HD23      LEU  36   9.333  -6.859   1.213
  268    H    ASP  37           HN       ASP  37  14.236  -4.153   3.204
  269    HA   ASP  37           HA       ASP  37  15.113  -6.778   2.223
  270   1HB   ASP  37          HB2       ASP  37  17.198  -6.565   3.379
  271   2HB   ASP  37          HB1       ASP  37  16.980  -5.037   2.540
  272    H    SER  38           HN       SER  38  13.762  -4.794   4.776
  273    HA   SER  38           HA       SER  38  12.637  -7.072   6.067
  274   1HB   SER  38          HB2       SER  38  13.703  -6.409   8.310
  275   2HB   SER  38          HB1       SER  38  14.724  -7.260   7.146
  276    HG   SER  38           HG       SER  38  15.841  -5.473   6.756
  277    H    LEU  39           HN       LEU  39  13.433  -3.708   7.105
  278    HA   LEU  39           HA       LEU  39  11.060  -3.250   8.490
  279   1HB   LEU  39          HB2       LEU  39  13.079  -1.914   8.829
  280   2HB   LEU  39          HB1       LEU  39  12.940  -1.242   7.231
  281    HG   LEU  39           HG       LEU  39  12.374   0.285   9.170
  282   1HD1  LEU  39          HD11      LEU  39  10.220  -0.059   7.097
  283   2HD1  LEU  39          HD12      LEU  39  11.693   0.896   6.932
  284   3HD1  LEU  39          HD13      LEU  39  10.465   1.365   8.108
  285   1HD2  LEU  39          HD21      LEU  39  10.135   0.115  10.148
  286   2HD2  LEU  39          HD22      LEU  39  11.135  -1.286  10.541
  287   3HD2  LEU  39          HD23      LEU  39   9.890  -1.412   9.300
  288    H    MET  40           HN       MET  40  11.747  -2.614   5.115
  289    HA   MET  40           HA       MET  40   9.178  -1.307   4.687
  290   1HB   MET  40          HB2       MET  40  11.204  -2.262   2.667
  291   2HB   MET  40          HB1       MET  40   9.760  -1.331   2.293
  292   1HG   MET  40          HG2       MET  40  10.643   0.475   3.786
  293   2HG   MET  40          HG1       MET  40  12.140  -0.449   3.905
  294   1HE   MET  40          HE1       MET  40   9.743   0.027   0.814
  295   2HE   MET  40          HE2       MET  40  10.508   1.404   0.018
  296   3HE   MET  40          HE3       MET  40   9.755   1.606   1.601
  297    H    GLY  41           HN       GLY  41   9.620  -4.250   5.494
  298   1HA   GLY  41          HA2       GLY  41   7.327  -5.138   3.886
  299   2HA   GLY  41          HA1       GLY  41   8.429  -6.225   4.745
  300    H    VAL  42           HN       VAL  42   8.701  -4.791   7.076
  301    HA   VAL  42           HA       VAL  42   6.515  -5.643   8.629
  302    HB   VAL  42           HB       VAL  42   8.611  -3.572   9.333
  303   1HG1  VAL  42          HG11      VAL  42   6.731  -3.497  10.846
  304   2HG1  VAL  42          HG12      VAL  42   8.143  -4.165  11.669
  305   3HG1  VAL  42          HG13      VAL  42   6.844  -5.237  11.126
  306   1HG2  VAL  42          HG21      VAL  42   8.624  -6.554   9.782
  307   2HG2  VAL  42          HG22      VAL  42   9.824  -5.414  10.397
  308   3HG2  VAL  42          HG23      VAL  42   9.650  -5.659   8.659
  309    H    GLU  43           HN       GLU  43   7.446  -2.384   7.546
  310    HA   GLU  43           HA       GLU  43   5.428  -0.910   8.770
  311   1HB   GLU  43          HB2       GLU  43   7.359   0.059   7.553
  312   2HB   GLU  43          HB1       GLU  43   6.643  -0.452   6.035
  313   1HG   GLU  43          HG2       GLU  43   6.154   1.886   6.277
  314   2HG   GLU  43          HG1       GLU  43   4.692   0.958   6.558
  315    H    VAL  44           HN       VAL  44   5.448  -2.634   5.741
  316    HA   VAL  44           HA       VAL  44   2.962  -1.869   4.682
  317    HB   VAL  44           HB       VAL  44   4.382  -4.511   4.335
  318   1HG1  VAL  44          HG11      VAL  44   2.155  -4.483   3.412
  319   2HG1  VAL  44          HG12      VAL  44   3.395  -4.519   2.142
  320   3HG1  VAL  44          HG13      VAL  44   2.545  -3.011   2.505
  321   1HG2  VAL  44          HG21      VAL  44   5.514  -3.471   2.445
  322   2HG2  VAL  44          HG22      VAL  44   5.923  -2.775   4.012
  323   3HG2  VAL  44          HG23      VAL  44   4.825  -1.905   2.921
  324    H    ARG  45           HN       ARG  45   3.960  -4.523   6.738
  325    HA   ARG  45           HA       ARG  45   1.414  -5.756   6.892
  326   1HB   ARG  45          HB2       ARG  45   3.760  -5.928   8.766
  327   2HB   ARG  45          HB1       ARG  45   2.391  -7.011   8.809
  328   1HG   ARG  45          HG2       ARG  45   2.968  -7.751   6.512
  329   2HG   ARG  45          HG1       ARG  45   4.398  -6.716   6.590
  330   1HD   ARG  45          HD2       ARG  45   3.743  -9.088   8.311
  331   2HD   ARG  45          HD1       ARG  45   5.081  -8.920   7.172
  332    HE   ARG  45           HE       ARG  45   5.051  -6.952   9.239
  333   1HH1  ARG  45          HH11      ARG  45   6.224 -10.174   8.378
  334   2HH1  ARG  45          HH12      ARG  45   7.385 -10.248   9.622
  335   1HH2  ARG  45          HH21      ARG  45   6.586  -7.139  11.074
  336   2HH2  ARG  45          HH22      ARG  45   7.562  -8.530  11.172
  337    H    GLN  46           HN       GLN  46   2.951  -3.186   8.666
  338    HA   GLN  46           HA       GLN  46   1.000  -3.218  10.750
  339   1HB   GLN  46          HB2       GLN  46   2.867  -0.976   9.900
  340   2HB   GLN  46          HB1       GLN  46   1.946  -1.009  11.397
  341   1HG   GLN  46          HG2       GLN  46   4.027  -3.044  10.672
  342   2HG   GLN  46          HG1       GLN  46   4.366  -1.580  11.591
  343   1HE2  GLN  46          HE21      GLN  46   4.572  -4.393  12.297
  344   2HE2  GLN  46          HE22      GLN  46   3.654  -4.565  13.748
  345    H    ILE  47           HN       ILE  47   1.057  -2.075   7.582
  346    HA   ILE  47           HA       ILE  47  -1.135  -0.228   8.001
  347    HB   ILE  47           HB       ILE  47   0.106  -1.140   5.388
  348   1HG1  ILE  47          HG12      ILE  47   0.656   1.389   6.962
  349   2HG1  ILE  47          HG11      ILE  47   1.727  -0.001   6.909
  350   1HG2  ILE  47          HG21      ILE  47  -0.953   0.893   4.488
  351   2HG2  ILE  47          HG22      ILE  47  -1.640   1.231   6.078
  352   3HG2  ILE  47          HG23      ILE  47  -2.146  -0.202   5.182
  353   1HD1  ILE  47          HD11      ILE  47   2.530   1.740   5.450
  354   2HD1  ILE  47          HD12      ILE  47   0.987   1.786   4.595
  355   3HD1  ILE  47          HD13      ILE  47   2.017   0.355   4.487
  356    H    LEU  48           HN       LEU  48  -0.512  -3.253   6.255
  357    HA   LEU  48           HA       LEU  48  -3.343  -3.550   5.768
  358   1HB   LEU  48          HB2       LEU  48  -0.999  -5.196   4.845
  359   2HB   LEU  48          HB1       LEU  48  -2.656  -5.678   4.566
  360    HG   LEU  48           HG       LEU  48  -1.885  -4.716   2.571
  361   1HD1  LEU  48          HD11      LEU  48  -3.336  -2.789   2.237
  362   2HD1  LEU  48          HD12      LEU  48  -3.574  -2.692   3.984
  363   3HD1  LEU  48          HD13      LEU  48  -4.127  -4.115   3.095
  364   1HD2  LEU  48          HD21      LEU  48   0.064  -3.501   3.375
  365   2HD2  LEU  48          HD22      LEU  48  -0.974  -2.295   4.136
  366   3HD2  LEU  48          HD23      LEU  48  -0.943  -2.453   2.378
  367    H    GLU  49           HN       GLU  49  -0.891  -5.485   7.460
  368    HA   GLU  49           HA       GLU  49  -2.714  -7.482   8.284
  369   1HB   GLU  49          HB2       GLU  49  -0.429  -8.117   8.088
  370   2HB   GLU  49          HB1       GLU  49   0.095  -6.811   9.130
  371   1HG   GLU  49          HG2       GLU  49  -1.048  -7.940  11.024
  372   2HG   GLU  49          HG1       GLU  49  -1.414  -9.285   9.943
  373    H    ARG  50           HN       ARG  50  -1.231  -4.840   9.951
  374    HA   ARG  50           HA       ARG  50  -2.326  -5.320  12.490
  375   1HB   ARG  50          HB2       ARG  50  -0.416  -3.949  12.203
  376   2HB   ARG  50          HB1       ARG  50  -1.286  -2.834  11.171
  377   1HG   ARG  50          HG2       ARG  50  -2.640  -2.146  13.108
  378   2HG   ARG  50          HG1       ARG  50  -1.689  -3.239  14.126
  379   1HD   ARG  50          HD2       ARG  50   0.337  -2.074  13.512
  380   2HD   ARG  50          HD1       ARG  50  -0.582  -0.997  12.469
  381    HE   ARG  50           HE       ARG  50  -1.764  -0.441  14.676
  382   1HH1  ARG  50          HH11      ARG  50   1.640  -1.280  14.359
  383   2HH1  ARG  50          HH12      ARG  50   2.212  -0.183  15.514
  384   1HH2  ARG  50          HH21      ARG  50  -1.054   1.072  16.291
  385   2HH2  ARG  50          HH22      ARG  50   0.596   1.266  16.665
  386    H    GLU  51           HN       GLU  51  -3.599  -3.609   9.744
  387    HA   GLU  51           HA       GLU  51  -5.776  -2.564  11.393
  388   1HB   GLU  51          HB2       GLU  51  -4.948  -1.851   8.608
  389   2HB   GLU  51          HB1       GLU  51  -6.277  -1.114   9.486
  390   1HG   GLU  51          HG2       GLU  51  -3.387  -1.020  10.336
  391   2HG   GLU  51          HG1       GLU  51  -4.280   0.293   9.566
  392    H    HIS  52           HN       HIS  52  -5.401  -4.179   8.216
  393    HA   HIS  52           HA       HIS  52  -8.310  -4.603   8.275
  394   1HB   HIS  52          HB2       HIS  52  -7.076  -3.374   6.310
  395   2HB   HIS  52          HB1       HIS  52  -6.553  -4.978   5.858
  396    HD1  HIS  52           HD1      HIS  52  -7.897  -5.099   3.630
  397    HD2  HIS  52           HD2      HIS  52 -10.269  -4.288   6.958
  398    HE1  HIS  52           HE1      HIS  52 -10.245  -5.234   2.832
  399    HE2  HIS  52           HE2      HIS  52 -11.668  -4.815   4.837
  400    H    ASP  53           HN       ASP  53  -5.741  -6.236   9.285
  401    HA   ASP  53           HA       ASP  53  -5.219  -8.363   9.759
  402   1HB   ASP  53          HB2       ASP  53  -7.591  -8.685  10.367
  403   2HB   ASP  53          HB1       ASP  53  -7.994  -9.031   8.694
  404    H    LEU  54           HN       LEU  54  -5.052  -7.157   6.974
  405    HA   LEU  54           HA       LEU  54  -4.769  -9.491   5.323
  406   1HB   LEU  54          HB2       LEU  54  -4.527  -6.587   4.851
  407   2HB   LEU  54          HB1       LEU  54  -3.571  -7.603   3.805
  408    HG   LEU  54           HG       LEU  54  -5.624  -8.753   3.071
  409   1HD1  LEU  54          HD11      LEU  54  -7.037  -6.737   4.790
  410   2HD1  LEU  54          HD12      LEU  54  -6.979  -8.478   5.053
  411   3HD1  LEU  54          HD13      LEU  54  -7.808  -7.829   3.637
  412   1HD2  LEU  54          HD21      LEU  54  -4.784  -6.867   1.802
  413   2HD2  LEU  54          HD22      LEU  54  -5.700  -5.755   2.821
  414   3HD2  LEU  54          HD23      LEU  54  -6.550  -6.892   1.780
  415    H    VAL  55           HN       VAL  55  -3.364 -10.651   6.464
  416    HA   VAL  55           HA       VAL  55  -0.712  -9.768   7.008
  417    HB   VAL  55           HB       VAL  55  -1.690 -12.626   6.781
  418   1HG1  VAL  55          HG11      VAL  55   0.262 -13.163   8.187
  419   2HG1  VAL  55          HG12      VAL  55   0.757 -11.474   8.136
  420   3HG1  VAL  55          HG13      VAL  55   0.746 -12.429   6.659
  421   1HG2  VAL  55          HG21      VAL  55  -1.504 -10.846   9.215
  422   2HG2  VAL  55          HG22      VAL  55  -1.918 -12.560   9.225
  423   3HG2  VAL  55          HG23      VAL  55  -2.989 -11.397   8.441
  424    H    LEU  56           HN       LEU  56   0.199  -9.018   5.260
  425    HA   LEU  56           HA       LEU  56   0.432 -10.728   2.920
  426   1HB   LEU  56          HB2       LEU  56   1.385  -7.945   3.404
  427   2HB   LEU  56          HB1       LEU  56   1.424  -8.777   1.868
  428    HG   LEU  56           HG       LEU  56  -1.069  -7.885   3.330
  429   1HD1  LEU  56          HD11      LEU  56  -1.335  -6.365   1.432
  430   2HD1  LEU  56          HD12      LEU  56   0.217  -6.909   0.794
  431   3HD1  LEU  56          HD13      LEU  56   0.148  -6.047   2.333
  432   1HD2  LEU  56          HD21      LEU  56  -0.780  -9.254   0.653
  433   2HD2  LEU  56          HD22      LEU  56  -2.280  -8.635   1.342
  434   3HD2  LEU  56          HD23      LEU  56  -1.439  -9.975   2.120
  435    HA   PRO  57           HA       PRO  57   4.333 -11.774   4.862
  436   1HB   PRO  57          HB2       PRO  57   4.467 -13.609   2.553
  437   2HB   PRO  57          HB1       PRO  57   4.552 -13.975   4.281
  438   1HG   PRO  57          HG2       PRO  57   2.348 -14.638   2.938
  439   2HG   PRO  57          HG1       PRO  57   2.220 -13.852   4.537
  440   1HD   PRO  57          HD2       PRO  57   2.056 -12.553   1.850
  441   2HD   PRO  57          HD1       PRO  57   0.887 -12.489   3.196
  442    H    ILE  58           HN       ILE  58   6.425 -11.381   4.311
  443    HA   ILE  58           HA       ILE  58   6.831  -9.309   2.487
  444    HB   ILE  58           HB       ILE  58   8.774 -10.948   4.133
  445   1HG1  ILE  58          HG12      ILE  58   9.263  -8.704   5.154
  446   2HG1  ILE  58          HG11      ILE  58   7.987  -8.048   4.134
  447   1HG2  ILE  58          HG21      ILE  58  10.627  -9.527   3.455
  448   2HG2  ILE  58          HG22      ILE  58   9.600  -8.777   2.227
  449   3HG2  ILE  58          HG23      ILE  58  10.000 -10.493   2.118
  450   1HD1  ILE  58          HD11      ILE  58   7.650 -10.109   6.302
  451   2HD1  ILE  58          HD12      ILE  58   6.361  -9.459   5.290
  452   3HD1  ILE  58          HD13      ILE  58   7.220  -8.401   6.410
  453    H    ARG  59           HN       ARG  59   7.013 -12.667   2.069
  454    HA   ARG  59           HA       ARG  59   8.445 -13.102  -0.248
  455   1HB   ARG  59          HB2       ARG  59   5.697 -14.196   0.403
  456   2HB   ARG  59          HB1       ARG  59   6.661 -14.744  -0.946
  457   1HG   ARG  59          HG2       ARG  59   6.886 -16.363   0.722
  458   2HG   ARG  59          HG1       ARG  59   8.389 -15.456   0.753
  459   1HD   ARG  59          HD2       ARG  59   7.694 -14.288   2.744
  460   2HD   ARG  59          HD1       ARG  59   6.077 -14.974   2.645
  461    HE   ARG  59           HE       ARG  59   7.673 -17.133   2.666
  462   1HH1  ARG  59          HH11      ARG  59   7.577 -14.358   4.877
  463   2HH1  ARG  59          HH12      ARG  59   7.800 -15.303   6.279
  464   1HH2  ARG  59          HH21      ARG  59   8.053 -18.386   4.582
  465   2HH2  ARG  59          HH22      ARG  59   8.097 -17.655   6.113
  466    H    GLU  60           HN       GLU  60   5.037 -12.063  -0.108
  467    HA   GLU  60           HA       GLU  60   5.013 -11.438  -2.925
  468   1HB   GLU  60          HB2       GLU  60   2.943 -11.121  -0.765
  469   2HB   GLU  60          HB1       GLU  60   2.673 -10.639  -2.431
  470   1HG   GLU  60          HG2       GLU  60   3.245 -13.419  -1.424
  471   2HG   GLU  60          HG1       GLU  60   1.708 -12.806  -2.035
  472    H    VAL  61           HN       VAL  61   5.193  -9.759   0.098
  473    HA   VAL  61           HA       VAL  61   4.659  -7.176  -0.776
  474    HB   VAL  61           HB       VAL  61   6.388  -8.093   1.552
  475   1HG1  VAL  61          HG11      VAL  61   5.256  -5.352   0.996
  476   2HG1  VAL  61          HG12      VAL  61   6.968  -5.788   0.971
  477   3HG1  VAL  61          HG13      VAL  61   6.056  -5.854   2.481
  478   1HG2  VAL  61          HG21      VAL  61   3.545  -7.119   1.416
  479   2HG2  VAL  61          HG22      VAL  61   4.415  -7.576   2.884
  480   3HG2  VAL  61          HG23      VAL  61   4.061  -8.788   1.645
  481    H    ARG  62           HN       ARG  62   7.613  -9.024  -1.028
  482    HA   ARG  62           HA       ARG  62   9.306  -6.876  -1.622
  483   1HB   ARG  62          HB2       ARG  62   9.580  -9.793  -2.310
  484   2HB   ARG  62          HB1       ARG  62  10.817  -8.602  -2.701
  485   1HG   ARG  62          HG2       ARG  62  11.004  -8.012  -0.377
  486   2HG   ARG  62          HG1       ARG  62   9.756  -9.175   0.039
  487   1HD   ARG  62          HD2       ARG  62  11.865 -10.222   0.529
  488   2HD   ARG  62          HD1       ARG  62  11.186 -11.002  -0.896
  489    HE   ARG  62           HE       ARG  62  12.742  -9.574  -2.199
  490   1HH1  ARG  62          HH11      ARG  62  13.540 -10.561   1.161
  491   2HH1  ARG  62          HH12      ARG  62  15.211 -10.262   0.933
  492   1HH2  ARG  62          HH21      ARG  62  15.061  -9.214  -2.391
  493   2HH2  ARG  62          HH22      ARG  62  16.070  -9.485  -1.027
  494    H    GLN  63           HN       GLN  63   6.789  -8.040  -3.545
  495    HA   GLN  63           HA       GLN  63   8.088  -6.983  -5.958
  496   1HB   GLN  63          HB2       GLN  63   5.739  -8.872  -5.732
  497   2HB   GLN  63          HB1       GLN  63   6.180  -8.068  -7.222
  498   1HG   GLN  63          HG2       GLN  63   7.069 -10.215  -7.380
  499   2HG   GLN  63          HG1       GLN  63   8.435  -9.174  -6.999
  500   1HE2  GLN  63          HE21      GLN  63   6.003 -10.291  -4.742
  501   2HE2  GLN  63          HE22      GLN  63   7.073 -11.241  -3.785
  502    H    LEU  64           HN       LEU  64   6.330  -5.836  -3.587
  503    HA   LEU  64           HA       LEU  64   4.203  -4.628  -5.062
  504   1HB   LEU  64          HB2       LEU  64   5.305  -3.828  -2.369
  505   2HB   LEU  64          HB1       LEU  64   3.779  -3.297  -3.049
  506    HG   LEU  64           HG       LEU  64   4.526  -6.050  -2.127
  507   1HD1  LEU  64          HD11      LEU  64   3.917  -4.559  -0.347
  508   2HD1  LEU  64          HD12      LEU  64   2.656  -5.769  -0.582
  509   3HD1  LEU  64          HD13      LEU  64   2.425  -4.127  -1.182
  510   1HD2  LEU  64          HD21      LEU  64   1.987  -5.196  -3.519
  511   2HD2  LEU  64          HD22      LEU  64   2.271  -6.773  -2.781
  512   3HD2  LEU  64          HD23      LEU  64   3.225  -6.266  -4.174
  513    H    THR  65           HN       THR  65   4.520  -3.218  -6.580
  514    HA   THR  65           HA       THR  65   7.002  -1.878  -6.944
  515    HB   THR  65           HB       THR  65   5.823  -1.232  -9.075
  516    HG1  THR  65           HG1      THR  65   3.900  -3.074  -8.895
  517   1HG2  THR  65          HG21      THR  65   7.248  -3.218  -8.784
  518   2HG2  THR  65          HG22      THR  65   5.873  -3.550  -9.875
  519   3HG2  THR  65          HG23      THR  65   5.829  -4.072  -8.178
  520    H    LEU  66           HN       LEU  66   5.716  -0.845  -4.740
  521    HA   LEU  66           HA       LEU  66   5.350   1.093  -3.655
  522   1HB   LEU  66          HB2       LEU  66   7.286   1.772  -5.223
  523   2HB   LEU  66          HB1       LEU  66   6.075   2.583  -6.183
  524    HG   LEU  66           HG       LEU  66   7.294   4.143  -4.767
  525   1HD1  LEU  66          HD11      LEU  66   4.457   3.804  -3.864
  526   2HD1  LEU  66          HD12      LEU  66   5.011   4.694  -5.283
  527   3HD1  LEU  66          HD13      LEU  66   5.436   5.262  -3.663
  528   1HD2  LEU  66          HD21      LEU  66   7.101   4.062  -2.331
  529   2HD2  LEU  66          HD22      LEU  66   7.905   2.628  -2.973
  530   3HD2  LEU  66          HD23      LEU  66   6.221   2.538  -2.457
  531    H    ARG  67           HN       ARG  67   4.055   1.656  -6.972
  532    HA   ARG  67           HA       ARG  67   1.864   3.082  -5.773
  533   1HB   ARG  67          HB2       ARG  67   2.492   2.478  -8.650
  534   2HB   ARG  67          HB1       ARG  67   0.976   3.218  -8.162
  535   1HG   ARG  67          HG2       ARG  67   3.727   4.360  -7.703
  536   2HG   ARG  67          HG1       ARG  67   2.564   4.895  -8.917
  537   1HD   ARG  67          HD2       ARG  67   0.978   5.258  -6.907
  538   2HD   ARG  67          HD1       ARG  67   2.426   5.135  -5.932
  539    HE   ARG  67           HE       ARG  67   3.329   7.012  -7.378
  540   1HH1  ARG  67          HH11      ARG  67  -0.079   6.756  -6.468
  541   2HH1  ARG  67          HH12      ARG  67  -0.459   8.363  -6.877
  542   1HH2  ARG  67          HH21      ARG  67   2.797   9.255  -7.945
  543   2HH2  ARG  67          HH22      ARG  67   1.196   9.779  -7.751
  544    H    LYS  68           HN       LYS  68   2.440  -0.125  -6.674
  545    HA   LYS  68           HA       LYS  68  -0.253  -0.958  -6.876
  546   1HB   LYS  68          HB2       LYS  68   1.695  -2.421  -7.479
  547   2HB   LYS  68          HB1       LYS  68   2.049  -2.573  -5.758
  548   1HG   LYS  68          HG2       LYS  68  -0.063  -3.678  -5.371
  549   2HG   LYS  68          HG1       LYS  68  -0.517  -3.461  -7.060
  550   1HD   LYS  68          HD2       LYS  68   1.372  -4.876  -7.731
  551   2HD   LYS  68          HD1       LYS  68   1.788  -5.106  -6.028
  552   1HE   LYS  68          HE2       LYS  68  -0.340  -6.175  -5.618
  553   2HE   LYS  68          HE1       LYS  68  -0.850  -5.867  -7.274
  554   1HZ   LYS  68          HZ1       LYS  68  -0.105  -8.142  -7.030
  555   2HZ   LYS  68          HZ2       LYS  68   1.378  -7.653  -6.430
  556   3HZ   LYS  68          HZ3       LYS  68   0.972  -7.305  -8.030
  557    H    LEU  69           HN       LEU  69   1.752  -0.122  -4.247
  558    HA   LEU  69           HA       LEU  69   0.407  -1.261  -2.050
  559   1HB   LEU  69          HB2       LEU  69   1.962   1.303  -2.234
  560   2HB   LEU  69          HB1       LEU  69   1.092   0.916  -0.771
  561    HG   LEU  69           HG       LEU  69   3.411   0.372  -0.526
  562   1HD1  LEU  69          HD11      LEU  69   1.848  -1.027   0.639
  563   2HD1  LEU  69          HD12      LEU  69   3.260  -1.958   0.143
  564   3HD1  LEU  69          HD13      LEU  69   1.746  -2.108  -0.749
  565   1HD2  LEU  69          HD21      LEU  69   4.506  -1.369  -1.864
  566   2HD2  LEU  69          HD22      LEU  69   4.027   0.011  -2.849
  567   3HD2  LEU  69          HD23      LEU  69   3.071  -1.475  -2.882
  568    H    GLN  70           HN       GLN  70  -0.355   1.703  -3.779
  569    HA   GLN  70           HA       GLN  70  -2.588   2.254  -1.990
  570   1HB   GLN  70          HB2       GLN  70  -2.996   4.223  -3.447
  571   2HB   GLN  70          HB1       GLN  70  -1.377   4.185  -2.758
  572   1HG   GLN  70          HG2       GLN  70  -0.389   3.661  -4.734
  573   2HG   GLN  70          HG1       GLN  70  -1.896   3.098  -5.501
  574   1HE2  GLN  70          HE21      GLN  70  -1.739   4.384  -7.223
  575   2HE2  GLN  70          HE22      GLN  70  -1.877   6.092  -7.203
  576    H    GLU  71           HN       GLU  71  -2.204   0.117  -4.350
  577    HA   GLU  71           HA       GLU  71  -4.888   0.490  -5.476
  578   1HB   GLU  71          HB2       GLU  71  -2.897   0.178  -7.001
  579   2HB   GLU  71          HB1       GLU  71  -2.680  -1.415  -6.305
  580   1HG   GLU  71          HG2       GLU  71  -4.856  -2.084  -7.176
  581   2HG   GLU  71          HG1       GLU  71  -5.068  -0.478  -7.876
  582    H    MET  72           HN       MET  72  -2.941  -1.388  -3.414
  583    HA   MET  72           HA       MET  72  -5.159  -3.265  -2.923
  584   1HB   MET  72          HB2       MET  72  -3.477  -4.840  -2.112
  585   2HB   MET  72          HB1       MET  72  -3.088  -4.334  -3.746
  586   1HG   MET  72          HG2       MET  72  -1.475  -2.682  -2.723
  587   2HG   MET  72          HG1       MET  72  -1.757  -3.480  -1.185
  588   1HE   MET  72          HE1       MET  72  -0.540  -7.142  -1.994
  589   2HE   MET  72          HE2       MET  72  -2.171  -6.511  -2.227
  590   3HE   MET  72          HE3       MET  72  -1.263  -6.090  -0.776
  591    H    SER  73           HN       SER  73  -4.541  -0.518  -1.965
  592    HA   SER  73           HA       SER  73  -3.488  -0.439   0.570
  593   1HB   SER  73          HB2       SER  73  -4.823   1.778   0.599
  594   2HB   SER  73          HB1       SER  73  -3.569   1.546  -0.607
  595    HG   SER  73           HG       SER  73  -6.383   1.374  -0.969
  596    H    SER  74           HN       SER  74  -6.740  -1.130  -0.534
  597    HA   SER  74           HA       SER  74  -8.648  -1.828   0.552
  598   1HB   SER  74          HB2       SER  74  -6.687  -2.569   2.736
  599   2HB   SER  74          HB1       SER  74  -8.327  -3.197   2.565
  600    HG   SER  74           HG       SER  74  -6.190  -3.532   0.726
  601    H    LYS  75           HN       LYS  75  -7.992   0.871   0.756
  602    HA   LYS  75           HA       LYS  75  -8.554   1.624   3.552
  603   1HB   LYS  75          HB2       LYS  75  -6.365   2.271   2.301
  604   2HB   LYS  75          HB1       LYS  75  -7.387   3.396   1.427
  605   1HG   LYS  75          HG2       LYS  75  -7.978   4.490   3.521
  606   2HG   LYS  75          HG1       LYS  75  -6.965   3.340   4.402
  607   1HD   LYS  75          HD2       LYS  75  -5.059   4.092   2.945
  608   2HD   LYS  75          HD1       LYS  75  -6.112   5.397   2.392
  609   1HE   LYS  75          HE2       LYS  75  -5.257   4.849   5.213
  610   2HE   LYS  75          HE1       LYS  75  -4.643   6.119   4.168
  611   1HZ   LYS  75          HZ1       LYS  75  -6.931   7.079   4.126
  612   2HZ   LYS  75          HZ2       LYS  75  -6.232   7.057   5.637
  613   3HZ   LYS  75          HZ3       LYS  75  -7.418   5.928   5.284
  614    H    ALA  76           HN       ALA  76 -10.132   0.923   0.989
  615    HA   ALA  76           HA       ALA  76 -11.966   1.400  -0.065
  616   1HB   ALA  76          HB1       ALA  76 -12.496   3.531   2.006
  617   2HB   ALA  76          HB2       ALA  76 -12.921   1.830   2.176
  618   3HB   ALA  76          HB3       ALA  76 -13.677   2.805   0.915
  619    H    GLY  77           HN       GLY  77 -11.551   4.775   0.888
  620   1HA   GLY  77          HA2       GLY  77 -11.187   6.628  -0.391
  621   2HA   GLY  77          HA1       GLY  77 -10.304   5.593  -1.509
  622    H    SER  78           HN       SER  78 -11.211   5.000  -3.353
  623    HA   SER  78           HA       SER  78 -13.738   6.105  -4.074
  624   1HB   SER  78          HB2       SER  78 -13.092   4.948  -6.268
  625   2HB   SER  78          HB1       SER  78 -12.065   6.269  -5.702
  626    HG   SER  78           HG       SER  78 -11.397   3.763  -6.221
  627    H    ASP  79           HN       ASP  79 -12.566   3.144  -2.824
  628    HA   ASP  79           HA       ASP  79 -14.749   1.540  -3.829
  629   1HB   ASP  79          HB2       ASP  79 -12.482   0.904  -1.957
  630   2HB   ASP  79          HB1       ASP  79 -13.866  -0.169  -2.078
  631    H    THR  80           HN       THR  80 -16.195   3.144  -3.023
  632    HA   THR  80           HA       THR  80 -17.447   2.079  -0.682
  633    HB   THR  80           HB       THR  80 -16.873   5.070  -0.858
  634    HG1  THR  80           HG1      THR  80 -15.373   3.117   0.057
  635   1HG2  THR  80          HG21      THR  80 -17.890   5.128   1.379
  636   2HG2  THR  80          HG22      THR  80 -18.222   3.398   1.268
  637   3HG2  THR  80          HG23      THR  80 -19.024   4.522   0.173
  638    H    GLU  81           HN       GLU  81 -19.167   1.468  -1.803
  639    HA   GLU  81           HA       GLU  81 -20.456   3.475  -3.483
  640   1HB   GLU  81          HB2       GLU  81 -21.238   0.567  -3.126
  641   2HB   GLU  81          HB1       GLU  81 -21.938   1.697  -4.270
  642   1HG   GLU  81          HG2       GLU  81 -20.546   0.559  -5.664
  643   2HG   GLU  81          HG1       GLU  81 -19.438   1.820  -5.131
  644    H    LEU  82           HN       LEU  82 -22.265   4.434  -2.852
  645    HA   LEU  82           HA       LEU  82 -22.862   4.190  -0.050
  646   1HB   LEU  82          HB2       LEU  82 -22.716   6.370  -1.423
  647   2HB   LEU  82          HB1       LEU  82 -24.313   5.975  -2.005
  648    HG   LEU  82           HG       LEU  82 -23.653   6.409   0.919
  649   1HD1  LEU  82          HD11      LEU  82 -24.795   8.332  -1.087
  650   2HD1  LEU  82          HD12      LEU  82 -23.207   8.427  -0.330
  651   3HD1  LEU  82          HD13      LEU  82 -24.664   8.610   0.648
  652   1HD2  LEU  82          HD21      LEU  82 -26.075   6.718   1.177
  653   2HD2  LEU  82          HD22      LEU  82 -25.712   5.115   0.538
  654   3HD2  LEU  82          HD23      LEU  82 -26.302   6.381  -0.540
  655    H    ALA  83           HN       ALA  83 -23.753   2.285   0.247
  656    HA   ALA  83           HA       ALA  83 -26.171   1.524  -1.179
  657   1HB   ALA  83          HB1       ALA  83 -24.572   0.089   0.947
  658   2HB   ALA  83          HB2       ALA  83 -24.460  -0.187  -0.791
  659   3HB   ALA  83          HB3       ALA  83 -25.949  -0.581   0.072
  660    H    ALA  84           HN       ALA  84 -24.969   2.196   2.042
  661    HA   ALA  84           HA       ALA  84 -27.728   2.670   2.916
  662   1HB   ALA  84          HB1       ALA  84 -26.941   2.165   5.188
  663   2HB   ALA  84          HB2       ALA  84 -25.324   1.853   4.554
  664   3HB   ALA  84          HB3       ALA  84 -26.668   0.802   4.100
  665    HA   PRO  85           HA       PRO  85 -26.195   6.847   3.351
  666   1HB   PRO  85          HB2       PRO  85 -28.768   7.469   4.589
  667   2HB   PRO  85          HB1       PRO  85 -28.148   7.996   3.020
  668   1HG   PRO  85          HG2       PRO  85 -30.215   6.264   3.274
  669   2HG   PRO  85          HG1       PRO  85 -29.082   6.217   1.912
  670   1HD   PRO  85          HD2       PRO  85 -29.146   4.518   4.379
  671   2HD   PRO  85          HD1       PRO  85 -28.862   4.036   2.692
  672    H    LYS  86           HN       LYS  86 -24.931   7.453   4.988
  673    HA   LYS  86           HA       LYS  86 -25.403   6.378   7.643
  674   1HB   LYS  86          HB2       LYS  86 -23.126   8.080   6.634
  675   2HB   LYS  86          HB1       LYS  86 -23.173   7.164   8.133
  676   1HG   LYS  86          HG2       LYS  86 -23.173   5.082   6.889
  677   2HG   LYS  86          HG1       LYS  86 -23.213   5.977   5.367
  678   1HD   LYS  86          HD2       LYS  86 -21.009   6.041   7.424
  679   2HD   LYS  86          HD1       LYS  86 -20.949   5.236   5.857
  680   1HE   LYS  86          HE2       LYS  86 -21.241   8.204   6.329
  681   2HE   LYS  86          HE1       LYS  86 -19.775   7.384   5.812
  682   1HZ   LYS  86          HZ1       LYS  86 -20.929   6.724   3.781
  683   2HZ   LYS  86          HZ2       LYS  86 -20.848   8.401   3.977
  684   3HZ   LYS  86          HZ3       LYS  86 -22.309   7.617   4.239
  685    H    SER  87           HN       SER  87 -26.791   7.523   8.750
  686    HA   SER  87           HA       SER  87 -26.822  10.407   8.416
  687   1HB   SER  87          HB2       SER  87 -28.836   8.552   9.686
  688   2HB   SER  87          HB1       SER  87 -29.033  10.297   9.484
  689    HG   SER  87           HG       SER  87 -28.632   9.895   7.219
  690    H    LYS  88           HN       LYS  88 -25.770   7.967  10.545
  691    HA   LYS  88           HA       LYS  88 -25.353  10.020  12.573
  692   1HB   LYS  88          HB2       LYS  88 -26.914   8.280  13.363
  693   2HB   LYS  88          HB1       LYS  88 -25.708   7.047  13.041
  694   1HG   LYS  88          HG2       LYS  88 -25.711   7.507  15.389
  695   2HG   LYS  88          HG1       LYS  88 -24.219   8.154  14.707
  696   1HD   LYS  88          HD2       LYS  88 -25.054   9.790  16.217
  697   2HD   LYS  88          HD1       LYS  88 -25.384  10.393  14.592
  698   1HE   LYS  88          HE2       LYS  88 -27.325  10.754  15.973
  699   2HE   LYS  88          HE1       LYS  88 -27.696   9.503  14.788
  700   1HZ   LYS  88          HZ1       LYS  88 -28.530   8.811  16.889
  701   2HZ   LYS  88          HZ2       LYS  88 -27.089   9.156  17.666
  702   3HZ   LYS  88          HZ3       LYS  88 -27.172   7.841  16.619
  703    H    ASN  89           HN       ASN  89 -23.419  10.650  11.795
  704    HA   ASN  89           HA       ASN  89 -21.201  10.849  11.775
  705   1HB   ASN  89          HB2       ASN  89 -21.183   8.425  13.588
  706   2HB   ASN  89          HB1       ASN  89 -19.822   9.508  13.313
  707   1HD2  ASN  89          HD21      ASN  89 -21.132   8.879  15.775
  708   2HD2  ASN  89          HD22      ASN  89 -21.780  10.365  16.413
  Start of MODEL    9
    1   1H    GLY   1          HT1       GLY   1 -12.057  10.480  13.407
    2   2H    GLY   1          HT2       GLY   1 -11.863   9.263  14.527
    3   3H    GLY   1          HT3       GLY   1 -12.337  10.818  15.038
    4   1HA   GLY   1          HA1       GLY   1 -14.235   9.276  14.994
    5   2HA   GLY   1          HA2       GLY   1 -14.419  10.584  13.821
    6    H    ASP   2           HN       ASP   2 -15.887   8.415  13.305
    7    HA   ASP   2           HA       ASP   2 -14.424   6.528  11.728
    8   1HB   ASP   2          HB2       ASP   2 -17.417   6.889  11.989
    9   2HB   ASP   2          HB1       ASP   2 -16.653   5.610  11.057
   10    H    GLY   3           HN       GLY   3 -13.435   8.159  10.516
   11   1HA   GLY   3          HA2       GLY   3 -14.770   8.414   7.921
   12   2HA   GLY   3          HA1       GLY   3 -14.080   9.864   8.659
   13    H    GLU   4           HN       GLU   4 -12.761   6.761   9.181
   14    HA   GLU   4           HA       GLU   4 -10.470   7.408   7.493
   15   1HB   GLU   4          HB2       GLU   4 -10.482   6.002  10.168
   16   2HB   GLU   4          HB1       GLU   4  -9.073   6.275   9.153
   17   1HG   GLU   4          HG2       GLU   4  -9.346   8.683   9.445
   18   2HG   GLU   4          HG1       GLU   4 -10.745   8.391  10.476
   19    H    ALA   5           HN       ALA   5 -10.292   5.977   5.972
   20    HA   ALA   5           HA       ALA   5 -11.483   3.342   6.348
   21   1HB   ALA   5          HB1       ALA   5 -12.289   4.599   4.409
   22   2HB   ALA   5          HB2       ALA   5 -11.368   3.186   3.892
   23   3HB   ALA   5          HB3       ALA   5 -10.633   4.788   3.831
   24    H    GLN   6           HN       GLN   6  -8.666   4.945   4.901
   25    HA   GLN   6           HA       GLN   6  -6.700   3.326   6.065
   26   1HB   GLN   6          HB2       GLN   6  -7.648   1.540   4.659
   27   2HB   GLN   6          HB1       GLN   6  -7.551   2.570   3.246
   28   1HG   GLN   6          HG2       GLN   6  -5.788   0.967   3.162
   29   2HG   GLN   6          HG1       GLN   6  -5.086   2.554   3.462
   30   1HE2  GLN   6          HE21      GLN   6  -5.658  -0.573   4.660
   31   2HE2  GLN   6          HE22      GLN   6  -4.657  -0.444   6.082
   32    H    ARG   7           HN       ARG   7  -4.666   4.135   5.440
   33    HA   ARG   7           HA       ARG   7  -4.674   6.565   3.839
   34   1HB   ARG   7          HB2       ARG   7  -3.332   6.402   5.957
   35   2HB   ARG   7          HB1       ARG   7  -2.379   5.125   5.209
   36   1HG   ARG   7          HG2       ARG   7  -1.832   6.815   3.396
   37   2HG   ARG   7          HG1       ARG   7  -2.511   8.029   4.477
   38   1HD   ARG   7          HD2       ARG   7  -0.219   6.178   5.103
   39   2HD   ARG   7          HD1       ARG   7  -0.076   7.868   4.643
   40    HE   ARG   7           HE       ARG   7  -1.641   7.263   7.019
   41   1HH1  ARG   7          HH11      ARG   7   1.408   8.420   5.613
   42   2HH1  ARG   7          HH12      ARG   7   2.018   9.052   7.069
   43   1HH2  ARG   7          HH21      ARG   7  -0.806   8.115   9.033
   44   2HH2  ARG   7          HH22      ARG   7   0.735   8.836   9.086
   45    H    ASP   8           HN       ASP   8  -3.396   6.710   1.902
   46    HA   ASP   8           HA       ASP   8  -3.287   4.328   0.319
   47   1HB   ASP   8          HB2       ASP   8  -1.776   6.911  -0.182
   48   2HB   ASP   8          HB1       ASP   8  -2.089   5.639  -1.351
   49    H    LEU   9           HN       LEU   9  -1.630   2.938   0.106
   50    HA   LEU   9           HA       LEU   9   0.412   3.027   2.031
   51   1HB   LEU   9          HB2       LEU   9   0.172   1.273  -0.391
   52   2HB   LEU   9          HB1       LEU   9   1.362   1.048   0.869
   53    HG   LEU   9           HG       LEU   9  -1.625   0.814   1.162
   54   1HD1  LEU   9          HD11      LEU   9  -1.130  -1.534   1.627
   55   2HD1  LEU   9          HD12      LEU   9   0.579  -1.234   1.315
   56   3HD1  LEU   9          HD13      LEU   9  -0.597  -1.064   0.012
   57   1HD2  LEU   9          HD21      LEU   9  -0.641   1.767   3.184
   58   2HD2  LEU   9          HD22      LEU   9   0.547   0.464   3.230
   59   3HD2  LEU   9          HD23      LEU   9  -1.163   0.106   3.463
   60    H    VAL  10           HN       VAL  10   0.257   4.531  -0.975
   61    HA   VAL  10           HA       VAL  10   3.104   4.750  -1.311
   62    HB   VAL  10           HB       VAL  10   0.821   6.310  -2.598
   63   1HG1  VAL  10          HG11      VAL  10   3.774   6.413  -3.270
   64   2HG1  VAL  10          HG12      VAL  10   2.844   7.720  -2.535
   65   3HG1  VAL  10          HG13      VAL  10   2.481   7.197  -4.180
   66   1HG2  VAL  10          HG21      VAL  10   1.428   5.028  -4.586
   67   2HG2  VAL  10          HG22      VAL  10   0.968   3.980  -3.246
   68   3HG2  VAL  10          HG23      VAL  10   2.670   4.185  -3.660
   69    H    LYS  11           HN       LYS  11   0.676   6.337   0.548
   70    HA   LYS  11           HA       LYS  11   2.378   8.654   1.080
   71   1HB   LYS  11          HB2       LYS  11  -0.266   8.097   2.429
   72   2HB   LYS  11          HB1       LYS  11   0.533   9.625   2.066
   73   1HG   LYS  11          HG2       LYS  11  -0.712   7.819   0.008
   74   2HG   LYS  11          HG1       LYS  11  -1.487   9.234   0.711
   75   1HD   LYS  11          HD2       LYS  11   0.074  10.691  -0.304
   76   2HD   LYS  11          HD1       LYS  11   1.144   9.357  -0.736
   77   1HE   LYS  11          HE2       LYS  11  -0.100  10.156  -2.689
   78   2HE   LYS  11          HE1       LYS  11  -0.502   8.495  -2.295
   79   1HZ   LYS  11          HZ1       LYS  11  -2.624   9.243  -1.354
   80   2HZ   LYS  11          HZ2       LYS  11  -2.401   9.839  -2.915
   81   3HZ   LYS  11          HZ3       LYS  11  -2.149  10.869  -1.607
   82    H    ALA  12           HN       ALA  12   2.507   5.664   1.894
   83    HA   ALA  12           HA       ALA  12   3.160   6.128   4.716
   84   1HB   ALA  12          HB1       ALA  12   1.857   3.651   3.583
   85   2HB   ALA  12          HB2       ALA  12   1.060   4.880   4.562
   86   3HB   ALA  12          HB3       ALA  12   2.340   3.888   5.261
   87    H    VAL  13           HN       VAL  13   3.546   3.585   2.210
   88    HA   VAL  13           HA       VAL  13   6.074   2.765   3.215
   89    HB   VAL  13           HB       VAL  13   4.672   2.123   0.599
   90   1HG1  VAL  13          HG11      VAL  13   6.215   0.218   0.426
   91   2HG1  VAL  13          HG12      VAL  13   7.075   0.790   1.860
   92   3HG1  VAL  13          HG13      VAL  13   7.055   1.770   0.388
   93   1HG2  VAL  13          HG21      VAL  13   4.099  -0.004   1.686
   94   2HG2  VAL  13          HG22      VAL  13   3.427   1.373   2.556
   95   3HG2  VAL  13          HG23      VAL  13   4.864   0.556   3.175
   96    H    ALA  14           HN       ALA  14   5.043   4.408   0.217
   97    HA   ALA  14           HA       ALA  14   7.663   4.974  -0.633
   98   1HB   ALA  14          HB1       ALA  14   6.644   6.559  -2.239
   99   2HB   ALA  14          HB2       ALA  14   5.132   6.485  -1.335
  100   3HB   ALA  14          HB3       ALA  14   5.708   5.061  -2.174
  101    H    HIS  15           HN       HIS  15   5.553   6.507   1.592
  102    HA   HIS  15           HA       HIS  15   6.764   9.035   1.837
  103   1HB   HIS  15          HB2       HIS  15   4.561   8.466   2.818
  104   2HB   HIS  15          HB1       HIS  15   5.349   7.399   3.961
  105    HD1  HIS  15           HD1      HIS  15   4.341  10.900   3.432
  106    HD2  HIS  15           HD2      HIS  15   6.829   8.798   6.016
  107    HE1  HIS  15           HE1      HIS  15   4.756  12.431   5.378
  108    HE2  HIS  15           HE2      HIS  15   6.042  10.993   7.035
  109    H    ILE  16           HN       ILE  16   7.657   5.899   3.133
  110    HA   ILE  16           HA       ILE  16   9.597   6.866   5.007
  111    HB   ILE  16           HB       ILE  16   9.291   4.112   3.736
  112   1HG1  ILE  16          HG12      ILE  16   7.313   4.720   5.024
  113   2HG1  ILE  16          HG11      ILE  16   8.209   3.450   5.848
  114   1HG2  ILE  16          HG21      ILE  16  10.920   4.873   6.157
  115   2HG2  ILE  16          HG22      ILE  16  11.546   4.357   4.592
  116   3HG2  ILE  16          HG23      ILE  16  10.632   3.228   5.590
  117   1HD1  ILE  16          HD11      ILE  16   9.124   5.103   7.400
  118   2HD1  ILE  16          HD12      ILE  16   7.359   5.119   7.409
  119   3HD1  ILE  16          HD13      ILE  16   8.247   6.382   6.560
  120    H    LEU  17           HN       LEU  17   9.515   6.331   1.630
  121    HA   LEU  17           HA       LEU  17  12.423   6.433   1.397
  122   1HB   LEU  17          HB2       LEU  17  10.309   5.911  -0.692
  123   2HB   LEU  17          HB1       LEU  17  12.038   5.893  -0.976
  124    HG   LEU  17           HG       LEU  17  10.524   3.968   0.797
  125   1HD1  LEU  17          HD11      LEU  17  10.078   3.617  -1.567
  126   2HD1  LEU  17          HD12      LEU  17  11.059   2.312  -0.906
  127   3HD1  LEU  17          HD13      LEU  17  11.812   3.565  -1.896
  128   1HD2  LEU  17          HD21      LEU  17  12.789   4.380   1.612
  129   2HD2  LEU  17          HD22      LEU  17  13.434   4.037   0.009
  130   3HD2  LEU  17          HD23      LEU  17  12.648   2.757   0.935
  131    H    GLY  18           HN       GLY  18   9.933   8.513   1.643
  132   1HA   GLY  18          HA2       GLY  18   9.891  10.799   1.418
  133   2HA   GLY  18          HA1       GLY  18  11.451  10.717   0.611
  134    H    ILE  19           HN       ILE  19   8.888   8.744  -0.582
  135    HA   ILE  19           HA       ILE  19   8.721  10.556  -2.848
  136    HB   ILE  19           HB       ILE  19   8.149   8.395  -4.108
  137   1HG1  ILE  19          HG12      ILE  19   9.958   7.296  -1.959
  138   2HG1  ILE  19          HG11      ILE  19   8.270   6.880  -2.211
  139   1HG2  ILE  19          HG21      ILE  19  10.983   9.208  -3.383
  140   2HG2  ILE  19          HG22      ILE  19   9.994   9.892  -4.674
  141   3HG2  ILE  19          HG23      ILE  19  10.560   8.224  -4.784
  142   1HD1  ILE  19          HD11      ILE  19   9.752   5.154  -3.059
  143   2HD1  ILE  19          HD12      ILE  19  10.533   6.326  -4.121
  144   3HD1  ILE  19          HD13      ILE  19   8.839   5.896  -4.373
  145    H    ARG  20           HN       ARG  20   6.995  10.616  -4.048
  146    HA   ARG  20           HA       ARG  20   4.611   9.096  -3.665
  147   1HB   ARG  20          HB2       ARG  20   4.358  10.774  -1.846
  148   2HB   ARG  20          HB1       ARG  20   4.508  12.052  -3.048
  149   1HG   ARG  20          HG2       ARG  20   2.511  10.432  -4.056
  150   2HG   ARG  20          HG1       ARG  20   2.199  10.465  -2.315
  151   1HD   ARG  20          HD2       ARG  20   1.013  12.298  -3.299
  152   2HD   ARG  20          HD1       ARG  20   2.387  12.965  -2.416
  153    HE   ARG  20           HE       ARG  20   2.162  12.692  -5.329
  154   1HH1  ARG  20          HH11      ARG  20   3.818  14.131  -2.530
  155   2HH1  ARG  20          HH12      ARG  20   4.661  15.275  -3.496
  156   1HH2  ARG  20          HH21      ARG  20   3.342  14.287  -6.570
  157   2HH2  ARG  20          HH22      ARG  20   4.387  15.391  -5.778
  158    H    ASP  21           HN       ASP  21   6.440  11.718  -5.141
  159    HA   ASP  21           HA       ASP  21   4.585  12.185  -7.224
  160   1HB   ASP  21          HB2       ASP  21   6.261  13.505  -8.379
  161   2HB   ASP  21          HB1       ASP  21   6.401  13.854  -6.665
  162    H    LEU  22           HN       LEU  22   7.533  10.261  -7.253
  163    HA   LEU  22           HA       LEU  22   8.149   8.457  -8.442
  164   1HB   LEU  22          HB2       LEU  22   5.176   8.244  -8.694
  165   2HB   LEU  22          HB1       LEU  22   6.207   7.145  -9.582
  166    HG   LEU  22           HG       LEU  22   5.369   6.163  -7.560
  167   1HD1  LEU  22          HD11      LEU  22   7.528   5.401  -6.605
  168   2HD1  LEU  22          HD12      LEU  22   8.335   6.716  -7.462
  169   3HD1  LEU  22          HD13      LEU  22   7.538   5.435  -8.368
  170   1HD2  LEU  22          HD21      LEU  22   6.120   6.899  -5.338
  171   2HD2  LEU  22          HD22      LEU  22   5.126   8.114  -6.146
  172   3HD2  LEU  22          HD23      LEU  22   6.876   8.308  -6.081
  173    H    ALA  23           HN       ALA  23   7.898  11.140  -9.725
  174    HA   ALA  23           HA       ALA  23   7.051  10.780 -12.401
  175   1HB   ALA  23          HB1       ALA  23   8.867  12.896 -11.268
  176   2HB   ALA  23          HB2       ALA  23   7.105  12.979 -11.317
  177   3HB   ALA  23          HB3       ALA  23   8.032  12.965 -12.818
  178    H    GLY  24           HN       GLY  24   9.973  10.422 -10.809
  179   1HA   GLY  24          HA2       GLY  24  11.127   9.130 -13.182
  180   2HA   GLY  24          HA1       GLY  24  12.061  10.420 -12.420
  181    H    ILE  25           HN       ILE  25  10.063   8.114 -10.757
  182    HA   ILE  25           HA       ILE  25  12.475   6.942  -9.585
  183    HB   ILE  25           HB       ILE  25   9.752   7.327  -8.222
  184   1HG1  ILE  25          HG12      ILE  25  11.157   8.589  -6.481
  185   2HG1  ILE  25          HG11      ILE  25  12.435   8.611  -7.682
  186   1HG2  ILE  25          HG21      ILE  25  12.204   5.991  -7.091
  187   2HG2  ILE  25          HG22      ILE  25  10.699   5.202  -7.551
  188   3HG2  ILE  25          HG23      ILE  25  10.718   6.342  -6.203
  189   1HD1  ILE  25          HD11      ILE  25  11.213  10.711  -7.619
  190   2HD1  ILE  25          HD12      ILE  25   9.712   9.856  -7.971
  191   3HD1  ILE  25          HD13      ILE  25  11.004   9.904  -9.173
  192    H    ASN  26           HN       ASN  26  12.373   4.648  -9.241
  193    HA   ASN  26           HA       ASN  26  11.373   3.253 -11.411
  194   1HB   ASN  26          HB2       ASN  26  12.279   2.174  -8.743
  195   2HB   ASN  26          HB1       ASN  26  11.887   1.159 -10.118
  196   1HD2  ASN  26          HD21      ASN  26  13.886   0.331 -10.383
  197   2HD2  ASN  26          HD22      ASN  26  15.261   1.237 -10.896
  198    H    LEU  27           HN       LEU  27   9.512   2.680 -11.983
  199    HA   LEU  27           HA       LEU  27   7.368   2.205 -10.025
  200   1HB   LEU  27          HB2       LEU  27   7.304   2.945 -12.942
  201   2HB   LEU  27          HB1       LEU  27   5.878   2.530 -12.009
  202    HG   LEU  27           HG       LEU  27   7.696   4.843 -11.341
  203   1HD1  LEU  27          HD11      LEU  27   6.626   5.162 -13.524
  204   2HD1  LEU  27          HD12      LEU  27   5.966   6.252 -12.304
  205   3HD1  LEU  27          HD13      LEU  27   5.057   4.822 -12.793
  206   1HD2  LEU  27          HD21      LEU  27   6.425   3.938  -9.480
  207   2HD2  LEU  27          HD22      LEU  27   4.937   4.068 -10.419
  208   3HD2  LEU  27          HD23      LEU  27   5.817   5.525  -9.952
  209    H    ASP  28           HN       ASP  28   9.176   0.853 -12.663
  210    HA   ASP  28           HA       ASP  28   7.454  -1.446 -13.033
  211   1HB   ASP  28          HB2       ASP  28   8.705  -0.463 -14.911
  212   2HB   ASP  28          HB1       ASP  28  10.219  -0.839 -14.103
  213    H    SER  29           HN       SER  29  10.201  -0.618 -11.176
  214    HA   SER  29           HA       SER  29  11.246  -3.217 -10.757
  215   1HB   SER  29          HB2       SER  29  11.664  -0.677  -9.215
  216   2HB   SER  29          HB1       SER  29  12.662  -2.123  -9.130
  217    HG   SER  29           HG       SER  29  13.318  -1.870 -11.154
  218    H    SER  30           HN       SER  30  11.053  -4.569  -9.079
  219    HA   SER  30           HA       SER  30   8.743  -4.676  -7.487
  220   1HB   SER  30          HB2       SER  30  11.427  -6.000  -7.150
  221   2HB   SER  30          HB1       SER  30   9.916  -6.574  -6.462
  222    HG   SER  30           HG       SER  30   9.216  -6.576  -8.818
  223    H    LEU  31           HN       LEU  31   8.615  -4.410  -5.154
  224    HA   LEU  31           HA       LEU  31   9.588  -2.141  -4.010
  225   1HB   LEU  31          HB2       LEU  31   7.728  -3.539  -3.159
  226   2HB   LEU  31          HB1       LEU  31   8.893  -4.721  -2.596
  227    HG   LEU  31           HG       LEU  31   9.830  -2.949  -1.093
  228   1HD1  LEU  31          HD11      LEU  31   9.009  -1.050  -2.305
  229   2HD1  LEU  31          HD12      LEU  31   8.408  -1.039  -0.629
  230   3HD1  LEU  31          HD13      LEU  31   7.348  -1.553  -1.962
  231   1HD2  LEU  31          HD21      LEU  31   8.047  -3.135   0.552
  232   2HD2  LEU  31          HD22      LEU  31   8.305  -4.672  -0.275
  233   3HD2  LEU  31          HD23      LEU  31   6.931  -3.660  -0.708
  234    H    ALA  32           HN       ALA  32  10.910  -5.347  -3.900
  235    HA   ALA  32           HA       ALA  32  12.954  -4.839  -2.015
  236   1HB   ALA  32          HB1       ALA  32  12.263  -7.095  -2.547
  237   2HB   ALA  32          HB2       ALA  32  14.000  -6.896  -2.789
  238   3HB   ALA  32          HB3       ALA  32  12.911  -6.922  -4.175
  239    H    ASP  33           HN       ASP  33  12.781  -4.640  -5.508
  240    HA   ASP  33           HA       ASP  33  15.534  -4.374  -6.043
  241   1HB   ASP  33          HB2       ASP  33  13.825  -5.052  -7.734
  242   2HB   ASP  33          HB1       ASP  33  13.220  -3.407  -7.720
  243    H    LEU  34           HN       LEU  34  12.922  -2.164  -5.437
  244    HA   LEU  34           HA       LEU  34  14.037   0.327  -6.022
  245   1HB   LEU  34          HB2       LEU  34  12.292  -0.238  -3.626
  246   2HB   LEU  34          HB1       LEU  34  12.415   1.260  -4.527
  247    HG   LEU  34           HG       LEU  34  11.180  -1.307  -5.498
  248   1HD1  LEU  34          HD11      LEU  34   9.118  -0.075  -5.483
  249   2HD1  LEU  34          HD12      LEU  34   9.934   1.299  -4.722
  250   3HD1  LEU  34          HD13      LEU  34   9.807  -0.254  -3.866
  251   1HD2  LEU  34          HD21      LEU  34  12.197  -0.114  -7.321
  252   2HD2  LEU  34          HD22      LEU  34  11.331   1.368  -6.857
  253   3HD2  LEU  34          HD23      LEU  34  10.436  -0.066  -7.389
  254    H    GLY  35           HN       GLY  35  14.227  -1.672  -3.168
  255   1HA   GLY  35          HA2       GLY  35  16.572  -1.669  -2.238
  256   2HA   GLY  35          HA1       GLY  35  16.352   0.072  -2.136
  257    H    LEU  36           HN       LEU  36  14.039  -2.519  -1.347
  258    HA   LEU  36           HA       LEU  36  13.551  -1.274   1.171
  259   1HB   LEU  36          HB2       LEU  36  11.679  -2.585   1.263
  260   2HB   LEU  36          HB1       LEU  36  12.015  -2.906  -0.409
  261    HG   LEU  36           HG       LEU  36  13.299  -4.999   0.552
  262   1HD1  LEU  36          HD11      LEU  36  11.408  -4.389   2.818
  263   2HD1  LEU  36          HD12      LEU  36  13.169  -4.385   2.900
  264   3HD1  LEU  36          HD13      LEU  36  12.304  -5.893   2.599
  265   1HD2  LEU  36          HD21      LEU  36  10.298  -4.817   0.558
  266   2HD2  LEU  36          HD22      LEU  36  11.240  -6.305   0.453
  267   3HD2  LEU  36          HD23      LEU  36  11.315  -5.118  -0.852
  268    H    ASP  37           HN       ASP  37  14.617  -1.587   2.949
  269    HA   ASP  37           HA       ASP  37  16.807  -3.500   2.915
  270   1HB   ASP  37          HB2       ASP  37  17.168  -1.138   3.597
  271   2HB   ASP  37          HB1       ASP  37  16.168  -1.437   5.018
  272    H    SER  38           HN       SER  38  14.607  -2.582   5.583
  273    HA   SER  38           HA       SER  38  13.893  -5.374   5.906
  274   1HB   SER  38          HB2       SER  38  15.973  -5.098   7.267
  275   2HB   SER  38          HB1       SER  38  15.171  -3.833   8.195
  276    HG   SER  38           HG       SER  38  14.335  -6.535   7.974
  277    H    LEU  39           HN       LEU  39  13.655  -2.338   7.831
  278    HA   LEU  39           HA       LEU  39  11.048  -2.618   8.741
  279   1HB   LEU  39          HB2       LEU  39  12.529  -0.855   9.539
  280   2HB   LEU  39          HB1       LEU  39  12.491  -0.078   7.969
  281    HG   LEU  39           HG       LEU  39  10.007   0.211   8.303
  282   1HD1  LEU  39          HD11      LEU  39   9.155   0.197  10.582
  283   2HD1  LEU  39          HD12      LEU  39  10.672  -0.511  11.134
  284   3HD1  LEU  39          HD13      LEU  39   9.632  -1.406  10.025
  285   1HD2  LEU  39          HD21      LEU  39  10.267   2.195   9.719
  286   2HD2  LEU  39          HD22      LEU  39  11.540   2.054   8.504
  287   3HD2  LEU  39          HD23      LEU  39  11.877   1.636  10.187
  288    H    MET  40           HN       MET  40  12.215  -1.609   5.675
  289    HA   MET  40           HA       MET  40   9.835  -0.415   4.616
  290   1HB   MET  40          HB2       MET  40  12.162  -1.657   3.147
  291   2HB   MET  40          HB1       MET  40  10.968  -0.541   2.495
  292   1HG   MET  40          HG2       MET  40  11.767   1.247   3.816
  293   2HG   MET  40          HG1       MET  40  12.789   0.171   4.766
  294   1HE   MET  40          HE1       MET  40  14.893   1.755   4.403
  295   2HE   MET  40          HE2       MET  40  13.868   2.859   3.484
  296   3HE   MET  40          HE3       MET  40  15.410   2.324   2.814
  297    H    GLY  41           HN       GLY  41  10.491  -3.637   5.317
  298   1HA   GLY  41          HA2       GLY  41   8.349  -4.474   3.476
  299   2HA   GLY  41          HA1       GLY  41   9.551  -5.559   4.176
  300    H    VAL  42           HN       VAL  42   9.431  -4.335   6.785
  301    HA   VAL  42           HA       VAL  42   7.286  -5.890   7.853
  302    HB   VAL  42           HB       VAL  42   9.147  -3.994   9.309
  303   1HG1  VAL  42          HG11      VAL  42   7.430  -6.235  10.362
  304   2HG1  VAL  42          HG12      VAL  42   7.178  -4.509  10.606
  305   3HG1  VAL  42          HG13      VAL  42   8.595  -5.303  11.307
  306   1HG2  VAL  42          HG21      VAL  42   9.415  -6.968   8.865
  307   2HG2  VAL  42          HG22      VAL  42  10.472  -5.976   9.874
  308   3HG2  VAL  42          HG23      VAL  42  10.414  -5.712   8.131
  309    H    GLU  43           HN       GLU  43   7.961  -2.425   7.589
  310    HA   GLU  43           HA       GLU  43   5.911  -1.423   9.191
  311   1HB   GLU  43          HB2       GLU  43   7.762  -0.054   8.261
  312   2HB   GLU  43          HB1       GLU  43   7.046  -0.198   6.664
  313   1HG   GLU  43          HG2       GLU  43   6.378   1.929   7.433
  314   2HG   GLU  43          HG1       GLU  43   4.996   0.862   7.640
  315    H    VAL  44           HN       VAL  44   5.955  -2.433   5.874
  316    HA   VAL  44           HA       VAL  44   3.463  -1.529   4.883
  317    HB   VAL  44           HB       VAL  44   4.515  -4.226   4.208
  318   1HG1  VAL  44          HG11      VAL  44   3.934  -3.594   1.964
  319   2HG1  VAL  44          HG12      VAL  44   3.432  -2.003   2.552
  320   3HG1  VAL  44          HG13      VAL  44   2.565  -3.467   3.079
  321   1HG2  VAL  44          HG21      VAL  44   6.183  -3.253   2.682
  322   2HG2  VAL  44          HG22      VAL  44   6.520  -3.032   4.389
  323   3HG2  VAL  44          HG23      VAL  44   5.907  -1.668   3.437
  324    H    ARG  45           HN       ARG  45   4.378  -4.668   6.162
  325    HA   ARG  45           HA       ARG  45   1.806  -5.733   6.220
  326   1HB   ARG  45          HB2       ARG  45   3.829  -7.078   6.285
  327   2HB   ARG  45          HB1       ARG  45   4.224  -6.434   7.870
  328   1HG   ARG  45          HG2       ARG  45   2.180  -7.461   8.762
  329   2HG   ARG  45          HG1       ARG  45   1.872  -8.167   7.170
  330   1HD   ARG  45          HD2       ARG  45   2.988  -9.728   8.711
  331   2HD   ARG  45          HD1       ARG  45   3.934  -9.377   7.258
  332    HE   ARG  45           HE       ARG  45   5.466  -8.214   8.506
  333   1HH1  ARG  45          HH11      ARG  45   2.715  -9.097  10.630
  334   2HH1  ARG  45          HH12      ARG  45   3.603  -8.990  12.054
  335   1HH2  ARG  45          HH21      ARG  45   6.674  -8.097  10.473
  336   2HH2  ARG  45          HH22      ARG  45   5.951  -8.431  11.990
  337    H    GLN  46           HN       GLN  46   3.705  -4.040   8.687
  338    HA   GLN  46           HA       GLN  46   1.946  -4.283  10.840
  339   1HB   GLN  46          HB2       GLN  46   3.998  -2.204  10.173
  340   2HB   GLN  46          HB1       GLN  46   3.005  -2.078  11.619
  341   1HG   GLN  46          HG2       GLN  46   4.649  -4.461  10.938
  342   2HG   GLN  46          HG1       GLN  46   5.260  -3.133  11.942
  343   1HE2  GLN  46          HE21      GLN  46   4.394  -2.890  13.998
  344   2HE2  GLN  46          HE22      GLN  46   3.489  -4.132  14.782
  345    H    ILE  47           HN       ILE  47   1.656  -2.288   8.059
  346    HA   ILE  47           HA       ILE  47  -0.333  -0.569   9.272
  347    HB   ILE  47           HB       ILE  47   0.366  -0.957   6.336
  348   1HG1  ILE  47          HG12      ILE  47   1.148   1.285   8.196
  349   2HG1  ILE  47          HG11      ILE  47   2.200  -0.071   7.821
  350   1HG2  ILE  47          HG21      ILE  47  -1.891  -0.062   6.648
  351   2HG2  ILE  47          HG22      ILE  47  -0.824   1.174   5.984
  352   3HG2  ILE  47          HG23      ILE  47  -1.256   1.203   7.697
  353   1HD1  ILE  47          HD11      ILE  47   2.811   1.858   6.515
  354   2HD1  ILE  47          HD12      ILE  47   1.164   2.000   5.894
  355   3HD1  ILE  47          HD13      ILE  47   2.161   0.610   5.452
  356    H    LEU  48           HN       LEU  48  -0.336  -3.011   6.726
  357    HA   LEU  48           HA       LEU  48  -3.142  -3.068   6.431
  358   1HB   LEU  48          HB2       LEU  48  -1.017  -4.991   5.512
  359   2HB   LEU  48          HB1       LEU  48  -2.709  -5.224   5.151
  360    HG   LEU  48           HG       LEU  48  -1.666  -4.308   3.236
  361   1HD1  LEU  48          HD11      LEU  48  -2.890  -2.230   2.882
  362   2HD1  LEU  48          HD12      LEU  48  -3.190  -2.127   4.614
  363   3HD1  LEU  48          HD13      LEU  48  -3.881  -3.456   3.680
  364   1HD2  LEU  48          HD21      LEU  48  -0.644  -2.070   4.961
  365   2HD2  LEU  48          HD22      LEU  48  -0.494  -2.168   3.205
  366   3HD2  LEU  48          HD23      LEU  48   0.320  -3.352   4.230
  367    H    GLU  49           HN       GLU  49  -0.966  -5.233   8.178
  368    HA   GLU  49           HA       GLU  49  -2.863  -7.171   8.931
  369   1HB   GLU  49          HB2       GLU  49  -0.427  -7.504   8.952
  370   2HB   GLU  49          HB1       GLU  49  -0.272  -6.334  10.246
  371   1HG   GLU  49          HG2       GLU  49  -1.597  -7.841  11.691
  372   2HG   GLU  49          HG1       GLU  49  -1.609  -9.021  10.383
  373    H    ARG  50           HN       ARG  50  -1.892  -4.141  10.271
  374    HA   ARG  50           HA       ARG  50  -3.096  -4.576  12.849
  375   1HB   ARG  50          HB2       ARG  50  -1.041  -3.260  12.385
  376   2HB   ARG  50          HB1       ARG  50  -2.047  -2.079  11.580
  377   1HG   ARG  50          HG2       ARG  50  -3.208  -1.672  13.703
  378   2HG   ARG  50          HG1       ARG  50  -2.098  -2.810  14.484
  379   1HD   ARG  50          HD2       ARG  50  -1.188  -0.629  14.825
  380   2HD   ARG  50          HD1       ARG  50  -0.212  -1.439  13.594
  381    HE   ARG  50           HE       ARG  50  -2.361   0.399  12.793
  382   1HH1  ARG  50          HH11      ARG  50   1.018  -0.558  12.687
  383   2HH1  ARG  50          HH12      ARG  50   1.542   0.720  11.687
  384   1HH2  ARG  50          HH21      ARG  50  -1.662   2.255  11.460
  385   2HH2  ARG  50          HH22      ARG  50  -0.029   2.357  10.983
  386    H    GLU  51           HN       GLU  51  -3.621  -2.269  10.200
  387    HA   GLU  51           HA       GLU  51  -5.883  -1.077  11.380
  388   1HB   GLU  51          HB2       GLU  51  -4.937  -0.932   8.525
  389   2HB   GLU  51          HB1       GLU  51  -6.085   0.151   9.292
  390   1HG   GLU  51          HG2       GLU  51  -3.195  -0.184  10.061
  391   2HG   GLU  51          HG1       GLU  51  -3.875   1.143   9.126
  392    H    HIS  52           HN       HIS  52  -5.623  -3.457   8.733
  393    HA   HIS  52           HA       HIS  52  -8.570  -3.700   8.874
  394   1HB   HIS  52          HB2       HIS  52  -6.807  -3.692   6.449
  395   2HB   HIS  52          HB1       HIS  52  -8.362  -4.502   6.412
  396    HD1  HIS  52           HD1      HIS  52  -9.049  -2.753   4.548
  397    HD2  HIS  52           HD2      HIS  52  -8.303  -1.133   8.303
  398    HE1  HIS  52           HE1      HIS  52  -9.951  -0.419   4.483
  399    HE2  HIS  52           HE2      HIS  52  -9.328   0.584   6.689
  400    H    ASP  53           HN       ASP  53  -5.919  -5.251   9.700
  401    HA   ASP  53           HA       ASP  53  -5.275  -7.334  10.102
  402   1HB   ASP  53          HB2       ASP  53  -7.417  -7.488  11.316
  403   2HB   ASP  53          HB1       ASP  53  -8.230  -7.991   9.843
  404    H    LEU  54           HN       LEU  54  -4.605  -6.650   7.744
  405    HA   LEU  54           HA       LEU  54  -5.022  -9.044   6.084
  406   1HB   LEU  54          HB2       LEU  54  -4.431  -6.203   5.313
  407   2HB   LEU  54          HB1       LEU  54  -3.860  -7.495   4.286
  408    HG   LEU  54           HG       LEU  54  -6.229  -8.201   3.952
  409   1HD1  LEU  54          HD11      LEU  54  -7.199  -7.325   5.990
  410   2HD1  LEU  54          HD12      LEU  54  -8.025  -6.696   4.563
  411   3HD1  LEU  54          HD13      LEU  54  -6.883  -5.679   5.443
  412   1HD2  LEU  54          HD21      LEU  54  -6.820  -6.342   2.477
  413   2HD2  LEU  54          HD22      LEU  54  -5.118  -6.775   2.339
  414   3HD2  LEU  54          HD23      LEU  54  -5.591  -5.342   3.247
  415    H    VAL  55           HN       VAL  55  -3.474 -10.328   6.945
  416    HA   VAL  55           HA       VAL  55  -0.804  -9.342   7.374
  417    HB   VAL  55           HB       VAL  55  -1.689 -12.240   7.245
  418   1HG1  VAL  55          HG11      VAL  55   0.708 -11.930   7.096
  419   2HG1  VAL  55          HG12      VAL  55   0.282 -12.655   8.646
  420   3HG1  VAL  55          HG13      VAL  55   0.693 -10.941   8.556
  421   1HG2  VAL  55          HG21      VAL  55  -1.890 -12.186   9.682
  422   2HG2  VAL  55          HG22      VAL  55  -3.028 -11.069   8.926
  423   3HG2  VAL  55          HG23      VAL  55  -1.553 -10.457   9.676
  424    H    LEU  56           HN       LEU  56  -0.239  -8.510   5.416
  425    HA   LEU  56           HA       LEU  56  -0.047 -10.342   3.171
  426   1HB   LEU  56          HB2       LEU  56   0.841  -7.442   3.317
  427   2HB   LEU  56          HB1       LEU  56   0.760  -8.432   1.892
  428    HG   LEU  56           HG       LEU  56  -1.635  -7.531   3.492
  429   1HD1  LEU  56          HD11      LEU  56  -0.581  -5.701   2.297
  430   2HD1  LEU  56          HD12      LEU  56  -2.114  -6.134   1.542
  431   3HD1  LEU  56          HD13      LEU  56  -0.591  -6.644   0.810
  432   1HD2  LEU  56          HD21      LEU  56  -1.465  -9.041   0.881
  433   2HD2  LEU  56          HD22      LEU  56  -2.942  -8.457   1.643
  434   3HD2  LEU  56          HD23      LEU  56  -1.980  -9.709   2.429
  435    HA   PRO  57           HA       PRO  57   3.960 -11.402   4.833
  436   1HB   PRO  57          HB2       PRO  57   3.937 -13.178   2.482
  437   2HB   PRO  57          HB1       PRO  57   4.136 -13.579   4.192
  438   1HG   PRO  57          HG2       PRO  57   1.864 -14.195   2.961
  439   2HG   PRO  57          HG1       PRO  57   1.817 -13.484   4.592
  440   1HD   PRO  57          HD2       PRO  57   1.470 -12.105   1.951
  441   2HD   PRO  57          HD1       PRO  57   0.427 -12.045   3.393
  442    H    ILE  58           HN       ILE  58   6.120 -11.268   4.110
  443    HA   ILE  58           HA       ILE  58   6.514  -9.139   2.302
  444    HB   ILE  58           HB       ILE  58   8.567 -10.950   3.628
  445   1HG1  ILE  58          HG12      ILE  58   9.132  -8.756   4.849
  446   2HG1  ILE  58          HG11      ILE  58   7.638  -8.145   4.147
  447   1HG2  ILE  58          HG21      ILE  58  10.311  -9.370   2.908
  448   2HG2  ILE  58          HG22      ILE  58   9.120  -8.506   1.933
  449   3HG2  ILE  58          HG23      ILE  58   9.519 -10.182   1.557
  450   1HD1  ILE  58          HD11      ILE  58   7.851 -10.477   6.036
  451   2HD1  ILE  58          HD12      ILE  58   6.362  -9.810   5.364
  452   3HD1  ILE  58          HD13      ILE  58   7.340  -8.843   6.465
  453    H    ARG  59           HN       ARG  59   6.715 -12.569   1.984
  454    HA   ARG  59           HA       ARG  59   7.945 -12.483  -0.535
  455   1HB   ARG  59          HB2       ARG  59   7.221 -14.832  -0.960
  456   2HB   ARG  59          HB1       ARG  59   8.082 -14.601   0.542
  457   1HG   ARG  59          HG2       ARG  59   5.083 -14.818   0.380
  458   2HG   ARG  59          HG1       ARG  59   6.139 -16.215   0.555
  459   1HD   ARG  59          HD2       ARG  59   5.822 -13.906   2.474
  460   2HD   ARG  59          HD1       ARG  59   5.313 -15.577   2.726
  461    HE   ARG  59           HE       ARG  59   8.149 -14.806   2.439
  462   1HH1  ARG  59          HH11      ARG  59   5.677 -16.700   4.140
  463   2HH1  ARG  59          HH12      ARG  59   6.739 -17.205   5.363
  464   1HH2  ARG  59          HH21      ARG  59   9.559 -15.487   4.082
  465   2HH2  ARG  59          HH22      ARG  59   9.016 -16.507   5.337
  466    H    GLU  60           HN       GLU  60   4.919 -11.409   0.178
  467    HA   GLU  60           HA       GLU  60   4.170 -11.502  -2.667
  468   1HB   GLU  60          HB2       GLU  60   2.607 -10.804  -0.189
  469   2HB   GLU  60          HB1       GLU  60   1.984 -10.462  -1.783
  470   1HG   GLU  60          HG2       GLU  60   2.165 -12.914  -2.264
  471   2HG   GLU  60          HG1       GLU  60   2.593 -13.139  -0.566
  472    H    VAL  61           HN       VAL  61   4.497  -9.373   0.102
  473    HA   VAL  61           HA       VAL  61   4.058  -6.942  -1.142
  474    HB   VAL  61           HB       VAL  61   5.736  -7.547   1.315
  475   1HG1  VAL  61          HG11      VAL  61   6.274  -5.336   0.465
  476   2HG1  VAL  61          HG12      VAL  61   5.351  -5.234   1.968
  477   3HG1  VAL  61          HG13      VAL  61   4.559  -4.922   0.422
  478   1HG2  VAL  61          HG21      VAL  61   3.724  -6.904   2.553
  479   2HG2  VAL  61          HG22      VAL  61   3.450  -8.306   1.517
  480   3HG2  VAL  61          HG23      VAL  61   2.856  -6.719   1.029
  481    H    ARG  62           HN       ARG  62   6.958  -8.824  -0.957
  482    HA   ARG  62           HA       ARG  62   8.840  -6.887  -1.609
  483   1HB   ARG  62          HB2       ARG  62   9.416  -9.032  -0.667
  484   2HB   ARG  62          HB1       ARG  62   8.849  -9.850  -2.113
  485   1HG   ARG  62          HG2       ARG  62  10.611  -8.919  -3.397
  486   2HG   ARG  62          HG1       ARG  62  11.107  -7.905  -2.035
  487   1HD   ARG  62          HD2       ARG  62  11.715  -9.884  -0.759
  488   2HD   ARG  62          HD1       ARG  62  11.083 -10.934  -2.028
  489    HE   ARG  62           HE       ARG  62  12.977  -9.412  -3.267
  490   1HH1  ARG  62          HH11      ARG  62  13.110 -11.531  -0.384
  491   2HH1  ARG  62          HH12      ARG  62  14.654 -12.101  -0.775
  492   1HH2  ARG  62          HH21      ARG  62  15.086 -10.136  -3.682
  493   2HH2  ARG  62          HH22      ARG  62  15.850 -11.262  -2.659
  494    H    GLN  63           HN       GLN  63   6.532  -8.479  -3.691
  495    HA   GLN  63           HA       GLN  63   8.042  -7.578  -6.024
  496   1HB   GLN  63          HB2       GLN  63   5.700  -9.499  -5.938
  497   2HB   GLN  63          HB1       GLN  63   6.481  -8.949  -7.410
  498   1HG   GLN  63          HG2       GLN  63   7.378 -11.060  -7.021
  499   2HG   GLN  63          HG1       GLN  63   8.614  -9.950  -6.438
  500   1HE2  GLN  63          HE21      GLN  63   5.652 -10.699  -4.765
  501   2HE2  GLN  63          HE22      GLN  63   6.359 -11.547  -3.454
  502    H    LEU  64           HN       LEU  64   5.886  -6.362  -4.010
  503    HA   LEU  64           HA       LEU  64   4.015  -5.248  -5.867
  504   1HB   LEU  64          HB2       LEU  64   4.804  -4.155  -3.160
  505   2HB   LEU  64          HB1       LEU  64   3.394  -3.700  -4.087
  506    HG   LEU  64           HG       LEU  64   3.916  -6.286  -2.673
  507   1HD1  LEU  64          HD11      LEU  64   1.850  -4.141  -2.260
  508   2HD1  LEU  64          HD12      LEU  64   3.233  -4.490  -1.221
  509   3HD1  LEU  64          HD13      LEU  64   1.925  -5.663  -1.373
  510   1HD2  LEU  64          HD21      LEU  64   1.671  -6.996  -3.412
  511   2HD2  LEU  64          HD22      LEU  64   2.778  -6.786  -4.766
  512   3HD2  LEU  64          HD23      LEU  64   1.563  -5.553  -4.421
  513    H    THR  65           HN       THR  65   4.368  -3.562  -7.175
  514    HA   THR  65           HA       THR  65   6.886  -2.229  -7.050
  515    HB   THR  65           HB       THR  65   5.858  -1.085  -9.079
  516    HG1  THR  65           HG1      THR  65   3.944  -2.294  -9.844
  517   1HG2  THR  65          HG21      THR  65   5.918  -4.094  -9.032
  518   2HG2  THR  65          HG22      THR  65   7.330  -3.058  -9.169
  519   3HG2  THR  65          HG23      THR  65   6.120  -3.076 -10.470
  520    H    LEU  66           HN       LEU  66   6.939   0.093  -6.959
  521    HA   LEU  66           HA       LEU  66   5.876   0.972  -4.578
  522   1HB   LEU  66          HB2       LEU  66   7.881   1.826  -5.941
  523   2HB   LEU  66          HB1       LEU  66   6.733   2.835  -6.785
  524    HG   LEU  66           HG       LEU  66   7.975   4.050  -5.044
  525   1HD1  LEU  66          HD11      LEU  66   5.785   4.853  -5.625
  526   2HD1  LEU  66          HD12      LEU  66   6.087   5.090  -3.896
  527   3HD1  LEU  66          HD13      LEU  66   5.057   3.763  -4.446
  528   1HD2  LEU  66          HD21      LEU  66   6.604   2.178  -3.121
  529   2HD2  LEU  66          HD22      LEU  66   7.550   3.599  -2.677
  530   3HD2  LEU  66          HD23      LEU  66   8.331   2.233  -3.476
  531    H    ARG  67           HN       ARG  67   4.597   1.551  -7.844
  532    HA   ARG  67           HA       ARG  67   2.542   3.244  -6.742
  533   1HB   ARG  67          HB2       ARG  67   3.805   3.169  -9.160
  534   2HB   ARG  67          HB1       ARG  67   2.270   2.405  -9.538
  535   1HG   ARG  67          HG2       ARG  67   2.322   4.863  -9.938
  536   2HG   ARG  67          HG1       ARG  67   1.044   4.334  -8.844
  537   1HD   ARG  67          HD2       ARG  67   2.149   5.174  -6.955
  538   2HD   ARG  67          HD1       ARG  67   3.698   5.253  -7.773
  539    HE   ARG  67           HE       ARG  67   2.640   7.090  -9.152
  540   1HH1  ARG  67          HH11      ARG  67   1.356   6.602  -5.872
  541   2HH1  ARG  67          HH12      ARG  67   1.055   8.270  -5.662
  542   1HH2  ARG  67          HH21      ARG  67   2.249   9.270  -8.805
  543   2HH2  ARG  67          HH22      ARG  67   1.610   9.841  -7.334
  544    H    LYS  68           HN       LYS  68   2.941  -0.044  -6.935
  545    HA   LYS  68           HA       LYS  68   0.149  -0.702  -7.398
  546   1HB   LYS  68          HB2       LYS  68   2.062  -2.221  -8.115
  547   2HB   LYS  68          HB1       LYS  68   2.374  -2.517  -6.413
  548   1HG   LYS  68          HG2       LYS  68   0.051  -3.409  -6.217
  549   2HG   LYS  68          HG1       LYS  68  -0.101  -3.256  -7.964
  550   1HD   LYS  68          HD2       LYS  68   1.890  -4.975  -6.474
  551   2HD   LYS  68          HD1       LYS  68   0.468  -5.541  -7.344
  552   1HE   LYS  68          HE2       LYS  68   1.474  -4.616  -9.438
  553   2HE   LYS  68          HE1       LYS  68   2.926  -4.234  -8.514
  554   1HZ   LYS  68          HZ1       LYS  68   3.238  -6.345  -9.610
  555   2HZ   LYS  68          HZ2       LYS  68   1.759  -6.893  -9.032
  556   3HZ   LYS  68          HZ3       LYS  68   3.022  -6.711  -7.959
  557    H    LEU  69           HN       LEU  69   2.255   0.172  -4.875
  558    HA   LEU  69           HA       LEU  69   1.076  -1.020  -2.642
  559   1HB   LEU  69          HB2       LEU  69   2.606   1.504  -2.993
  560   2HB   LEU  69          HB1       LEU  69   1.707   1.309  -1.504
  561    HG   LEU  69           HG       LEU  69   3.948   0.660  -1.102
  562   1HD1  LEU  69          HD11      LEU  69   2.260  -0.645  -0.006
  563   2HD1  LEU  69          HD12      LEU  69   3.666  -1.656  -0.364
  564   3HD1  LEU  69          HD13      LEU  69   2.205  -1.765  -1.358
  565   1HD2  LEU  69          HD21      LEU  69   4.639   0.214  -3.396
  566   2HD2  LEU  69          HD22      LEU  69   3.674  -1.259  -3.407
  567   3HD2  LEU  69          HD23      LEU  69   5.077  -1.129  -2.334
  568    H    GLN  70           HN       GLN  70   0.073   1.831  -4.358
  569    HA   GLN  70           HA       GLN  70  -2.002   2.359  -2.481
  570   1HB   GLN  70          HB2       GLN  70  -2.779   4.043  -4.212
  571   2HB   GLN  70          HB1       GLN  70  -1.202   4.297  -3.480
  572   1HG   GLN  70          HG2       GLN  70  -0.121   3.408  -5.423
  573   2HG   GLN  70          HG1       GLN  70  -1.687   3.113  -6.224
  574   1HE2  GLN  70          HE21      GLN  70  -1.211   4.555  -7.952
  575   2HE2  GLN  70          HE22      GLN  70  -1.166   6.247  -7.670
  576    H    GLU  71           HN       GLU  71  -1.716   0.247  -5.067
  577    HA   GLU  71           HA       GLU  71  -4.563   0.044  -5.575
  578   1HB   GLU  71          HB2       GLU  71  -2.910  -0.393  -7.363
  579   2HB   GLU  71          HB1       GLU  71  -2.262  -1.730  -6.422
  580   1HG   GLU  71          HG2       GLU  71  -4.515  -2.796  -6.554
  581   2HG   GLU  71          HG1       GLU  71  -4.986  -1.519  -7.671
  582    H    MET  72           HN       MET  72  -2.008  -1.641  -3.859
  583    HA   MET  72           HA       MET  72  -3.767  -3.739  -2.860
  584   1HB   MET  72          HB2       MET  72  -0.880  -3.081  -2.234
  585   2HB   MET  72          HB1       MET  72  -1.744  -4.445  -1.556
  586   1HG   MET  72          HG2       MET  72  -1.183  -4.008  -4.481
  587   2HG   MET  72          HG1       MET  72  -0.265  -5.062  -3.410
  588   1HE   MET  72          HE1       MET  72  -2.067  -7.716  -5.601
  589   2HE   MET  72          HE2       MET  72  -0.533  -7.169  -4.920
  590   3HE   MET  72          HE3       MET  72  -1.364  -6.183  -6.121
  591    H    SER  73           HN       SER  73  -3.324  -0.638  -2.129
  592    HA   SER  73           HA       SER  73  -2.830  -0.345   0.513
  593   1HB   SER  73          HB2       SER  73  -2.827   1.499  -0.929
  594   2HB   SER  73          HB1       SER  73  -4.508   1.285  -1.363
  595    HG   SER  73           HG       SER  73  -3.951   1.727   1.347
  596    H    SER  74           HN       SER  74  -5.995  -0.982  -1.013
  597    HA   SER  74           HA       SER  74  -7.892  -1.856  -0.296
  598   1HB   SER  74          HB2       SER  74  -6.399  -2.669   2.205
  599   2HB   SER  74          HB1       SER  74  -7.890  -3.385   1.578
  600    HG   SER  74           HG       SER  74  -5.322  -3.387   0.405
  601    H    LYS  75           HN       LYS  75  -8.992   0.098  -0.186
  602    HA   LYS  75           HA       LYS  75  -8.983   1.602   2.303
  603   1HB   LYS  75          HB2       LYS  75 -10.550   2.031  -0.240
  604   2HB   LYS  75          HB1       LYS  75 -10.575   3.101   1.146
  605   1HG   LYS  75          HG2       LYS  75  -8.197   2.508  -0.602
  606   2HG   LYS  75          HG1       LYS  75  -9.177   3.974  -0.627
  607   1HD   LYS  75          HD2       LYS  75  -8.525   4.339   1.762
  608   2HD   LYS  75          HD1       LYS  75  -7.418   2.976   1.605
  609   1HE   LYS  75          HE2       LYS  75  -7.353   5.521  -0.021
  610   2HE   LYS  75          HE1       LYS  75  -6.271   5.102   1.305
  611   1HZ   LYS  75          HZ1       LYS  75  -5.355   4.776  -0.904
  612   2HZ   LYS  75          HZ2       LYS  75  -6.477   3.558  -1.237
  613   3HZ   LYS  75          HZ3       LYS  75  -5.335   3.346  -0.004
  614    H    ALA  76           HN       ALA  76 -10.856  -0.873   0.819
  615    HA   ALA  76           HA       ALA  76 -13.103  -0.225   2.565
  616   1HB   ALA  76          HB1       ALA  76 -14.466  -1.612   1.096
  617   2HB   ALA  76          HB2       ALA  76 -13.045  -1.990   0.121
  618   3HB   ALA  76          HB3       ALA  76 -13.657  -0.338   0.182
  619    H    GLY  77           HN       GLY  77 -12.658  -1.172   4.459
  620   1HA   GLY  77          HA2       GLY  77 -11.638  -3.872   4.581
  621   2HA   GLY  77          HA1       GLY  77 -12.163  -2.880   5.944
  622    H    SER  78           HN       SER  78 -14.632  -2.314   4.331
  623    HA   SER  78           HA       SER  78 -16.032  -4.814   4.263
  624   1HB   SER  78          HB2       SER  78 -16.231  -4.205   6.628
  625   2HB   SER  78          HB1       SER  78 -16.757  -2.584   6.190
  626    HG   SER  78           HG       SER  78 -18.656  -3.311   6.140
  627    H    ASP  79           HN       ASP  79 -17.366  -4.695   2.578
  628    HA   ASP  79           HA       ASP  79 -18.267  -2.043   1.730
  629   1HB   ASP  79          HB2       ASP  79 -18.629  -2.903  -0.517
  630   2HB   ASP  79          HB1       ASP  79 -16.996  -3.330  -0.047
  631    H    THR  80           HN       THR  80 -20.407  -1.688   1.599
  632    HA   THR  80           HA       THR  80 -22.059  -3.881   2.618
  633    HB   THR  80           HB       THR  80 -21.504  -2.393   4.469
  634    HG1  THR  80           HG1      THR  80 -24.180  -1.805   3.792
  635   1HG2  THR  80          HG21      THR  80 -22.783  -0.196   2.836
  636   2HG2  THR  80          HG22      THR  80 -21.071  -0.330   3.238
  637   3HG2  THR  80          HG23      THR  80 -22.259  -0.046   4.512
  638    H    GLU  81           HN       GLU  81 -21.654  -1.548   0.202
  639    HA   GLU  81           HA       GLU  81 -24.387  -1.996  -0.672
  640   1HB   GLU  81          HB2       GLU  81 -24.379   0.206   0.384
  641   2HB   GLU  81          HB1       GLU  81 -22.968   0.679  -0.542
  642   1HG   GLU  81          HG2       GLU  81 -25.121   1.665  -1.306
  643   2HG   GLU  81          HG1       GLU  81 -24.225   0.795  -2.549
  644    H    LEU  82           HN       LEU  82 -24.615  -2.172  -2.877
  645    HA   LEU  82           HA       LEU  82 -22.187  -2.852  -4.290
  646   1HB   LEU  82          HB2       LEU  82 -24.192  -4.288  -4.425
  647   2HB   LEU  82          HB1       LEU  82 -25.078  -2.974  -5.168
  648    HG   LEU  82           HG       LEU  82 -23.457  -3.054  -7.072
  649   1HD1  LEU  82          HD11      LEU  82 -22.111  -5.074  -7.363
  650   2HD1  LEU  82          HD12      LEU  82 -22.564  -5.598  -5.740
  651   3HD1  LEU  82          HD13      LEU  82 -21.604  -4.136  -5.958
  652   1HD2  LEU  82          HD21      LEU  82 -25.658  -4.083  -7.236
  653   2HD2  LEU  82          HD22      LEU  82 -25.031  -5.569  -6.523
  654   3HD2  LEU  82          HD23      LEU  82 -24.456  -5.035  -8.104
  655    H    ALA  83           HN       ALA  83 -24.533  -0.304  -4.160
  656    HA   ALA  83           HA       ALA  83 -23.808   0.905  -6.637
  657   1HB   ALA  83          HB1       ALA  83 -25.179   2.121  -4.235
  658   2HB   ALA  83          HB2       ALA  83 -25.989   1.325  -5.585
  659   3HB   ALA  83          HB3       ALA  83 -25.103   2.825  -5.852
  660    H    ALA  84           HN       ALA  84 -22.054   2.020  -7.067
  661    HA   ALA  84           HA       ALA  84 -20.743   3.585  -5.017
  662   1HB   ALA  84          HB1       ALA  84 -19.327   1.451  -6.632
  663   2HB   ALA  84          HB2       ALA  84 -19.612   1.407  -4.890
  664   3HB   ALA  84          HB3       ALA  84 -18.543   2.628  -5.581
  665    HA   PRO  85           HA       PRO  85 -20.512   6.194  -8.657
  666   1HB   PRO  85          HB2       PRO  85 -18.699   7.901  -7.117
  667   2HB   PRO  85          HB1       PRO  85 -20.358   8.225  -7.620
  668   1HG   PRO  85          HG2       PRO  85 -19.695   7.825  -5.031
  669   2HG   PRO  85          HG1       PRO  85 -21.258   7.325  -5.700
  670   1HD   PRO  85          HD2       PRO  85 -18.808   5.679  -5.190
  671   2HD   PRO  85          HD1       PRO  85 -20.506   5.316  -4.807
  672    H    LYS  86           HN       LYS  86 -18.886   4.031  -8.812
  673    HA   LYS  86           HA       LYS  86 -16.098   4.301  -8.870
  674   1HB   LYS  86          HB2       LYS  86 -17.316   2.156  -9.016
  675   2HB   LYS  86          HB1       LYS  86 -17.863   2.587 -10.628
  676   1HG   LYS  86          HG2       LYS  86 -15.497   2.615 -11.369
  677   2HG   LYS  86          HG1       LYS  86 -15.028   2.044  -9.765
  678   1HD   LYS  86          HD2       LYS  86 -16.459   0.059 -10.086
  679   2HD   LYS  86          HD1       LYS  86 -16.856   0.633 -11.703
  680   1HE   LYS  86          HE2       LYS  86 -15.150  -1.026 -11.910
  681   2HE   LYS  86          HE1       LYS  86 -14.427   0.539 -12.260
  682   1HZ   LYS  86          HZ1       LYS  86 -13.484   0.548  -9.996
  683   2HZ   LYS  86          HZ2       LYS  86 -13.013  -0.808 -10.878
  684   3HZ   LYS  86          HZ3       LYS  86 -14.222  -0.951  -9.702
  685    H    SER  87           HN       SER  87 -18.515   4.801 -11.403
  686    HA   SER  87           HA       SER  87 -16.507   6.324 -12.884
  687   1HB   SER  87          HB2       SER  87 -18.757   4.670 -14.045
  688   2HB   SER  87          HB1       SER  87 -17.513   5.545 -14.950
  689    HG   SER  87           HG       SER  87 -16.618   3.901 -12.992
  690    H    LYS  88           HN       LYS  88 -17.099   8.200 -11.948
  691    HA   LYS  88           HA       LYS  88 -19.346   9.587 -13.098
  692   1HB   LYS  88          HB2       LYS  88 -19.155   9.171 -10.097
  693   2HB   LYS  88          HB1       LYS  88 -19.980  10.561 -10.775
  694   1HG   LYS  88          HG2       LYS  88 -20.712   7.678 -11.260
  695   2HG   LYS  88          HG1       LYS  88 -21.521   8.770 -10.132
  696   1HD   LYS  88          HD2       LYS  88 -22.193  10.216 -11.963
  697   2HD   LYS  88          HD1       LYS  88 -21.288   9.227 -13.109
  698   1HE   LYS  88          HE2       LYS  88 -23.634   8.284 -11.465
  699   2HE   LYS  88          HE1       LYS  88 -23.716   8.776 -13.154
  700   1HZ   LYS  88          HZ1       LYS  88 -23.599   6.402 -12.966
  701   2HZ   LYS  88          HZ2       LYS  88 -22.197   6.456 -12.062
  702   3HZ   LYS  88          HZ3       LYS  88 -22.179   6.949 -13.692
  703    H    ASN  89           HN       ASN  89 -17.085   9.880 -10.386
  704    HA   ASN  89           HA       ASN  89 -15.806  12.068 -11.761
  705   1HB   ASN  89          HB2       ASN  89 -15.590  13.331  -9.660
  706   2HB   ASN  89          HB1       ASN  89 -17.284  13.090 -10.041
  707   1HD2  ASN  89          HD21      ASN  89 -18.531  11.826  -8.682
  708   2HD2  ASN  89          HD22      ASN  89 -17.985  11.301  -7.128
  Start of MODEL   10
    1   1H    GLY   1          HT1       GLY   1  -4.131   8.711  11.926
    2   2H    GLY   1          HT2       GLY   1  -5.425   9.818  12.127
    3   3H    GLY   1          HT3       GLY   1  -3.820  10.364  11.907
    4   1HA   GLY   1          HA1       GLY   1  -5.188  10.587   9.914
    5   2HA   GLY   1          HA2       GLY   1  -3.757   9.578   9.708
    6    H    ASP   2           HN       ASP   2  -4.427   7.253  10.769
    7    HA   ASP   2           HA       ASP   2  -6.010   6.079   8.735
    8   1HB   ASP   2          HB2       ASP   2  -4.844   4.875  11.256
    9   2HB   ASP   2          HB1       ASP   2  -5.488   3.969   9.892
   10    H    GLY   3           HN       GLY   3  -7.604   4.256   9.518
   11   1HA   GLY   3          HA2       GLY   3  -9.345   3.891  11.218
   12   2HA   GLY   3          HA1       GLY   3  -9.579   5.639  11.201
   13    H    GLU   4           HN       GLU   4 -10.581   6.607   9.498
   14    HA   GLU   4           HA       GLU   4 -12.233   4.893   7.837
   15   1HB   GLU   4          HB2       GLU   4 -13.182   6.935   8.882
   16   2HB   GLU   4          HB1       GLU   4 -12.002   7.911   8.018
   17   1HG   GLU   4          HG2       GLU   4 -12.996   7.129   5.888
   18   2HG   GLU   4          HG1       GLU   4 -14.236   6.298   6.825
   19    H    ALA   5           HN       ALA   5  -9.714   7.309   7.608
   20    HA   ALA   5           HA       ALA   5  -9.207   6.509   4.852
   21   1HB   ALA   5          HB1       ALA   5  -8.378   9.032   6.294
   22   2HB   ALA   5          HB2       ALA   5  -9.677   8.904   5.107
   23   3HB   ALA   5          HB3       ALA   5  -8.004   8.636   4.617
   24    H    GLN   6           HN       GLN   6  -8.202   4.638   5.677
   25    HA   GLN   6           HA       GLN   6  -5.947   4.646   7.350
   26   1HB   GLN   6          HB2       GLN   6  -7.187   2.613   6.747
   27   2HB   GLN   6          HB1       GLN   6  -6.682   2.795   5.075
   28   1HG   GLN   6          HG2       GLN   6  -4.366   2.463   5.759
   29   2HG   GLN   6          HG1       GLN   6  -4.897   2.261   7.426
   30   1HE2  GLN   6          HE21      GLN   6  -4.147   0.233   7.575
   31   2HE2  GLN   6          HE22      GLN   6  -4.815  -1.123   6.739
   32    H    ARG   7           HN       ARG   7  -3.818   4.965   6.880
   33    HA   ARG   7           HA       ARG   7  -3.208   6.755   4.827
   34   1HB   ARG   7          HB2       ARG   7  -1.974   6.797   6.832
   35   2HB   ARG   7          HB1       ARG   7  -1.548   5.101   6.695
   36   1HG   ARG   7          HG2       ARG   7  -0.128   5.580   4.816
   37   2HG   ARG   7          HG1       ARG   7  -0.607   7.276   4.863
   38   1HD   ARG   7          HD2       ARG   7   1.604   6.770   5.980
   39   2HD   ARG   7          HD1       ARG   7   0.428   7.613   6.986
   40    HE   ARG   7           HE       ARG   7  -0.100   5.237   7.789
   41   1HH1  ARG   7          HH11      ARG   7   3.156   6.333   6.914
   42   2HH1  ARG   7          HH12      ARG   7   3.945   5.379   8.069
   43   1HH2  ARG   7          HH21      ARG   7   1.004   3.982   9.455
   44   2HH2  ARG   7          HH22      ARG   7   2.719   4.080   9.555
   45    H    ASP   8           HN       ASP   8  -2.779   6.453   2.772
   46    HA   ASP   8           HA       ASP   8  -2.652   3.925   1.531
   47   1HB   ASP   8          HB2       ASP   8  -1.893   6.635   0.519
   48   2HB   ASP   8          HB1       ASP   8  -1.456   5.201  -0.401
   49    H    LEU   9           HN       LEU   9  -1.086   2.736   0.747
   50    HA   LEU   9           HA       LEU   9   1.189   2.623   2.377
   51   1HB   LEU   9          HB2       LEU   9   0.515   1.080  -0.101
   52   2HB   LEU   9          HB1       LEU   9   1.790   0.677   1.035
   53    HG   LEU   9           HG       LEU   9  -1.156   0.748   1.649
   54   1HD1  LEU   9          HD11      LEU   9   0.769  -1.566   1.363
   55   2HD1  LEU   9          HD12      LEU   9  -0.516  -1.140   0.229
   56   3HD1  LEU   9          HD13      LEU   9  -0.917  -1.679   1.864
   57   1HD2  LEU   9          HD21      LEU   9  -0.507  -0.229   3.798
   58   2HD2  LEU   9          HD22      LEU   9   0.195   1.374   3.573
   59   3HD2  LEU   9          HD23      LEU   9   1.195  -0.065   3.360
   60    H    VAL  10           HN       VAL  10   0.678   4.092  -0.736
   61    HA   VAL  10           HA       VAL  10   3.502   4.303  -1.224
   62    HB   VAL  10           HB       VAL  10   1.201   5.877  -2.445
   63   1HG1  VAL  10          HG11      VAL  10   3.268   7.218  -2.490
   64   2HG1  VAL  10          HG12      VAL  10   2.826   6.674  -4.110
   65   3HG1  VAL  10          HG13      VAL  10   4.126   5.867  -3.231
   66   1HG2  VAL  10          HG21      VAL  10   1.255   3.529  -3.021
   67   2HG2  VAL  10          HG22      VAL  10   2.945   3.668  -3.508
   68   3HG2  VAL  10          HG23      VAL  10   1.692   4.519  -4.411
   69    H    LYS  11           HN       LYS  11   1.081   6.194   0.375
   70    HA   LYS  11           HA       LYS  11   2.961   8.313   0.976
   71   1HB   LYS  11          HB2       LYS  11   0.028   7.906   1.350
   72   2HB   LYS  11          HB1       LYS  11   0.834   9.082   2.384
   73   1HG   LYS  11          HG2       LYS  11  -0.162  10.199   0.484
   74   2HG   LYS  11          HG1       LYS  11   1.589  10.296   0.367
   75   1HD   LYS  11          HD2       LYS  11   0.801   9.846  -1.822
   76   2HD   LYS  11          HD1       LYS  11   1.458   8.329  -1.221
   77   1HE   LYS  11          HE2       LYS  11  -0.626   7.933  -2.401
   78   2HE   LYS  11          HE1       LYS  11  -0.827   7.574  -0.690
   79   1HZ   LYS  11          HZ1       LYS  11  -2.675   8.878  -1.776
   80   2HZ   LYS  11          HZ2       LYS  11  -1.613  10.184  -1.871
   81   3HZ   LYS  11          HZ3       LYS  11  -2.042   9.548  -0.368
   82    H    ALA  12           HN       ALA  12   3.362   5.641   1.847
   83    HA   ALA  12           HA       ALA  12   3.902   6.132   4.662
   84   1HB   ALA  12          HB1       ALA  12   2.656   3.582   3.607
   85   2HB   ALA  12          HB2       ALA  12   1.856   4.770   4.636
   86   3HB   ALA  12          HB3       ALA  12   3.220   3.840   5.259
   87    H    VAL  13           HN       VAL  13   4.222   3.543   2.200
   88    HA   VAL  13           HA       VAL  13   6.800   2.758   3.105
   89    HB   VAL  13           HB       VAL  13   5.252   2.013   0.609
   90   1HG1  VAL  13          HG11      VAL  13   7.682   0.699   1.816
   91   2HG1  VAL  13          HG12      VAL  13   7.614   1.615   0.308
   92   3HG1  VAL  13          HG13      VAL  13   6.743   0.085   0.447
   93   1HG2  VAL  13          HG21      VAL  13   5.545   0.587   3.249
   94   2HG2  VAL  13          HG22      VAL  13   4.714  -0.041   1.829
   95   3HG2  VAL  13          HG23      VAL  13   4.096   1.393   2.648
   96    H    ALA  14           HN       ALA  14   5.593   4.402   0.193
   97    HA   ALA  14           HA       ALA  14   8.204   4.805  -0.827
   98   1HB   ALA  14          HB1       ALA  14   6.267   4.825  -2.329
   99   2HB   ALA  14          HB2       ALA  14   7.119   6.369  -2.448
  100   3HB   ALA  14          HB3       ALA  14   5.624   6.239  -1.513
  101    H    HIS  15           HN       HIS  15   6.140   6.458   1.344
  102    HA   HIS  15           HA       HIS  15   7.513   8.930   1.441
  103   1HB   HIS  15          HB2       HIS  15   5.202   8.650   2.274
  104   2HB   HIS  15          HB1       HIS  15   5.790   7.609   3.561
  105    HD1  HIS  15           HD1      HIS  15   5.192   8.992   5.538
  106    HD2  HIS  15           HD2      HIS  15   7.318  11.155   2.710
  107    HE1  HIS  15           HE1      HIS  15   5.651  11.221   6.592
  108    HE2  HIS  15           HE2      HIS  15   7.325  12.221   5.044
  109    H    ILE  16           HN       ILE  16   8.152   5.813   2.824
  110    HA   ILE  16           HA       ILE  16  10.007   6.562   4.827
  111    HB   ILE  16           HB       ILE  16   9.688   3.991   3.230
  112   1HG1  ILE  16          HG12      ILE  16   7.872   4.479   4.793
  113   2HG1  ILE  16          HG11      ILE  16   8.769   3.049   5.282
  114   1HG2  ILE  16          HG21      ILE  16  11.142   2.837   4.833
  115   2HG2  ILE  16          HG22      ILE  16  11.568   4.385   5.554
  116   3HG2  ILE  16          HG23      ILE  16  12.020   4.038   3.880
  117   1HD1  ILE  16          HD11      ILE  16   8.198   4.435   7.197
  118   2HD1  ILE  16          HD12      ILE  16   9.049   5.800   6.476
  119   3HD1  ILE  16          HD13      ILE  16   9.947   4.366   6.971
  120    H    LEU  17           HN       LEU  17  10.272   5.988   1.386
  121    HA   LEU  17           HA       LEU  17  13.150   6.387   1.400
  122   1HB   LEU  17          HB2       LEU  17  11.244   6.062  -0.917
  123   2HB   LEU  17          HB1       LEU  17  12.989   6.111  -1.039
  124    HG   LEU  17           HG       LEU  17  11.349   3.969   0.302
  125   1HD1  LEU  17          HD11      LEU  17  11.267   3.886  -2.116
  126   2HD1  LEU  17          HD12      LEU  17  12.228   2.548  -1.482
  127   3HD1  LEU  17          HD13      LEU  17  13.027   3.950  -2.198
  128   1HD2  LEU  17          HD21      LEU  17  13.445   4.338   1.501
  129   2HD2  LEU  17          HD22      LEU  17  14.343   4.201  -0.012
  130   3HD2  LEU  17          HD23      LEU  17  13.475   2.805   0.628
  131    H    GLY  18           HN       GLY  18  10.273   8.127   0.835
  132   1HA   GLY  18          HA2       GLY  18  10.165  10.481   1.032
  133   2HA   GLY  18          HA1       GLY  18  11.833  10.564   0.463
  134    H    ILE  19           HN       ILE  19   9.013   8.855  -0.826
  135    HA   ILE  19           HA       ILE  19   9.103  10.541  -3.173
  136    HB   ILE  19           HB       ILE  19   8.460   8.235  -4.341
  137   1HG1  ILE  19          HG12      ILE  19  10.510   7.427  -2.270
  138   2HG1  ILE  19          HG11      ILE  19   8.865   6.833  -2.411
  139   1HG2  ILE  19          HG21      ILE  19  10.082   9.801  -5.224
  140   2HG2  ILE  19          HG22      ILE  19  10.750   8.180  -5.291
  141   3HG2  ILE  19          HG23      ILE  19  11.275   9.295  -4.026
  142   1HD1  ILE  19          HD11      ILE  19   9.428   5.775  -4.537
  143   2HD1  ILE  19          HD12      ILE  19  10.475   5.211  -3.233
  144   3HD1  ILE  19          HD13      ILE  19  11.076   6.385  -4.405
  145    H    ARG  20           HN       ARG  20   7.263  10.926  -4.119
  146    HA   ARG  20           HA       ARG  20   4.869   9.375  -3.539
  147   1HB   ARG  20          HB2       ARG  20   4.928  11.262  -1.863
  148   2HB   ARG  20          HB1       ARG  20   4.822  12.375  -3.227
  149   1HG   ARG  20          HG2       ARG  20   2.760  10.795  -3.827
  150   2HG   ARG  20          HG1       ARG  20   2.772  10.581  -2.076
  151   1HD   ARG  20          HD2       ARG  20   1.331  12.417  -2.492
  152   2HD   ARG  20          HD1       ARG  20   2.842  13.103  -1.883
  153    HE   ARG  20           HE       ARG  20   1.977  13.049  -4.683
  154   1HH1  ARG  20          HH11      ARG  20   4.007  14.520  -2.131
  155   2HH1  ARG  20          HH12      ARG  20   4.561  15.784  -3.119
  156   1HH2  ARG  20          HH21      ARG  20   2.687  14.890  -6.007
  157   2HH2  ARG  20          HH22      ARG  20   3.765  16.014  -5.353
  158    H    ASP  21           HN       ASP  21   6.472  12.010  -5.285
  159    HA   ASP  21           HA       ASP  21   4.485  11.956  -7.427
  160   1HB   ASP  21          HB2       ASP  21   5.807  13.645  -8.570
  161   2HB   ASP  21          HB1       ASP  21   5.662  14.121  -6.889
  162    H    LEU  22           HN       LEU  22   7.649  10.684  -6.851
  163    HA   LEU  22           HA       LEU  22   8.789   9.000  -7.862
  164   1HB   LEU  22          HB2       LEU  22   5.979   8.306  -8.605
  165   2HB   LEU  22          HB1       LEU  22   7.304   7.390  -9.283
  166    HG   LEU  22           HG       LEU  22   6.350   6.236  -7.417
  167   1HD1  LEU  22          HD11      LEU  22   8.688   5.952  -7.792
  168   2HD1  LEU  22          HD12      LEU  22   8.354   5.910  -6.056
  169   3HD1  LEU  22          HD13      LEU  22   9.056   7.351  -6.792
  170   1HD2  LEU  22          HD21      LEU  22   6.462   7.089  -5.137
  171   2HD2  LEU  22          HD22      LEU  22   5.445   8.107  -6.159
  172   3HD2  LEU  22          HD23      LEU  22   7.081   8.622  -5.743
  173    H    ALA  23           HN       ALA  23   8.219  11.584  -9.403
  174    HA   ALA  23           HA       ALA  23   8.218  10.648 -12.061
  175   1HB   ALA  23          HB1       ALA  23   8.706  13.432 -10.992
  176   2HB   ALA  23          HB2       ALA  23   7.170  12.781 -11.564
  177   3HB   ALA  23          HB3       ALA  23   8.499  13.025 -12.694
  178    H    GLY  24           HN       GLY  24  10.002   9.353 -12.171
  179   1HA   GLY  24          HA2       GLY  24  12.323   9.798 -13.203
  180   2HA   GLY  24          HA1       GLY  24  12.625  10.515 -11.615
  181    H    ILE  25           HN       ILE  25  10.701   8.408 -10.567
  182    HA   ILE  25           HA       ILE  25  12.777   6.370 -10.197
  183    HB   ILE  25           HB       ILE  25  10.368   6.944  -8.389
  184   1HG1  ILE  25          HG12      ILE  25  12.158   7.667  -6.695
  185   2HG1  ILE  25          HG11      ILE  25  13.267   7.755  -8.052
  186   1HG2  ILE  25          HG21      ILE  25  11.457   5.485  -6.749
  187   2HG2  ILE  25          HG22      ILE  25  12.725   5.123  -7.919
  188   3HG2  ILE  25          HG23      ILE  25  11.061   4.630  -8.241
  189   1HD1  ILE  25          HD11      ILE  25  12.419   9.946  -7.477
  190   2HD1  ILE  25          HD12      ILE  25  10.760   9.386  -7.672
  191   3HD1  ILE  25          HD13      ILE  25  11.827   9.479  -9.072
  192    H    ASN  26           HN       ASN  26  12.034   4.104 -10.199
  193    HA   ASN  26           HA       ASN  26  10.223   3.731 -12.388
  194   1HB   ASN  26          HB2       ASN  26  11.680   1.706 -10.690
  195   2HB   ASN  26          HB1       ASN  26  10.670   1.298 -12.063
  196   1HD2  ASN  26          HD21      ASN  26  13.661   2.552 -10.999
  197   2HD2  ASN  26          HD22      ASN  26  14.458   2.632 -12.530
  198    H    LEU  27           HN       LEU  27   8.229   3.055 -12.403
  199    HA   LEU  27           HA       LEU  27   6.917   2.399  -9.863
  200   1HB   LEU  27          HB2       LEU  27   5.818   3.359 -12.510
  201   2HB   LEU  27          HB1       LEU  27   4.834   2.940 -11.119
  202    HG   LEU  27           HG       LEU  27   6.855   5.173 -11.211
  203   1HD1  LEU  27          HD11      LEU  27   4.900   5.632 -12.596
  204   2HD1  LEU  27          HD12      LEU  27   4.905   6.640 -11.151
  205   3HD1  LEU  27          HD13      LEU  27   3.843   5.232 -11.245
  206   1HD2  LEU  27          HD21      LEU  27   5.907   5.798  -9.064
  207   2HD2  LEU  27          HD22      LEU  27   6.601   4.173  -8.999
  208   3HD2  LEU  27          HD23      LEU  27   4.853   4.392  -9.108
  209    H    ASP  28           HN       ASP  28   8.464   1.050 -12.212
  210    HA   ASP  28           HA       ASP  28   6.869  -1.377 -12.144
  211   1HB   ASP  28          HB2       ASP  28   6.638  -0.249 -14.393
  212   2HB   ASP  28          HB1       ASP  28   8.375  -0.454 -14.603
  213    H    SER  29           HN       SER  29   8.405  -1.320 -10.336
  214    HA   SER  29           HA       SER  29  10.517  -3.143 -10.941
  215   1HB   SER  29          HB2       SER  29  11.059  -0.531  -9.495
  216   2HB   SER  29          HB1       SER  29  12.160  -1.909  -9.527
  217    HG   SER  29           HG       SER  29  11.266  -1.237 -11.960
  218    H    SER  30           HN       SER  30  11.000  -4.397  -9.130
  219    HA   SER  30           HA       SER  30   8.866  -4.775  -7.358
  220   1HB   SER  30          HB2       SER  30  11.734  -5.710  -7.222
  221   2HB   SER  30          HB1       SER  30  10.432  -6.367  -6.242
  222    HG   SER  30           HG       SER  30  10.795  -6.490  -9.046
  223    H    LEU  31           HN       LEU  31   8.751  -4.302  -5.118
  224    HA   LEU  31           HA       LEU  31   9.712  -1.833  -4.254
  225   1HB   LEU  31          HB2       LEU  31   7.692  -3.206  -3.448
  226   2HB   LEU  31          HB1       LEU  31   8.819  -4.130  -2.486
  227    HG   LEU  31           HG       LEU  31   9.343  -2.098  -1.170
  228   1HD1  LEU  31          HD11      LEU  31   8.926  -0.458  -2.941
  229   2HD1  LEU  31          HD12      LEU  31   7.980  -0.102  -1.488
  230   3HD1  LEU  31          HD13      LEU  31   7.209  -0.859  -2.887
  231   1HD2  LEU  31          HD21      LEU  31   6.391  -2.653  -1.429
  232   2HD2  LEU  31          HD22      LEU  31   7.187  -1.886  -0.055
  233   3HD2  LEU  31          HD23      LEU  31   7.534  -3.569  -0.446
  234    H    ALA  32           HN       ALA  32  10.994  -5.000  -4.130
  235    HA   ALA  32           HA       ALA  32  12.990  -4.775  -2.195
  236   1HB   ALA  32          HB1       ALA  32  13.071  -6.385  -4.742
  237   2HB   ALA  32          HB2       ALA  32  12.359  -6.910  -3.218
  238   3HB   ALA  32          HB3       ALA  32  14.099  -6.631  -3.332
  239    H    ASP  33           HN       ASP  33  13.042  -4.136  -5.669
  240    HA   ASP  33           HA       ASP  33  15.756  -3.536  -5.945
  241   1HB   ASP  33          HB2       ASP  33  13.348  -2.765  -7.582
  242   2HB   ASP  33          HB1       ASP  33  14.961  -2.259  -8.044
  243    H    LEU  34           HN       LEU  34  13.061  -1.695  -4.960
  244    HA   LEU  34           HA       LEU  34  14.201   0.901  -5.179
  245   1HB   LEU  34          HB2       LEU  34  12.051   0.025  -3.273
  246   2HB   LEU  34          HB1       LEU  34  12.279   1.616  -3.983
  247    HG   LEU  34           HG       LEU  34  11.428  -0.863  -5.474
  248   1HD1  LEU  34          HD11      LEU  34   9.854   1.528  -4.616
  249   2HD1  LEU  34          HD12      LEU  34   9.763  -0.128  -3.994
  250   3HD1  LEU  34          HD13      LEU  34   9.282   0.212  -5.654
  251   1HD2  LEU  34          HD21      LEU  34  10.942   0.605  -7.306
  252   2HD2  LEU  34          HD22      LEU  34  12.664   0.661  -6.907
  253   3HD2  LEU  34          HD23      LEU  34  11.591   1.993  -6.428
  254    H    GLY  35           HN       GLY  35  13.581  -1.268  -2.418
  255   1HA   GLY  35          HA2       GLY  35  16.062  -1.220  -1.268
  256   2HA   GLY  35          HA1       GLY  35  15.270   0.221  -0.650
  257    H    LEU  36           HN       LEU  36  13.999  -3.046  -1.292
  258    HA   LEU  36           HA       LEU  36  13.343  -3.100   1.544
  259   1HB   LEU  36          HB2       LEU  36  11.260  -2.701   0.849
  260   2HB   LEU  36          HB1       LEU  36  11.384  -3.522  -0.673
  261    HG   LEU  36           HG       LEU  36  11.339  -5.706   0.647
  262   1HD1  LEU  36          HD11      LEU  36  10.506  -3.920   2.906
  263   2HD1  LEU  36          HD12      LEU  36  11.973  -4.893   2.817
  264   3HD1  LEU  36          HD13      LEU  36  10.397  -5.681   2.883
  265   1HD2  LEU  36          HD21      LEU  36   8.941  -5.687   0.973
  266   2HD2  LEU  36          HD22      LEU  36   9.399  -4.873  -0.528
  267   3HD2  LEU  36          HD23      LEU  36   8.939  -3.928   0.885
  268    H    ASP  37           HN       ASP  37  14.219  -4.537   2.565
  269    HA   ASP  37           HA       ASP  37  13.462  -7.233   1.895
  270   1HB   ASP  37          HB2       ASP  37  15.851  -7.125   1.180
  271   2HB   ASP  37          HB1       ASP  37  16.298  -6.605   2.803
  272    H    SER  38           HN       SER  38  13.772  -4.641   4.077
  273    HA   SER  38           HA       SER  38  13.114  -6.442   6.269
  274   1HB   SER  38          HB2       SER  38  14.853  -3.990   6.510
  275   2HB   SER  38          HB1       SER  38  14.429  -5.110   7.807
  276    HG   SER  38           HG       SER  38  16.035  -5.527   5.537
  277    H    LEU  39           HN       LEU  39  13.264  -2.853   6.398
  278    HA   LEU  39           HA       LEU  39  10.924  -2.833   7.995
  279   1HB   LEU  39          HB2       LEU  39  12.714  -1.202   8.290
  280   2HB   LEU  39          HB1       LEU  39  12.349  -0.509   6.721
  281    HG   LEU  39           HG       LEU  39  10.039  -0.021   7.602
  282   1HD1  LEU  39          HD11      LEU  39   9.993  -1.524   9.467
  283   2HD1  LEU  39          HD12      LEU  39   9.757   0.137  10.016
  284   3HD1  LEU  39          HD13      LEU  39  11.318  -0.656  10.242
  285   1HD2  LEU  39          HD21      LEU  39  12.377   1.355   8.913
  286   2HD2  LEU  39          HD22      LEU  39  10.724   1.982   8.788
  287   3HD2  LEU  39          HD23      LEU  39  11.676   1.711   7.324
  288    H    MET  40           HN       MET  40  11.448  -2.161   4.603
  289    HA   MET  40           HA       MET  40   8.953  -0.790   4.204
  290   1HB   MET  40          HB2       MET  40  10.969  -1.897   2.277
  291   2HB   MET  40          HB1       MET  40   9.506  -1.068   1.776
  292   1HG   MET  40          HG2       MET  40  10.205   0.944   2.911
  293   2HG   MET  40          HG1       MET  40  11.626   0.121   3.543
  294   1HE   MET  40          HE1       MET  40   9.816   1.360   0.264
  295   2HE   MET  40          HE2       MET  40  10.152  -0.337  -0.077
  296   3HE   MET  40          HE3       MET  40  11.003   0.927  -0.965
  297    H    GLY  41           HN       GLY  41   9.280  -3.785   5.008
  298   1HA   GLY  41          HA2       GLY  41   6.875  -4.569   3.491
  299   2HA   GLY  41          HA1       GLY  41   8.093  -5.732   4.018
  300    H    VAL  42           HN       VAL  42   8.599  -4.560   6.540
  301    HA   VAL  42           HA       VAL  42   6.567  -5.845   8.047
  302    HB   VAL  42           HB       VAL  42   8.833  -4.067   9.003
  303   1HG1  VAL  42          HG11      VAL  42   7.093  -6.005  10.523
  304   2HG1  VAL  42          HG12      VAL  42   7.059  -4.248  10.663
  305   3HG1  VAL  42          HG13      VAL  42   8.488  -5.147  11.177
  306   1HG2  VAL  42          HG21      VAL  42   9.632  -6.023   7.794
  307   2HG2  VAL  42          HG22      VAL  42   8.636  -7.071   8.808
  308   3HG2  VAL  42          HG23      VAL  42   9.978  -6.170   9.519
  309    H    GLU  43           HN       GLU  43   7.339  -2.356   7.550
  310    HA   GLU  43           HA       GLU  43   5.356  -1.565   9.375
  311   1HB   GLU  43          HB2       GLU  43   7.126  -0.003   8.702
  312   2HB   GLU  43          HB1       GLU  43   6.486   0.044   7.065
  313   1HG   GLU  43          HG2       GLU  43   4.493   1.124   7.785
  314   2HG   GLU  43          HG1       GLU  43   4.901   0.880   9.479
  315    H    VAL  44           HN       VAL  44   5.233  -2.460   6.059
  316    HA   VAL  44           HA       VAL  44   2.672  -1.520   5.284
  317    HB   VAL  44           HB       VAL  44   3.893  -4.153   4.455
  318   1HG1  VAL  44          HG11      VAL  44   1.655  -3.764   3.625
  319   2HG1  VAL  44          HG12      VAL  44   2.842  -3.714   2.314
  320   3HG1  VAL  44          HG13      VAL  44   2.168  -2.215   2.948
  321   1HG2  VAL  44          HG21      VAL  44   4.594  -1.422   3.418
  322   2HG2  VAL  44          HG22      VAL  44   5.092  -2.965   2.704
  323   3HG2  VAL  44          HG23      VAL  44   5.617  -2.535   4.333
  324    H    ARG  45           HN       ARG  45   3.790  -4.514   6.713
  325    HA   ARG  45           HA       ARG  45   1.345  -5.845   6.969
  326   1HB   ARG  45          HB2       ARG  45   3.724  -5.989   8.811
  327   2HB   ARG  45          HB1       ARG  45   2.463  -7.189   8.735
  328   1HG   ARG  45          HG2       ARG  45   3.131  -7.614   6.370
  329   2HG   ARG  45          HG1       ARG  45   4.494  -6.519   6.636
  330   1HD   ARG  45          HD2       ARG  45   3.910  -9.121   8.030
  331   2HD   ARG  45          HD1       ARG  45   5.286  -8.730   6.993
  332    HE   ARG  45           HE       ARG  45   5.056  -7.013   9.233
  333   1HH1  ARG  45          HH11      ARG  45   6.456 -10.098   8.137
  334   2HH1  ARG  45          HH12      ARG  45   7.484 -10.266   9.489
  335   1HH2  ARG  45          HH21      ARG  45   6.417  -7.367  11.154
  336   2HH2  ARG  45          HH22      ARG  45   7.462  -8.702  11.231
  337    H    GLN  46           HN       GLN  46   2.983  -3.570   9.110
  338    HA   GLN  46           HA       GLN  46   1.096  -3.852  11.221
  339   1HB   GLN  46          HB2       GLN  46   3.035  -1.564  10.771
  340   2HB   GLN  46          HB1       GLN  46   2.248  -1.980  12.284
  341   1HG   GLN  46          HG2       GLN  46   3.473  -4.108  12.323
  342   2HG   GLN  46          HG1       GLN  46   4.273  -3.656  10.821
  343   1HE2  GLN  46          HE21      GLN  46   3.579  -1.502  13.506
  344   2HE2  GLN  46          HE22      GLN  46   5.231  -1.190  13.908
  345    H    ILE  47           HN       ILE  47   0.701  -2.516   8.322
  346    HA   ILE  47           HA       ILE  47  -1.273  -0.575   9.256
  347    HB   ILE  47           HB       ILE  47  -0.049  -0.965   6.491
  348   1HG1  ILE  47          HG12      ILE  47   0.261   1.291   8.486
  349   2HG1  ILE  47          HG11      ILE  47   1.450   0.037   8.151
  350   1HG2  ILE  47          HG21      ILE  47  -1.244   1.072   5.837
  351   2HG2  ILE  47          HG22      ILE  47  -2.041   1.100   7.414
  352   3HG2  ILE  47          HG23      ILE  47  -2.358  -0.219   6.286
  353   1HD1  ILE  47          HD11      ILE  47   2.011   2.144   7.056
  354   2HD1  ILE  47          HD12      ILE  47   0.476   2.104   6.186
  355   3HD1  ILE  47          HD13      ILE  47   1.698   0.870   5.877
  356    H    LEU  48           HN       LEU  48  -0.869  -3.147   6.812
  357    HA   LEU  48           HA       LEU  48  -3.688  -3.377   6.422
  358   1HB   LEU  48          HB2       LEU  48  -1.450  -5.131   5.433
  359   2HB   LEU  48          HB1       LEU  48  -3.132  -5.427   5.060
  360    HG   LEU  48           HG       LEU  48  -2.192  -4.388   3.180
  361   1HD1  LEU  48          HD11      LEU  48  -3.419  -2.300   2.969
  362   2HD1  LEU  48          HD12      LEU  48  -3.685  -2.290   4.714
  363   3HD1  LEU  48          HD13      LEU  48  -4.389  -3.568   3.721
  364   1HD2  LEU  48          HD21      LEU  48  -1.118  -2.254   4.997
  365   2HD2  LEU  48          HD22      LEU  48  -1.026  -2.244   3.238
  366   3HD2  LEU  48          HD23      LEU  48  -0.183  -3.492   4.161
  367    H    GLU  49           HN       GLU  49  -1.341  -5.472   8.048
  368    HA   GLU  49           HA       GLU  49  -3.108  -7.547   8.748
  369   1HB   GLU  49          HB2       GLU  49  -0.729  -7.872   8.771
  370   2HB   GLU  49          HB1       GLU  49  -0.515  -6.581   9.937
  371   1HG   GLU  49          HG2       GLU  49  -1.827  -8.014  11.548
  372   2HG   GLU  49          HG1       GLU  49  -1.664  -9.313  10.365
  373    H    ARG  50           HN       ARG  50  -2.222  -4.592  10.152
  374    HA   ARG  50           HA       ARG  50  -3.201  -5.054  12.767
  375   1HB   ARG  50          HB2       ARG  50  -1.418  -3.435  11.862
  376   2HB   ARG  50          HB1       ARG  50  -2.774  -2.378  11.532
  377   1HG   ARG  50          HG2       ARG  50  -1.729  -1.816  13.617
  378   2HG   ARG  50          HG1       ARG  50  -3.365  -2.422  13.898
  379   1HD   ARG  50          HD2       ARG  50  -2.570  -4.517  14.628
  380   2HD   ARG  50          HD1       ARG  50  -0.947  -4.196  14.021
  381    HE   ARG  50           HE       ARG  50  -1.691  -2.287  15.924
  382   1HH1  ARG  50          HH11      ARG  50  -0.819  -5.706  15.700
  383   2HH1  ARG  50          HH12      ARG  50  -0.027  -5.786  17.205
  384   1HH2  ARG  50          HH21      ARG  50  -0.549  -2.312  17.927
  385   2HH2  ARG  50          HH22      ARG  50   0.169  -3.745  18.528
  386    H    GLU  51           HN       GLU  51  -4.358  -2.999  10.091
  387    HA   GLU  51           HA       GLU  51  -6.791  -2.400  11.547
  388   1HB   GLU  51          HB2       GLU  51  -5.750  -1.444   8.914
  389   2HB   GLU  51          HB1       GLU  51  -7.266  -0.916   9.626
  390   1HG   GLU  51          HG2       GLU  51  -4.573  -0.594  10.915
  391   2HG   GLU  51          HG1       GLU  51  -5.432   0.664  10.025
  392    H    HIS  52           HN       HIS  52  -5.930  -4.188   8.610
  393    HA   HIS  52           HA       HIS  52  -8.802  -4.726   8.318
  394   1HB   HIS  52          HB2       HIS  52  -6.679  -4.530   6.181
  395   2HB   HIS  52          HB1       HIS  52  -8.242  -5.289   5.911
  396    HD1  HIS  52           HD1      HIS  52  -9.775  -3.799   4.760
  397    HD2  HIS  52           HD2      HIS  52  -7.238  -1.681   7.262
  398    HE1  HIS  52           HE1      HIS  52 -10.381  -1.383   4.451
  399    HE2  HIS  52           HE2      HIS  52  -8.686  -0.122   5.788
  400    H    ASP  53           HN       ASP  53  -6.088  -6.154   9.400
  401    HA   ASP  53           HA       ASP  53  -5.515  -8.240   9.949
  402   1HB   ASP  53          HB2       ASP  53  -8.381  -8.771   9.232
  403   2HB   ASP  53          HB1       ASP  53  -7.307 -10.111   9.610
  404    H    LEU  54           HN       LEU  54  -5.260  -7.223   7.144
  405    HA   LEU  54           HA       LEU  54  -4.909  -9.735   5.717
  406   1HB   LEU  54          HB2       LEU  54  -4.520  -6.864   4.886
  407   2HB   LEU  54          HB1       LEU  54  -3.819  -8.160   3.951
  408    HG   LEU  54           HG       LEU  54  -6.120  -9.053   3.574
  409   1HD1  LEU  54          HD11      LEU  54  -8.029  -7.579   3.967
  410   2HD1  LEU  54          HD12      LEU  54  -6.960  -6.463   4.823
  411   3HD1  LEU  54          HD13      LEU  54  -7.255  -8.069   5.478
  412   1HD2  LEU  54          HD21      LEU  54  -6.736  -7.360   1.921
  413   2HD2  LEU  54          HD22      LEU  54  -5.009  -7.712   1.902
  414   3HD2  LEU  54          HD23      LEU  54  -5.602  -6.234   2.664
  415    H    VAL  55           HN       VAL  55  -3.278 -10.868   6.519
  416    HA   VAL  55           HA       VAL  55  -0.851  -9.544   7.301
  417    HB   VAL  55           HB       VAL  55  -1.441 -12.520   7.108
  418   1HG1  VAL  55          HG11      VAL  55   0.505 -12.798   8.595
  419   2HG1  VAL  55          HG12      VAL  55   0.813 -11.065   8.497
  420   3HG1  VAL  55          HG13      VAL  55   0.951 -12.068   7.054
  421   1HG2  VAL  55          HG21      VAL  55  -1.733 -12.441   9.554
  422   2HG2  VAL  55          HG22      VAL  55  -2.925 -11.449   8.715
  423   3HG2  VAL  55          HG23      VAL  55  -1.548 -10.688   9.508
  424    H    LEU  56           HN       LEU  56  -0.113  -8.637   5.485
  425    HA   LEU  56           HA       LEU  56   0.442 -10.307   3.152
  426   1HB   LEU  56          HB2       LEU  56   0.865  -7.371   3.575
  427   2HB   LEU  56          HB1       LEU  56   1.038  -8.210   2.054
  428    HG   LEU  56           HG       LEU  56  -1.567  -7.793   3.533
  429   1HD1  LEU  56          HD11      LEU  56  -0.706  -5.746   2.535
  430   2HD1  LEU  56          HD12      LEU  56  -2.126  -6.324   1.663
  431   3HD1  LEU  56          HD13      LEU  56  -0.513  -6.571   0.988
  432   1HD2  LEU  56          HD21      LEU  56  -2.620  -8.731   1.541
  433   2HD2  LEU  56          HD22      LEU  56  -1.533  -9.905   2.288
  434   3HD2  LEU  56          HD23      LEU  56  -1.033  -9.039   0.834
  435    HA   PRO  57           HA       PRO  57   4.467 -10.535   5.186
  436   1HB   PRO  57          HB2       PRO  57   4.871 -12.750   3.319
  437   2HB   PRO  57          HB1       PRO  57   4.856 -12.774   5.090
  438   1HG   PRO  57          HG2       PRO  57   2.850 -13.901   3.717
  439   2HG   PRO  57          HG1       PRO  57   2.529 -12.947   5.189
  440   1HD   PRO  57          HD2       PRO  57   2.381 -12.051   2.332
  441   2HD   PRO  57          HD1       PRO  57   1.137 -11.934   3.606
  442    H    ILE  58           HN       ILE  58   6.677 -10.535   4.386
  443    HA   ILE  58           HA       ILE  58   6.973  -8.596   2.375
  444    HB   ILE  58           HB       ILE  58   9.087 -10.263   3.814
  445   1HG1  ILE  58          HG12      ILE  58   9.686  -8.032   4.864
  446   2HG1  ILE  58          HG11      ILE  58   8.228  -7.377   4.143
  447   1HG2  ILE  58          HG21      ILE  58   9.568  -7.960   1.939
  448   2HG2  ILE  58          HG22      ILE  58   9.976  -9.655   1.662
  449   3HG2  ILE  58          HG23      ILE  58  10.790  -8.749   2.942
  450   1HD1  ILE  58          HD11      ILE  58   8.371  -9.572   6.197
  451   2HD1  ILE  58          HD12      ILE  58   6.890  -8.927   5.488
  452   3HD1  ILE  58          HD13      ILE  58   7.912  -7.896   6.489
  453    H    ARG  59           HN       ARG  59   6.976 -12.019   2.333
  454    HA   ARG  59           HA       ARG  59   8.373 -12.588  -0.034
  455   1HB   ARG  59          HB2       ARG  59   5.886 -14.006   0.972
  456   2HB   ARG  59          HB1       ARG  59   6.866 -14.575  -0.360
  457   1HG   ARG  59          HG2       ARG  59   7.514 -15.876   1.447
  458   2HG   ARG  59          HG1       ARG  59   8.788 -14.664   1.328
  459   1HD   ARG  59          HD2       ARG  59   7.654 -13.380   3.102
  460   2HD   ARG  59          HD1       ARG  59   6.455 -14.659   3.233
  461    HE   ARG  59           HE       ARG  59   9.227 -15.428   3.560
  462   1HH1  ARG  59          HH11      ARG  59   6.072 -14.928   5.045
  463   2HH1  ARG  59          HH12      ARG  59   6.567 -15.269   6.642
  464   1HH2  ARG  59          HH21      ARG  59   9.943 -16.023   5.752
  465   2HH2  ARG  59          HH22      ARG  59   8.838 -15.886   7.037
  466    H    GLU  60           HN       GLU  60   5.184 -11.240   0.374
  467    HA   GLU  60           HA       GLU  60   4.748 -11.258  -2.540
  468   1HB   GLU  60          HB2       GLU  60   2.832 -10.796  -0.249
  469   2HB   GLU  60          HB1       GLU  60   2.398 -10.764  -1.957
  470   1HG   GLU  60          HG2       GLU  60   2.928 -13.083  -2.198
  471   2HG   GLU  60          HG1       GLU  60   3.574 -13.150  -0.560
  472    H    VAL  61           HN       VAL  61   4.988  -9.152   0.265
  473    HA   VAL  61           HA       VAL  61   4.233  -6.786  -1.081
  474    HB   VAL  61           HB       VAL  61   5.857  -7.131   1.466
  475   1HG1  VAL  61          HG11      VAL  61   6.267  -4.920   0.511
  476   2HG1  VAL  61          HG12      VAL  61   5.295  -4.803   1.980
  477   3HG1  VAL  61          HG13      VAL  61   4.532  -4.636   0.398
  478   1HG2  VAL  61          HG21      VAL  61   3.611  -8.040   1.610
  479   2HG2  VAL  61          HG22      VAL  61   2.939  -6.516   1.030
  480   3HG2  VAL  61          HG23      VAL  61   3.755  -6.583   2.594
  481    H    ARG  62           HN       ARG  62   7.253  -8.464  -0.868
  482    HA   ARG  62           HA       ARG  62   8.924  -6.263  -1.427
  483   1HB   ARG  62          HB2       ARG  62   9.553  -8.493  -0.343
  484   2HB   ARG  62          HB1       ARG  62   9.655  -9.135  -1.972
  485   1HG   ARG  62          HG2       ARG  62  11.417  -7.650  -2.523
  486   2HG   ARG  62          HG1       ARG  62  11.221  -6.763  -1.014
  487   1HD   ARG  62          HD2       ARG  62  13.145  -8.209  -0.839
  488   2HD   ARG  62          HD1       ARG  62  11.875  -8.818   0.214
  489    HE   ARG  62           HE       ARG  62  11.933 -10.016  -2.401
  490   1HH1  ARG  62          HH11      ARG  62  13.438 -10.155   0.831
  491   2HH1  ARG  62          HH12      ARG  62  13.748 -11.807   0.777
  492   1HH2  ARG  62          HH21      ARG  62  12.412 -12.359  -2.474
  493   2HH2  ARG  62          HH22      ARG  62  13.110 -13.102  -1.103
  494    H    GLN  63           HN       GLN  63   6.784  -7.790  -3.508
  495    HA   GLN  63           HA       GLN  63   8.385  -6.879  -5.788
  496   1HB   GLN  63          HB2       GLN  63   7.156  -8.424  -7.295
  497   2HB   GLN  63          HB1       GLN  63   8.062  -9.273  -6.059
  498   1HG   GLN  63          HG2       GLN  63   5.208  -8.717  -5.517
  499   2HG   GLN  63          HG1       GLN  63   5.582  -9.889  -6.778
  500   1HE2  GLN  63          HE21      GLN  63   7.693  -9.488  -4.082
  501   2HE2  GLN  63          HE22      GLN  63   7.263 -10.970  -3.277
  502    H    LEU  64           HN       LEU  64   6.154  -5.703  -3.928
  503    HA   LEU  64           HA       LEU  64   4.211  -4.924  -5.868
  504   1HB   LEU  64          HB2       LEU  64   4.823  -3.652  -3.190
  505   2HB   LEU  64          HB1       LEU  64   3.396  -3.358  -4.160
  506    HG   LEU  64           HG       LEU  64   4.128  -5.892  -2.722
  507   1HD1  LEU  64          HD11      LEU  64   2.079  -5.459  -1.446
  508   2HD1  LEU  64          HD12      LEU  64   1.876  -3.941  -2.323
  509   3HD1  LEU  64          HD13      LEU  64   3.271  -4.169  -1.269
  510   1HD2  LEU  64          HD21      LEU  64   1.960  -6.781  -3.480
  511   2HD2  LEU  64          HD22      LEU  64   3.053  -6.475  -4.829
  512   3HD2  LEU  64          HD23      LEU  64   1.737  -5.348  -4.486
  513    H    THR  65           HN       THR  65   4.384  -3.315  -7.319
  514    HA   THR  65           HA       THR  65   6.943  -2.154  -7.705
  515    HB   THR  65           HB       THR  65   5.789  -1.460  -9.843
  516    HG1  THR  65           HG1      THR  65   3.653  -1.513  -9.506
  517   1HG2  THR  65          HG21      THR  65   5.615  -4.322  -8.980
  518   2HG2  THR  65          HG22      THR  65   7.113  -3.541  -9.438
  519   3HG2  THR  65          HG23      THR  65   5.818  -3.769 -10.652
  520    H    LEU  66           HN       LEU  66   6.112  -0.954  -5.516
  521    HA   LEU  66           HA       LEU  66   5.928   1.017  -4.462
  522   1HB   LEU  66          HB2       LEU  66   7.624   1.636  -6.324
  523   2HB   LEU  66          HB1       LEU  66   6.291   2.454  -7.097
  524    HG   LEU  66           HG       LEU  66   7.726   4.025  -5.893
  525   1HD1  LEU  66          HD11      LEU  66   5.071   3.725  -4.539
  526   2HD1  LEU  66          HD12      LEU  66   5.376   4.590  -6.048
  527   3HD1  LEU  66          HD13      LEU  66   6.072   5.178  -4.525
  528   1HD2  LEU  66          HD21      LEU  66   6.993   2.462  -3.426
  529   2HD2  LEU  66          HD22      LEU  66   7.895   3.980  -3.455
  530   3HD2  LEU  66          HD23      LEU  66   8.581   2.530  -4.188
  531    H    ARG  67           HN       ARG  67   4.311   1.777  -7.567
  532    HA   ARG  67           HA       ARG  67   2.216   3.105  -6.145
  533   1HB   ARG  67          HB2       ARG  67   2.533   2.405  -9.038
  534   2HB   ARG  67          HB1       ARG  67   0.998   3.005  -8.426
  535   1HG   ARG  67          HG2       ARG  67   3.650   4.431  -8.339
  536   2HG   ARG  67          HG1       ARG  67   2.283   4.806  -9.390
  537   1HD   ARG  67          HD2       ARG  67   0.947   5.126  -7.227
  538   2HD   ARG  67          HD1       ARG  67   2.503   5.130  -6.411
  539    HE   ARG  67           HE       ARG  67   2.501   6.972  -8.570
  540   1HH1  ARG  67          HH11      ARG  67   1.282   6.665  -5.271
  541   2HH1  ARG  67          HH12      ARG  67   1.165   8.356  -5.059
  542   1HH2  ARG  67          HH21      ARG  67   2.310   9.231  -8.256
  543   2HH2  ARG  67          HH22      ARG  67   1.809   9.821  -6.742
  544    H    LYS  68           HN       LYS  68   2.714  -0.091  -7.248
  545    HA   LYS  68           HA       LYS  68   0.082  -1.044  -7.044
  546   1HB   LYS  68          HB2       LYS  68   2.010  -2.334  -8.006
  547   2HB   LYS  68          HB1       LYS  68   2.586  -2.592  -6.364
  548   1HG   LYS  68          HG2       LYS  68   0.583  -3.846  -5.819
  549   2HG   LYS  68          HG1       LYS  68  -0.060  -3.551  -7.435
  550   1HD   LYS  68          HD2       LYS  68   2.496  -5.051  -6.828
  551   2HD   LYS  68          HD1       LYS  68   0.941  -5.805  -7.165
  552   1HE   LYS  68          HE2       LYS  68   2.474  -4.012  -9.053
  553   2HE   LYS  68          HE1       LYS  68   2.417  -5.768  -9.127
  554   1HZ   LYS  68          HZ1       LYS  68   0.108  -3.919  -9.523
  555   2HZ   LYS  68          HZ2       LYS  68  -0.008  -5.595  -9.475
  556   3HZ   LYS  68          HZ3       LYS  68   0.892  -4.843 -10.689
  557    H    LEU  69           HN       LEU  69   2.349  -0.119  -4.631
  558    HA   LEU  69           HA       LEU  69   1.257  -1.354  -2.358
  559   1HB   LEU  69          HB2       LEU  69   2.686   1.264  -2.710
  560   2HB   LEU  69          HB1       LEU  69   1.942   0.897  -1.175
  561    HG   LEU  69           HG       LEU  69   4.310   0.450  -1.106
  562   1HD1  LEU  69          HD11      LEU  69   2.710  -2.085  -1.060
  563   2HD1  LEU  69          HD12      LEU  69   2.902  -0.930   0.260
  564   3HD1  LEU  69          HD13      LEU  69   4.292  -1.849  -0.317
  565   1HD2  LEU  69          HD21      LEU  69   5.341  -1.320  -2.439
  566   2HD2  LEU  69          HD22      LEU  69   4.715  -0.023  -3.460
  567   3HD2  LEU  69          HD23      LEU  69   3.828  -1.539  -3.314
  568    H    GLN  70           HN       GLN  70   0.161   1.540  -4.080
  569    HA   GLN  70           HA       GLN  70  -1.965   1.768  -2.144
  570   1HB   GLN  70          HB2       GLN  70  -2.631   3.889  -3.258
  571   2HB   GLN  70          HB1       GLN  70  -1.007   3.894  -2.610
  572   1HG   GLN  70          HG2       GLN  70  -0.106   3.597  -4.833
  573   2HG   GLN  70          HG1       GLN  70  -1.751   3.597  -5.518
  574   1HE2  GLN  70          HE21      GLN  70  -1.238   5.468  -6.770
  575   2HE2  GLN  70          HE22      GLN  70  -1.145   7.005  -6.002
  576    H    GLU  71           HN       GLU  71  -1.545  -0.110  -4.559
  577    HA   GLU  71           HA       GLU  71  -4.301  -0.076  -5.548
  578   1HB   GLU  71          HB2       GLU  71  -2.316  -0.549  -7.074
  579   2HB   GLU  71          HB1       GLU  71  -2.018  -1.996  -6.134
  580   1HG   GLU  71          HG2       GLU  71  -3.124  -2.652  -8.114
  581   2HG   GLU  71          HG1       GLU  71  -4.293  -2.793  -6.806
  582    H    MET  72           HN       MET  72  -2.131  -1.479  -3.315
  583    HA   MET  72           HA       MET  72  -4.034  -3.548  -2.451
  584   1HB   MET  72          HB2       MET  72  -1.082  -3.210  -1.873
  585   2HB   MET  72          HB1       MET  72  -2.095  -4.493  -1.238
  586   1HG   MET  72          HG2       MET  72  -1.445  -4.037  -4.146
  587   2HG   MET  72          HG1       MET  72  -0.694  -5.224  -3.091
  588   1HE   MET  72          HE1       MET  72  -1.954  -7.323  -2.052
  589   2HE   MET  72          HE2       MET  72  -3.671  -7.649  -2.294
  590   3HE   MET  72          HE3       MET  72  -3.164  -6.246  -1.354
  591    H    SER  73           HN       SER  73  -3.672  -0.446  -1.861
  592    HA   SER  73           HA       SER  73  -2.843  -0.440   0.841
  593   1HB   SER  73          HB2       SER  73  -3.305   1.995   0.743
  594   2HB   SER  73          HB1       SER  73  -2.246   1.400  -0.529
  595    HG   SER  73           HG       SER  73  -4.110   2.880  -1.059
  596    H    SER  74           HN       SER  74  -5.640  -1.457  -0.435
  597    HA   SER  74           HA       SER  74  -7.761  -1.801   0.250
  598   1HB   SER  74          HB2       SER  74  -6.690  -0.975   2.968
  599   2HB   SER  74          HB1       SER  74  -8.153  -1.918   2.664
  600    HG   SER  74           HG       SER  74  -5.512  -2.660   1.982
  601    H    LYS  75           HN       LYS  75  -7.205   0.599  -0.915
  602    HA   LYS  75           HA       LYS  75  -8.566   2.619   0.700
  603   1HB   LYS  75          HB2       LYS  75  -6.318   3.066  -0.363
  604   2HB   LYS  75          HB1       LYS  75  -7.131   3.004  -1.918
  605   1HG   LYS  75          HG2       LYS  75  -6.849   5.281  -1.240
  606   2HG   LYS  75          HG1       LYS  75  -8.561   4.869  -1.226
  607   1HD   LYS  75          HD2       LYS  75  -8.039   6.209   0.722
  608   2HD   LYS  75          HD1       LYS  75  -8.442   4.574   1.225
  609   1HE   LYS  75          HE2       LYS  75  -5.564   5.467   0.877
  610   2HE   LYS  75          HE1       LYS  75  -6.419   5.712   2.385
  611   1HZ   LYS  75          HZ1       LYS  75  -6.743   3.263   2.436
  612   2HZ   LYS  75          HZ2       LYS  75  -5.180   3.820   2.564
  613   3HZ   LYS  75          HZ3       LYS  75  -5.686   3.138   1.095
  614    H    ALA  76           HN       ALA  76 -10.676   2.455   0.471
  615    HA   ALA  76           HA       ALA  76 -12.700   2.671  -0.352
  616   1HB   ALA  76          HB1       ALA  76 -11.490   3.097  -3.099
  617   2HB   ALA  76          HB2       ALA  76 -11.850   4.375  -1.940
  618   3HB   ALA  76          HB3       ALA  76 -13.162   3.417  -2.631
  619    H    GLY  77           HN       GLY  77 -12.690   0.523   0.357
  620   1HA   GLY  77          HA2       GLY  77 -13.617  -1.239  -1.713
  621   2HA   GLY  77          HA1       GLY  77 -12.174  -1.770  -0.851
  622    H    SER  78           HN       SER  78 -14.597  -3.139  -0.785
  623    HA   SER  78           HA       SER  78 -15.340  -2.681   1.983
  624   1HB   SER  78          HB2       SER  78 -17.021  -3.840  -0.238
  625   2HB   SER  78          HB1       SER  78 -17.534  -3.612   1.436
  626    HG   SER  78           HG       SER  78 -16.568  -1.328   0.742
  627    H    ASP  79           HN       ASP  79 -13.702  -3.886   2.684
  628    HA   ASP  79           HA       ASP  79 -13.777  -6.789   2.168
  629   1HB   ASP  79          HB2       ASP  79 -11.419  -6.875   2.746
  630   2HB   ASP  79          HB1       ASP  79 -11.665  -5.695   1.465
  631    H    THR  80           HN       THR  80 -13.507  -4.275   4.619
  632    HA   THR  80           HA       THR  80 -14.186  -6.312   6.596
  633    HB   THR  80           HB       THR  80 -11.869  -5.445   6.910
  634    HG1  THR  80           HG1      THR  80 -13.509  -4.536   9.080
  635   1HG2  THR  80          HG21      THR  80 -11.511  -3.142   7.706
  636   2HG2  THR  80          HG22      THR  80 -13.214  -2.787   7.421
  637   3HG2  THR  80          HG23      THR  80 -12.156  -3.175   6.065
  638    H    GLU  81           HN       GLU  81 -15.054  -3.320   5.081
  639    HA   GLU  81           HA       GLU  81 -17.470  -3.380   6.605
  640   1HB   GLU  81          HB2       GLU  81 -17.444  -0.973   7.066
  641   2HB   GLU  81          HB1       GLU  81 -16.119  -1.792   7.870
  642   1HG   GLU  81          HG2       GLU  81 -14.563  -0.961   6.212
  643   2HG   GLU  81          HG1       GLU  81 -15.888  -0.209   5.321
  644    H    LEU  82           HN       LEU  82 -19.205  -2.613   5.461
  645    HA   LEU  82           HA       LEU  82 -18.673  -2.305   2.612
  646   1HB   LEU  82          HB2       LEU  82 -20.217  -4.106   3.259
  647   2HB   LEU  82          HB1       LEU  82 -21.246  -2.947   4.070
  648    HG   LEU  82           HG       LEU  82 -21.733  -1.889   1.878
  649   1HD1  LEU  82          HD11      LEU  82 -21.154  -3.068  -0.180
  650   2HD1  LEU  82          HD12      LEU  82 -20.186  -4.211   0.751
  651   3HD1  LEU  82          HD13      LEU  82 -19.718  -2.513   0.681
  652   1HD2  LEU  82          HD21      LEU  82 -23.187  -3.670   1.049
  653   2HD2  LEU  82          HD22      LEU  82 -23.242  -3.557   2.809
  654   3HD2  LEU  82          HD23      LEU  82 -22.314  -4.843   2.033
  655    H    ALA  83           HN       ALA  83 -17.991  -0.180   2.795
  656    HA   ALA  83           HA       ALA  83 -20.169   1.743   3.165
  657   1HB   ALA  83          HB1       ALA  83 -18.434   2.031   4.884
  658   2HB   ALA  83          HB2       ALA  83 -18.463   3.407   3.780
  659   3HB   ALA  83          HB3       ALA  83 -17.210   2.180   3.620
  660    H    ALA  84           HN       ALA  84 -20.825   1.705   1.083
  661    HA   ALA  84           HA       ALA  84 -19.132   3.108  -0.794
  662   1HB   ALA  84          HB1       ALA  84 -20.209   0.366  -1.437
  663   2HB   ALA  84          HB2       ALA  84 -18.512   0.774  -1.168
  664   3HB   ALA  84          HB3       ALA  84 -19.371   1.444  -2.555
  665    HA   PRO  85           HA       PRO  85 -23.377   4.428  -1.582
  666   1HB   PRO  85          HB2       PRO  85 -22.176   6.770  -2.818
  667   2HB   PRO  85          HB1       PRO  85 -23.136   6.691  -1.337
  668   1HG   PRO  85          HG2       PRO  85 -20.469   7.276  -1.373
  669   2HG   PRO  85          HG1       PRO  85 -21.288   6.514   0.003
  670   1HD   PRO  85          HD2       PRO  85 -19.620   5.258  -2.143
  671   2HD   PRO  85          HD1       PRO  85 -19.653   4.918  -0.398
  672    H    LYS  86           HN       LYS  86 -23.116   2.633  -3.040
  673    HA   LYS  86           HA       LYS  86 -22.248   3.172  -5.759
  674   1HB   LYS  86          HB2       LYS  86 -22.626   0.756  -6.071
  675   2HB   LYS  86          HB1       LYS  86 -21.551   1.104  -4.726
  676   1HG   LYS  86          HG2       LYS  86 -23.570   0.839  -3.220
  677   2HG   LYS  86          HG1       LYS  86 -24.415   0.197  -4.627
  678   1HD   LYS  86          HD2       LYS  86 -21.894  -0.911  -3.390
  679   2HD   LYS  86          HD1       LYS  86 -23.507  -1.609  -3.268
  680   1HE   LYS  86          HE2       LYS  86 -23.524  -1.965  -5.693
  681   2HE   LYS  86          HE1       LYS  86 -21.914  -1.256  -5.808
  682   1HZ   LYS  86          HZ1       LYS  86 -22.641  -3.719  -4.322
  683   2HZ   LYS  86          HZ2       LYS  86 -21.092  -3.067  -4.369
  684   3HZ   LYS  86          HZ3       LYS  86 -21.796  -3.662  -5.781
  685    H    SER  87           HN       SER  87 -24.976   3.592  -4.031
  686    HA   SER  87           HA       SER  87 -26.812   3.041  -6.221
  687   1HB   SER  87          HB2       SER  87 -27.366   3.959  -3.394
  688   2HB   SER  87          HB1       SER  87 -28.526   3.303  -4.552
  689    HG   SER  87           HG       SER  87 -27.454   1.326  -4.461
  690    H    LYS  88           HN       LYS  88 -26.685   4.736  -7.624
  691    HA   LYS  88           HA       LYS  88 -26.848   7.431  -6.471
  692   1HB   LYS  88          HB2       LYS  88 -25.452   6.574  -9.009
  693   2HB   LYS  88          HB1       LYS  88 -25.645   8.237  -8.477
  694   1HG   LYS  88          HG2       LYS  88 -24.293   7.775  -6.505
  695   2HG   LYS  88          HG1       LYS  88 -24.123   6.093  -7.008
  696   1HD   LYS  88          HD2       LYS  88 -23.014   6.854  -9.075
  697   2HD   LYS  88          HD1       LYS  88 -23.146   8.520  -8.505
  698   1HE   LYS  88          HE2       LYS  88 -21.764   7.998  -6.580
  699   2HE   LYS  88          HE1       LYS  88 -21.684   6.309  -7.075
  700   1HZ   LYS  88          HZ1       LYS  88 -20.558   8.615  -8.597
  701   2HZ   LYS  88          HZ2       LYS  88 -20.572   7.028  -9.113
  702   3HZ   LYS  88          HZ3       LYS  88 -19.669   7.437  -7.756
  703    H    ASN  89           HN       ASN  89 -27.524   5.536  -9.404
  704    HA   ASN  89           HA       ASN  89 -29.986   7.106  -9.712
  705   1HB   ASN  89          HB2       ASN  89 -28.139   6.282 -11.983
  706   2HB   ASN  89          HB1       ASN  89 -29.690   7.078 -12.165
  707   1HD2  ASN  89          HD21      ASN  89 -29.154   8.930  -9.920
  708   2HD2  ASN  89          HD22      ASN  89 -27.985  10.054 -10.490
  Start of MODEL   11
    1   1H    GLY   1          HT1       GLY   1 -14.055  10.178  14.695
    2   2H    GLY   1          HT2       GLY   1 -12.983   9.446  15.768
    3   3H    GLY   1          HT3       GLY   1 -13.881   8.504  14.670
    4   1HA   GLY   1          HA1       GLY   1 -12.758   9.493  12.808
    5   2HA   GLY   1          HA2       GLY   1 -11.851  10.521  13.911
    6    H    ASP   2           HN       ASP   2 -12.664   7.015  13.922
    7    HA   ASP   2           HA       ASP   2 -10.012   6.228  13.442
    8   1HB   ASP   2          HB2       ASP   2  -9.509   5.221  15.594
    9   2HB   ASP   2          HB1       ASP   2  -9.796   6.938  15.833
   10    H    GLY   3           HN       GLY   3  -9.891   3.959  13.388
   11   1HA   GLY   3          HA2       GLY   3 -11.219   1.850  13.746
   12   2HA   GLY   3          HA1       GLY   3 -12.512   2.714  12.902
   13    H    GLU   4           HN       GLU   4 -12.421   3.002  10.781
   14    HA   GLU   4           HA       GLU   4 -10.070   1.922   9.420
   15   1HB   GLU   4          HB2       GLU   4 -12.174   0.632   9.039
   16   2HB   GLU   4          HB1       GLU   4 -12.894   2.080   8.349
   17   1HG   GLU   4          HG2       GLU   4 -12.126   0.615   6.598
   18   2HG   GLU   4          HG1       GLU   4 -11.168   2.094   6.613
   19    H    ALA   5           HN       ALA   5  -8.902   3.722   9.174
   20    HA   ALA   5           HA       ALA   5  -9.711   5.684   7.270
   21   1HB   ALA   5          HB1       ALA   5  -9.475   7.638   8.752
   22   2HB   ALA   5          HB2       ALA   5  -9.292   6.565  10.139
   23   3HB   ALA   5          HB3       ALA   5 -10.822   6.619   9.265
   24    H    GLN   6           HN       GLN   6  -7.906   6.008   6.168
   25    HA   GLN   6           HA       GLN   6  -5.337   6.149   7.570
   26   1HB   GLN   6          HB2       GLN   6  -5.895   4.318   5.242
   27   2HB   GLN   6          HB1       GLN   6  -4.290   4.744   5.797
   28   1HG   GLN   6          HG2       GLN   6  -4.735   3.678   7.930
   29   2HG   GLN   6          HG1       GLN   6  -6.368   3.270   7.390
   30   1HE2  GLN   6          HE21      GLN   6  -4.192   1.525   8.192
   31   2HE2  GLN   6          HE22      GLN   6  -3.883   0.497   6.854
   32    H    ARG   7           HN       ARG   7  -3.679   7.051   6.256
   33    HA   ARG   7           HA       ARG   7  -4.593   9.112   4.526
   34   1HB   ARG   7          HB2       ARG   7  -2.124   9.569   4.138
   35   2HB   ARG   7          HB1       ARG   7  -2.646   9.643   5.811
   36   1HG   ARG   7          HG2       ARG   7  -1.722   7.390   6.174
   37   2HG   ARG   7          HG1       ARG   7  -1.184   7.367   4.495
   38   1HD   ARG   7          HD2       ARG   7   0.331   9.170   4.882
   39   2HD   ARG   7          HD1       ARG   7  -0.326   9.456   6.494
   40    HE   ARG   7           HE       ARG   7   0.546   6.845   6.479
   41   1HH1  ARG   7          HH11      ARG   7   2.142   9.999   5.981
   42   2HH1  ARG   7          HH12      ARG   7   3.574   9.507   6.757
   43   1HH2  ARG   7          HH21      ARG   7   2.527   6.204   7.432
   44   2HH2  ARG   7          HH22      ARG   7   3.834   7.272   7.529
   45    H    ASP   8           HN       ASP   8  -2.462   6.308   3.871
   46    HA   ASP   8           HA       ASP   8  -3.680   5.096   1.813
   47   1HB   ASP   8          HB2       ASP   8  -3.483   7.298   0.546
   48   2HB   ASP   8          HB1       ASP   8  -1.735   7.122   0.712
   49    H    LEU   9           HN       LEU   9  -1.926   3.828   0.471
   50    HA   LEU   9           HA       LEU   9   0.095   3.116   2.402
   51   1HB   LEU   9          HB2       LEU   9  -0.620   1.774  -0.194
   52   2HB   LEU   9          HB1       LEU   9   0.535   1.176   0.971
   53    HG   LEU   9           HG       LEU   9  -2.444   1.316   1.210
   54   1HD1  LEU   9          HD11      LEU   9  -1.529  -0.618   0.096
   55   2HD1  LEU   9          HD12      LEU   9  -2.205  -1.063   1.665
   56   3HD1  LEU   9          HD13      LEU   9  -0.458  -0.923   1.466
   57   1HD2  LEU   9          HD21      LEU   9  -0.465   0.742   3.398
   58   2HD2  LEU   9          HD22      LEU   9  -2.214   0.529   3.503
   59   3HD2  LEU   9          HD23      LEU   9  -1.532   2.143   3.298
   60    H    VAL  10           HN       VAL  10  -0.135   4.604  -0.802
   61    HA   VAL  10           HA       VAL  10   2.727   4.454  -1.172
   62    HB   VAL  10           HB       VAL  10   0.552   5.885  -2.738
   63   1HG1  VAL  10          HG11      VAL  10   2.617   7.253  -2.823
   64   2HG1  VAL  10          HG12      VAL  10   2.277   6.493  -4.378
   65   3HG1  VAL  10          HG13      VAL  10   3.526   5.827  -3.325
   66   1HG2  VAL  10          HG21      VAL  10   1.252   4.333  -4.470
   67   2HG2  VAL  10          HG22      VAL  10   0.668   3.525  -3.007
   68   3HG2  VAL  10          HG23      VAL  10   2.401   3.611  -3.342
   69    H    LYS  11           HN       LYS  11   0.384   6.679  -0.040
   70    HA   LYS  11           HA       LYS  11   2.258   8.799   0.256
   71   1HB   LYS  11          HB2       LYS  11  -0.538   8.448   1.370
   72   2HB   LYS  11          HB1       LYS  11   0.446   9.859   1.712
   73   1HG   LYS  11          HG2       LYS  11  -1.081  10.437  -0.054
   74   2HG   LYS  11          HG1       LYS  11   0.524  10.322  -0.756
   75   1HD   LYS  11          HD2       LYS  11  -0.044   8.059  -1.604
   76   2HD   LYS  11          HD1       LYS  11  -1.655   8.229  -0.913
   77   1HE   LYS  11          HE2       LYS  11  -2.049  10.173  -2.353
   78   2HE   LYS  11          HE1       LYS  11  -0.464   9.931  -3.082
   79   1HZ   LYS  11          HZ1       LYS  11  -2.799   8.091  -3.214
   80   2HZ   LYS  11          HZ2       LYS  11  -1.276   7.649  -3.738
   81   3HZ   LYS  11          HZ3       LYS  11  -2.079   8.899  -4.499
   82    H    ALA  12           HN       ALA  12   2.182   5.986   1.722
   83    HA   ALA  12           HA       ALA  12   3.370   6.965   4.221
   84   1HB   ALA  12          HB1       ALA  12   2.085   4.284   3.649
   85   2HB   ALA  12          HB2       ALA  12   1.375   5.587   4.606
   86   3HB   ALA  12          HB3       ALA  12   2.825   4.765   5.177
   87    H    VAL  13           HN       VAL  13   3.489   4.135   2.023
   88    HA   VAL  13           HA       VAL  13   6.086   3.328   2.725
   89    HB   VAL  13           HB       VAL  13   4.409   2.641   0.293
   90   1HG1  VAL  13          HG11      VAL  13   6.753   2.253  -0.218
   91   2HG1  VAL  13          HG12      VAL  13   5.901   0.717  -0.028
   92   3HG1  VAL  13          HG13      VAL  13   6.948   1.314   1.264
   93   1HG2  VAL  13          HG21      VAL  13   3.432   1.947   2.406
   94   2HG2  VAL  13          HG22      VAL  13   4.936   1.151   2.867
   95   3HG2  VAL  13          HG23      VAL  13   3.995   0.540   1.505
   96    H    ALA  14           HN       ALA  14   4.948   5.207  -0.102
   97    HA   ALA  14           HA       ALA  14   7.562   5.360  -1.196
   98   1HB   ALA  14          HB1       ALA  14   6.665   7.080  -2.736
   99   2HB   ALA  14          HB2       ALA  14   5.191   7.185  -1.760
  100   3HB   ALA  14          HB3       ALA  14   5.556   5.708  -2.626
  101    H    HIS  15           HN       HIS  15   5.724   7.218   1.069
  102    HA   HIS  15           HA       HIS  15   7.425   9.471   1.172
  103   1HB   HIS  15          HB2       HIS  15   5.119   9.438   2.145
  104   2HB   HIS  15          HB1       HIS  15   5.701   8.373   3.417
  105    HD1  HIS  15           HD1      HIS  15   6.503   9.519   5.494
  106    HD2  HIS  15           HD2      HIS  15   6.491  12.062   2.204
  107    HE1  HIS  15           HE1      HIS  15   7.097  11.774   6.380
  108    HE2  HIS  15           HE2      HIS  15   7.081  13.309   4.394
  109    H    ILE  16           HN       ILE  16   7.473   6.378   2.815
  110    HA   ILE  16           HA       ILE  16   9.644   6.748   4.546
  111    HB   ILE  16           HB       ILE  16   8.622   4.310   3.083
  112   1HG1  ILE  16          HG12      ILE  16   7.118   5.191   4.781
  113   2HG1  ILE  16          HG11      ILE  16   7.753   3.630   5.279
  114   1HG2  ILE  16          HG21      ILE  16  10.788   4.308   5.168
  115   2HG2  ILE  16          HG22      ILE  16  10.952   3.867   3.467
  116   3HG2  ILE  16          HG23      ILE  16   9.967   2.877   4.544
  117   1HD1  ILE  16          HD11      ILE  16   9.335   4.760   6.764
  118   2HD1  ILE  16          HD12      ILE  16   7.665   5.184   7.139
  119   3HD1  ILE  16          HD13      ILE  16   8.688   6.320   6.257
  120    H    LEU  17           HN       LEU  17   9.512   5.843   1.155
  121    HA   LEU  17           HA       LEU  17  12.337   5.440   0.883
  122   1HB   LEU  17          HB2       LEU  17  10.241   5.813  -1.250
  123   2HB   LEU  17          HB1       LEU  17  11.875   5.245  -1.514
  124    HG   LEU  17           HG       LEU  17   9.731   3.815   0.039
  125   1HD1  LEU  17          HD11      LEU  17   9.819   2.191  -1.790
  126   2HD1  LEU  17          HD12      LEU  17  10.972   3.217  -2.640
  127   3HD1  LEU  17          HD13      LEU  17   9.330   3.788  -2.354
  128   1HD2  LEU  17          HD21      LEU  17  11.328   1.957   0.139
  129   2HD2  LEU  17          HD22      LEU  17  11.940   3.386   0.972
  130   3HD2  LEU  17          HD23      LEU  17  12.549   2.972  -0.631
  131    H    GLY  18           HN       GLY  18  10.347   8.174   0.875
  132   1HA   GLY  18          HA2       GLY  18  11.241  10.388   0.925
  133   2HA   GLY  18          HA1       GLY  18  12.624   9.814  -0.002
  134    H    ILE  19           HN       ILE  19   9.508   8.805  -0.969
  135    HA   ILE  19           HA       ILE  19   9.465  10.786  -3.087
  136    HB   ILE  19           HB       ILE  19   8.356   8.852  -4.407
  137   1HG1  ILE  19          HG12      ILE  19  10.156   7.279  -2.556
  138   2HG1  ILE  19          HG11      ILE  19   8.407   7.174  -2.657
  139   1HG2  ILE  19          HG21      ILE  19  11.342   9.073  -4.066
  140   2HG2  ILE  19          HG22      ILE  19  10.317  10.022  -5.156
  141   3HG2  ILE  19          HG23      ILE  19  10.536   8.292  -5.429
  142   1HD1  ILE  19          HD11      ILE  19   8.595   6.279  -4.926
  143   2HD1  ILE  19          HD12      ILE  19   9.467   5.290  -3.756
  144   3HD1  ILE  19          HD13      ILE  19  10.351   6.386  -4.817
  145    H    ARG  20           HN       ARG  20   7.357  10.654  -4.216
  146    HA   ARG  20           HA       ARG  20   5.030   9.606  -3.015
  147   1HB   ARG  20          HB2       ARG  20   5.438  11.487  -1.397
  148   2HB   ARG  20          HB1       ARG  20   5.315  12.615  -2.745
  149   1HG   ARG  20          HG2       ARG  20   3.022  11.526  -3.168
  150   2HG   ARG  20          HG1       ARG  20   3.206  10.874  -1.556
  151   1HD   ARG  20          HD2       ARG  20   3.388  13.820  -2.159
  152   2HD   ARG  20          HD1       ARG  20   1.940  13.018  -1.563
  153    HE   ARG  20           HE       ARG  20   3.435  12.366   0.395
  154   1HH1  ARG  20          HH11      ARG  20   3.998  15.350  -1.438
  155   2HH1  ARG  20          HH12      ARG  20   4.401  16.285  -0.072
  156   1HH2  ARG  20          HH21      ARG  20   4.038  13.642   2.299
  157   2HH2  ARG  20          HH22      ARG  20   4.503  15.254   2.102
  158    H    ASP  21           HN       ASP  21   6.631  11.923  -5.035
  159    HA   ASP  21           HA       ASP  21   4.421  12.554  -6.700
  160   1HB   ASP  21          HB2       ASP  21   7.334  12.773  -7.470
  161   2HB   ASP  21          HB1       ASP  21   5.985  13.699  -8.112
  162    H    LEU  22           HN       LEU  22   7.367  10.769  -7.490
  163    HA   LEU  22           HA       LEU  22   7.717   8.874  -8.703
  164   1HB   LEU  22          HB2       LEU  22   4.792   8.519  -8.140
  165   2HB   LEU  22          HB1       LEU  22   5.633   7.409  -9.193
  166    HG   LEU  22           HG       LEU  22   5.344   6.540  -6.990
  167   1HD1  LEU  22          HD11      LEU  22   7.301   5.838  -8.243
  168   2HD1  LEU  22          HD12      LEU  22   7.668   5.887  -6.518
  169   3HD1  LEU  22          HD13      LEU  22   8.225   7.181  -7.577
  170   1HD2  LEU  22          HD21      LEU  22   7.038   8.817  -6.009
  171   2HD2  LEU  22          HD22      LEU  22   6.555   7.417  -5.049
  172   3HD2  LEU  22          HD23      LEU  22   5.336   8.536  -5.653
  173    H    ALA  23           HN       ALA  23   6.931  11.464  -9.918
  174    HA   ALA  23           HA       ALA  23   5.536  10.737 -12.327
  175   1HB   ALA  23          HB1       ALA  23   6.960  13.306 -11.633
  176   2HB   ALA  23          HB2       ALA  23   5.244  12.981 -11.374
  177   3HB   ALA  23          HB3       ALA  23   5.890  13.062 -13.013
  178    H    GLY  24           HN       GLY  24   8.616  10.832 -11.185
  179   1HA   GLY  24          HA2       GLY  24   9.663   9.767 -13.675
  180   2HA   GLY  24          HA1       GLY  24  10.440  11.242 -13.084
  181    H    ILE  25           HN       ILE  25   9.208   8.319 -11.557
  182    HA   ILE  25           HA       ILE  25  11.855   7.864 -10.377
  183    HB   ILE  25           HB       ILE  25   9.174   7.451  -8.981
  184   1HG1  ILE  25          HG12      ILE  25   9.742   9.869  -9.173
  185   2HG1  ILE  25          HG11      ILE  25   9.674   9.307  -7.510
  186   1HG2  ILE  25          HG21      ILE  25  10.489   7.014  -6.942
  187   2HG2  ILE  25          HG22      ILE  25  11.974   7.161  -7.884
  188   3HG2  ILE  25          HG23      ILE  25  10.841   5.853  -8.224
  189   1HD1  ILE  25          HD11      ILE  25  12.179   9.780  -9.117
  190   2HD1  ILE  25          HD12      ILE  25  12.088   9.233  -7.433
  191   3HD1  ILE  25          HD13      ILE  25  11.508  10.838  -7.865
  192    H    ASN  26           HN       ASN  26  12.142   5.554  -9.933
  193    HA   ASN  26           HA       ASN  26  11.200   3.852 -11.978
  194   1HB   ASN  26          HB2       ASN  26  12.713   3.352  -9.437
  195   2HB   ASN  26          HB1       ASN  26  12.173   2.016 -10.440
  196   1HD2  ASN  26          HD21      ASN  26  13.233   1.578 -12.305
  197   2HD2  ASN  26          HD22      ASN  26  14.690   2.370 -12.779
  198    H    LEU  27           HN       LEU  27   8.987   3.743 -12.013
  199    HA   LEU  27           HA       LEU  27   7.462   2.911  -9.733
  200   1HB   LEU  27          HB2       LEU  27   6.759   3.151 -12.649
  201   2HB   LEU  27          HB1       LEU  27   5.623   2.601 -11.438
  202    HG   LEU  27           HG       LEU  27   6.904   5.336 -11.523
  203   1HD1  LEU  27          HD11      LEU  27   4.658   6.093 -12.085
  204   2HD1  LEU  27          HD12      LEU  27   4.077   4.436 -12.062
  205   3HD1  LEU  27          HD13      LEU  27   5.232   4.947 -13.301
  206   1HD2  LEU  27          HD21      LEU  27   6.447   4.560  -9.255
  207   2HD2  LEU  27          HD22      LEU  27   4.788   4.178  -9.720
  208   3HD2  LEU  27          HD23      LEU  27   5.343   5.850  -9.727
  209    H    ASP  28           HN       ASP  28   9.119   1.368 -12.291
  210    HA   ASP  28           HA       ASP  28   7.644  -1.112 -11.953
  211   1HB   ASP  28          HB2       ASP  28   9.724  -0.279 -13.959
  212   2HB   ASP  28          HB1       ASP  28   9.137  -1.933 -13.835
  213    H    SER  29           HN       SER  29   9.726   0.061 -10.007
  214    HA   SER  29           HA       SER  29  11.462  -2.256  -9.942
  215   1HB   SER  29          HB2       SER  29  11.535   0.319  -8.361
  216   2HB   SER  29          HB1       SER  29  12.695  -1.004  -8.230
  217    HG   SER  29           HG       SER  29  12.254  -0.112 -10.808
  218    H    SER  30           HN       SER  30  11.121  -3.775  -8.595
  219    HA   SER  30           HA       SER  30   8.801  -3.708  -6.874
  220   1HB   SER  30          HB2       SER  30  10.824  -5.774  -7.634
  221   2HB   SER  30          HB1       SER  30   9.476  -6.149  -6.588
  222    HG   SER  30           HG       SER  30   9.004  -4.833  -9.001
  223    H    LEU  31           HN       LEU  31   8.978  -4.134  -4.575
  224    HA   LEU  31           HA       LEU  31  11.270  -3.015  -3.361
  225   1HB   LEU  31          HB2       LEU  31   9.053  -4.610  -2.042
  226   2HB   LEU  31          HB1       LEU  31  10.432  -3.963  -1.184
  227    HG   LEU  31           HG       LEU  31   9.696  -1.668  -1.804
  228   1HD1  LEU  31          HD11      LEU  31   8.366  -2.176  -3.746
  229   2HD1  LEU  31          HD12      LEU  31   7.405  -1.332  -2.527
  230   3HD1  LEU  31          HD13      LEU  31   7.230  -3.076  -2.747
  231   1HD2  LEU  31          HD21      LEU  31   9.210  -2.616   0.373
  232   2HD2  LEU  31          HD22      LEU  31   7.730  -3.340  -0.258
  233   3HD2  LEU  31          HD23      LEU  31   7.886  -1.586  -0.170
  234    H    ALA  32           HN       ALA  32  10.796  -6.075  -4.566
  235    HA   ALA  32           HA       ALA  32  12.633  -7.381  -2.934
  236   1HB   ALA  32          HB1       ALA  32  12.748  -9.126  -4.686
  237   2HB   ALA  32          HB2       ALA  32  11.889  -8.050  -5.790
  238   3HB   ALA  32          HB3       ALA  32  11.083  -8.657  -4.342
  239    H    ASP  33           HN       ASP  33  12.880  -5.313  -5.668
  240    HA   ASP  33           HA       ASP  33  15.565  -5.908  -6.288
  241   1HB   ASP  33          HB2       ASP  33  14.348  -4.975  -8.083
  242   2HB   ASP  33          HB1       ASP  33  13.700  -3.683  -7.080
  243    H    LEU  34           HN       LEU  34  13.793  -3.550  -4.526
  244    HA   LEU  34           HA       LEU  34  15.828  -1.783  -3.719
  245   1HB   LEU  34          HB2       LEU  34  13.329  -2.456  -2.199
  246   2HB   LEU  34          HB1       LEU  34  14.210  -0.942  -2.196
  247    HG   LEU  34           HG       LEU  34  12.703  -2.055  -4.557
  248   1HD1  LEU  34          HD11      LEU  34  11.931   0.159  -2.684
  249   2HD1  LEU  34          HD12      LEU  34  11.273  -1.480  -2.741
  250   3HD1  LEU  34          HD13      LEU  34  11.049  -0.398  -4.126
  251   1HD2  LEU  34          HD21      LEU  34  12.985   0.144  -5.518
  252   2HD2  LEU  34          HD22      LEU  34  14.545  -0.628  -5.213
  253   3HD2  LEU  34          HD23      LEU  34  13.961   0.647  -4.132
  254    H    GLY  35           HN       GLY  35  14.390  -4.648  -2.222
  255   1HA   GLY  35          HA2       GLY  35  15.576  -6.199  -0.898
  256   2HA   GLY  35          HA1       GLY  35  16.764  -4.949  -0.539
  257    H    LEU  36           HN       LEU  36  13.603  -6.189   0.237
  258    HA   LEU  36           HA       LEU  36  13.453  -4.240   2.413
  259   1HB   LEU  36          HB2       LEU  36  11.123  -4.505   2.491
  260   2HB   LEU  36          HB1       LEU  36  11.525  -4.414   0.797
  261    HG   LEU  36           HG       LEU  36  11.406  -7.067   0.978
  262   1HD1  LEU  36          HD11      LEU  36   9.624  -7.766   2.482
  263   2HD1  LEU  36          HD12      LEU  36   9.560  -6.123   3.129
  264   3HD1  LEU  36          HD13      LEU  36  11.005  -7.110   3.390
  265   1HD2  LEU  36          HD21      LEU  36  10.080  -5.800  -0.475
  266   2HD2  LEU  36          HD22      LEU  36   9.129  -5.184   0.885
  267   3HD2  LEU  36          HD23      LEU  36   9.015  -6.896   0.428
  268    H    ASP  37           HN       ASP  37  13.233  -4.822   4.437
  269    HA   ASP  37           HA       ASP  37  12.539  -7.147   5.711
  270   1HB   ASP  37          HB2       ASP  37  14.527  -8.257   4.658
  271   2HB   ASP  37          HB1       ASP  37  15.568  -7.027   5.366
  272    H    SER  38           HN       SER  38  14.448  -4.377   5.402
  273    HA   SER  38           HA       SER  38  15.065  -4.062   8.160
  274   1HB   SER  38          HB2       SER  38  15.803  -1.751   7.294
  275   2HB   SER  38          HB1       SER  38  16.644  -3.185   6.697
  276    HG   SER  38           HG       SER  38  15.841  -2.919   4.792
  277    H    LEU  39           HN       LEU  39  13.564  -1.438   6.341
  278    HA   LEU  39           HA       LEU  39  11.690  -1.148   8.587
  279   1HB   LEU  39          HB2       LEU  39  13.118   0.786   8.174
  280   2HB   LEU  39          HB1       LEU  39  12.547   0.865   6.517
  281    HG   LEU  39           HG       LEU  39  10.234   1.209   7.464
  282   1HD1  LEU  39          HD11      LEU  39  10.064   2.109   9.720
  283   2HD1  LEU  39          HD12      LEU  39  11.765   1.729   9.992
  284   3HD1  LEU  39          HD13      LEU  39  10.606   0.431   9.706
  285   1HD2  LEU  39          HD21      LEU  39  12.342   3.300   7.958
  286   2HD2  LEU  39          HD22      LEU  39  10.597   3.590   7.821
  287   3HD2  LEU  39          HD23      LEU  39  11.500   2.953   6.445
  288    H    MET  40           HN       MET  40  11.931  -0.987   5.094
  289    HA   MET  40           HA       MET  40   9.323  -0.578   4.369
  290   1HB   MET  40          HB2       MET  40  11.420  -2.266   3.036
  291   2HB   MET  40          HB1       MET  40   9.844  -1.960   2.329
  292   1HG   MET  40          HG2       MET  40  10.267   0.394   2.318
  293   2HG   MET  40          HG1       MET  40  11.838   0.148   3.093
  294   1HE   MET  40          HE1       MET  40  12.930  -2.436   1.588
  295   2HE   MET  40          HE2       MET  40  13.910  -1.002   1.880
  296   3HE   MET  40          HE3       MET  40  13.833  -1.703   0.263
  297    H    GLY  41           HN       GLY  41  10.774  -3.695   5.163
  298   1HA   GLY  41          HA2       GLY  41   8.428  -5.204   4.527
  299   2HA   GLY  41          HA1       GLY  41   9.821  -5.788   5.422
  300    H    VAL  42           HN       VAL  42   9.120  -3.203   7.107
  301    HA   VAL  42           HA       VAL  42   7.380  -4.658   8.940
  302    HB   VAL  42           HB       VAL  42   9.201  -2.284   9.423
  303   1HG1  VAL  42          HG11      VAL  42   8.766  -2.618  11.805
  304   2HG1  VAL  42          HG12      VAL  42   7.569  -3.856  11.401
  305   3HG1  VAL  42          HG13      VAL  42   7.320  -2.180  10.899
  306   1HG2  VAL  42          HG21      VAL  42  10.463  -4.280   9.041
  307   2HG2  VAL  42          HG22      VAL  42   9.495  -5.158  10.237
  308   3HG2  VAL  42          HG23      VAL  42  10.554  -3.839  10.748
  309    H    GLU  43           HN       GLU  43   7.915  -1.438   7.634
  310    HA   GLU  43           HA       GLU  43   5.692  -0.187   8.718
  311   1HB   GLU  43          HB2       GLU  43   7.640   0.868   7.558
  312   2HB   GLU  43          HB1       GLU  43   6.926   0.367   6.032
  313   1HG   GLU  43          HG2       GLU  43   6.492   2.668   6.580
  314   2HG   GLU  43          HG1       GLU  43   4.986   1.746   6.443
  315    H    VAL  44           HN       VAL  44   6.056  -2.005   5.734
  316    HA   VAL  44           HA       VAL  44   3.441  -1.511   4.699
  317    HB   VAL  44           HB       VAL  44   5.292  -3.858   4.203
  318   1HG1  VAL  44          HG11      VAL  44   2.873  -2.958   2.670
  319   2HG1  VAL  44          HG12      VAL  44   3.058  -4.418   3.658
  320   3HG1  VAL  44          HG13      VAL  44   4.007  -4.235   2.176
  321   1HG2  VAL  44          HG21      VAL  44   6.294  -1.783   3.584
  322   2HG2  VAL  44          HG22      VAL  44   4.884  -1.331   2.609
  323   3HG2  VAL  44          HG23      VAL  44   5.893  -2.723   2.154
  324    H    ARG  45           HN       ARG  45   4.881  -4.059   6.568
  325    HA   ARG  45           HA       ARG  45   2.785  -5.914   6.546
  326   1HB   ARG  45          HB2       ARG  45   5.276  -6.091   7.213
  327   2HB   ARG  45          HB1       ARG  45   4.715  -5.622   8.811
  328   1HG   ARG  45          HG2       ARG  45   3.161  -7.558   8.750
  329   2HG   ARG  45          HG1       ARG  45   3.927  -8.055   7.239
  330   1HD   ARG  45          HD2       ARG  45   5.170  -7.858   9.975
  331   2HD   ARG  45          HD1       ARG  45   4.941  -9.284   8.965
  332    HE   ARG  45           HE       ARG  45   6.641  -7.294   7.770
  333   1HH1  ARG  45          HH11      ARG  45   6.531 -10.092   9.994
  334   2HH1  ARG  45          HH12      ARG  45   8.150 -10.510   9.804
  335   1HH2  ARG  45          HH21      ARG  45   8.987  -7.810   7.644
  336   2HH2  ARG  45          HH22      ARG  45   9.591  -9.137   8.502
  337    H    GLN  46           HN       GLN  46   3.703  -3.350   8.791
  338    HA   GLN  46           HA       GLN  46   1.581  -3.979  10.576
  339   1HB   GLN  46          HB2       GLN  46   3.575  -1.753  10.556
  340   2HB   GLN  46          HB1       GLN  46   2.320  -1.920  11.780
  341   1HG   GLN  46          HG2       GLN  46   3.208  -4.192  12.283
  342   2HG   GLN  46          HG1       GLN  46   4.518  -3.854  11.162
  343   1HE2  GLN  46          HE21      GLN  46   5.961  -4.094  12.816
  344   2HE2  GLN  46          HE22      GLN  46   6.213  -2.858  14.012
  345    H    ILE  47           HN       ILE  47   1.433  -2.484   7.710
  346    HA   ILE  47           HA       ILE  47  -0.811  -0.864   8.651
  347    HB   ILE  47           HB       ILE  47   0.357  -0.994   5.857
  348   1HG1  ILE  47          HG12      ILE  47   0.575   1.171   7.950
  349   2HG1  ILE  47          HG11      ILE  47   1.875   0.061   7.497
  350   1HG2  ILE  47          HG21      ILE  47  -1.700   0.840   7.105
  351   2HG2  ILE  47          HG22      ILE  47  -2.023  -0.431   5.924
  352   3HG2  ILE  47          HG23      ILE  47  -1.069   0.980   5.463
  353   1HD1  ILE  47          HD11      ILE  47   0.592   2.121   5.703
  354   2HD1  ILE  47          HD12      ILE  47   1.889   1.018   5.243
  355   3HD1  ILE  47          HD13      ILE  47   2.175   2.251   6.471
  356    H    LEU  48           HN       LEU  48   0.016  -3.325   6.242
  357    HA   LEU  48           HA       LEU  48  -2.719  -3.765   5.652
  358   1HB   LEU  48          HB2       LEU  48  -0.269  -5.318   4.859
  359   2HB   LEU  48          HB1       LEU  48  -1.880  -5.846   4.432
  360    HG   LEU  48           HG       LEU  48  -1.041  -4.765   2.538
  361   1HD1  LEU  48          HD11      LEU  48  -2.802  -2.801   3.955
  362   2HD1  LEU  48          HD12      LEU  48  -3.331  -4.203   3.022
  363   3HD1  LEU  48          HD13      LEU  48  -2.514  -2.854   2.216
  364   1HD2  LEU  48          HD21      LEU  48  -0.117  -2.484   2.522
  365   2HD2  LEU  48          HD22      LEU  48   0.845  -3.575   3.518
  366   3HD2  LEU  48          HD23      LEU  48  -0.256  -2.427   4.279
  367    H    GLU  49           HN       GLU  49  -0.366  -5.796   7.396
  368    HA   GLU  49           HA       GLU  49  -2.372  -7.688   8.095
  369   1HB   GLU  49          HB2       GLU  49  -0.030  -8.345   7.905
  370   2HB   GLU  49          HB1       GLU  49   0.404  -7.247   9.207
  371   1HG   GLU  49          HG2       GLU  49  -1.092  -8.581  10.706
  372   2HG   GLU  49          HG1       GLU  49  -1.253  -9.745   9.391
  373    H    ARG  50           HN       ARG  50  -0.540  -5.325   9.950
  374    HA   ARG  50           HA       ARG  50  -1.848  -5.761  12.380
  375   1HB   ARG  50          HB2       ARG  50   0.265  -4.712  12.369
  376   2HB   ARG  50          HB1       ARG  50  -0.302  -3.415  11.340
  377   1HG   ARG  50          HG2       ARG  50  -1.684  -2.579  13.194
  378   2HG   ARG  50          HG1       ARG  50  -1.053  -3.875  14.219
  379   1HD   ARG  50          HD2       ARG  50   1.160  -3.030  14.085
  380   2HD   ARG  50          HD1       ARG  50   0.730  -1.912  12.795
  381    HE   ARG  50           HE       ARG  50  -0.657  -1.565  15.295
  382   1HH1  ARG  50          HH11      ARG  50   2.268  -0.658  13.491
  383   2HH1  ARG  50          HH12      ARG  50   2.370   0.916  14.107
  384   1HH2  ARG  50          HH21      ARG  50  -0.538   0.635  16.164
  385   2HH2  ARG  50          HH22      ARG  50   0.722   1.676  15.675
  386    H    GLU  51           HN       GLU  51  -2.626  -3.321   9.875
  387    HA   GLU  51           HA       GLU  51  -4.757  -2.454  11.644
  388   1HB   GLU  51          HB2       GLU  51  -3.811  -1.217   9.097
  389   2HB   GLU  51          HB1       GLU  51  -5.055  -0.547  10.145
  390   1HG   GLU  51          HG2       GLU  51  -3.385  -0.519  12.015
  391   2HG   GLU  51          HG1       GLU  51  -2.151  -0.943  10.834
  392    H    HIS  52           HN       HIS  52  -4.510  -3.543   8.264
  393    HA   HIS  52           HA       HIS  52  -7.442  -3.621   8.179
  394   1HB   HIS  52          HB2       HIS  52  -5.445  -4.174   5.980
  395   2HB   HIS  52          HB1       HIS  52  -7.177  -4.385   5.814
  396    HD1  HIS  52           HD1      HIS  52  -8.627  -2.209   5.590
  397    HD2  HIS  52           HD2      HIS  52  -4.523  -1.578   5.806
  398    HE1  HIS  52           HE1      HIS  52  -8.258   0.095   4.748
  399    HE2  HIS  52           HE2      HIS  52  -5.819   0.532   5.069
  400    H    ASP  53           HN       ASP  53  -5.055  -5.719   9.063
  401    HA   ASP  53           HA       ASP  53  -5.008  -7.833   9.710
  402   1HB   ASP  53          HB2       ASP  53  -7.946  -7.889   9.042
  403   2HB   ASP  53          HB1       ASP  53  -7.088  -9.309   9.623
  404    H    LEU  54           HN       LEU  54  -4.837  -6.944   6.798
  405    HA   LEU  54           HA       LEU  54  -5.103  -9.471   5.423
  406   1HB   LEU  54          HB2       LEU  54  -3.890  -6.839   4.585
  407   2HB   LEU  54          HB1       LEU  54  -3.675  -8.281   3.631
  408    HG   LEU  54           HG       LEU  54  -6.156  -8.387   3.362
  409   1HD1  LEU  54          HD11      LEU  54  -7.440  -6.335   3.798
  410   2HD1  LEU  54          HD12      LEU  54  -6.022  -5.653   4.608
  411   3HD1  LEU  54          HD13      LEU  54  -6.823  -7.062   5.284
  412   1HD2  LEU  54          HD21      LEU  54  -4.772  -5.904   2.379
  413   2HD2  LEU  54          HD22      LEU  54  -6.242  -6.600   1.699
  414   3HD2  LEU  54          HD23      LEU  54  -4.725  -7.500   1.629
  415    H    VAL  55           HN       VAL  55  -3.840 -10.957   6.280
  416    HA   VAL  55           HA       VAL  55  -1.166 -10.371   7.105
  417    HB   VAL  55           HB       VAL  55  -2.399 -13.106   6.630
  418   1HG1  VAL  55          HG11      VAL  55   0.099 -12.329   8.153
  419   2HG1  VAL  55          HG12      VAL  55   0.043 -13.190   6.619
  420   3HG1  VAL  55          HG13      VAL  55  -0.588 -13.951   8.077
  421   1HG2  VAL  55          HG21      VAL  55  -3.634 -11.864   8.331
  422   2HG2  VAL  55          HG22      VAL  55  -2.132 -11.530   9.193
  423   3HG2  VAL  55          HG23      VAL  55  -2.724 -13.185   9.062
  424    H    LEU  56           HN       LEU  56  -0.349  -9.428   5.324
  425    HA   LEU  56           HA       LEU  56   0.146 -11.144   3.025
  426   1HB   LEU  56          HB2       LEU  56   0.774  -8.219   3.398
  427   2HB   LEU  56          HB1       LEU  56   0.941  -9.122   1.913
  428    HG   LEU  56           HG       LEU  56  -1.649  -8.392   3.285
  429   1HD1  LEU  56          HD11      LEU  56  -0.603  -6.540   2.135
  430   2HD1  LEU  56          HD12      LEU  56  -2.051  -7.070   1.278
  431   3HD1  LEU  56          HD13      LEU  56  -0.459  -7.509   0.668
  432   1HD2  LEU  56          HD21      LEU  56  -1.818 -10.610   2.254
  433   2HD2  LEU  56          HD22      LEU  56  -1.231  -9.949   0.726
  434   3HD2  LEU  56          HD23      LEU  56  -2.779  -9.415   1.388
  435    HA   PRO  57           HA       PRO  57   4.035 -11.681   5.125
  436   1HB   PRO  57          HB2       PRO  57   4.514 -13.812   3.233
  437   2HB   PRO  57          HB1       PRO  57   4.191 -13.944   4.965
  438   1HG   PRO  57          HG2       PRO  57   2.461 -14.799   3.030
  439   2HG   PRO  57          HG1       PRO  57   1.942 -14.258   4.639
  440   1HD   PRO  57          HD2       PRO  57   1.964 -12.777   2.046
  441   2HD   PRO  57          HD1       PRO  57   0.714 -12.804   3.318
  442    H    ILE  58           HN       ILE  58   6.294 -11.913   4.260
  443    HA   ILE  58           HA       ILE  58   6.901  -9.999   2.351
  444    HB   ILE  58           HB       ILE  58   8.523 -12.184   3.629
  445   1HG1  ILE  58          HG12      ILE  58   9.955 -10.313   4.357
  446   2HG1  ILE  58          HG11      ILE  58   8.989  -9.204   3.402
  447   1HG2  ILE  58          HG21      ILE  58   9.356 -12.339   1.364
  448   2HG2  ILE  58          HG22      ILE  58  10.573 -11.615   2.413
  449   3HG2  ILE  58          HG23      ILE  58   9.636 -10.598   1.321
  450   1HD1  ILE  58          HD11      ILE  58   7.070  -9.664   4.838
  451   2HD1  ILE  58          HD12      ILE  58   8.451  -9.062   5.759
  452   3HD1  ILE  58          HD13      ILE  58   8.051 -10.781   5.784
  453    H    ARG  59           HN       ARG  59   5.962 -13.208   2.004
  454    HA   ARG  59           HA       ARG  59   6.878 -13.805  -0.602
  455   1HB   ARG  59          HB2       ARG  59   4.514 -14.951   0.912
  456   2HB   ARG  59          HB1       ARG  59   5.045 -15.545  -0.652
  457   1HG   ARG  59          HG2       ARG  59   5.970 -17.029   0.886
  458   2HG   ARG  59          HG1       ARG  59   7.302 -15.965   0.458
  459   1HD   ARG  59          HD2       ARG  59   6.629 -14.630   2.569
  460   2HD   ARG  59          HD1       ARG  59   5.701 -16.060   3.002
  461    HE   ARG  59           HE       ARG  59   8.483 -16.368   2.280
  462   1HH1  ARG  59          HH11      ARG  59   6.007 -16.596   4.849
  463   2HH1  ARG  59          HH12      ARG  59   7.147 -17.052   6.049
  464   1HH2  ARG  59          HH21      ARG  59   9.978 -17.076   3.997
  465   2HH2  ARG  59          HH22      ARG  59   9.343 -17.347   5.565
  466    H    GLU  60           HN       GLU  60   4.406 -11.742   0.494
  467    HA   GLU  60           HA       GLU  60   3.354 -11.465  -2.246
  468   1HB   GLU  60          HB2       GLU  60   2.205 -10.520   0.394
  469   2HB   GLU  60          HB1       GLU  60   1.510 -10.164  -1.178
  470   1HG   GLU  60          HG2       GLU  60   1.772 -12.876   0.100
  471   2HG   GLU  60          HG1       GLU  60   0.296 -11.930  -0.087
  472    H    VAL  61           HN       VAL  61   4.392  -9.698   0.608
  473    HA   VAL  61           HA       VAL  61   4.277  -7.115  -0.373
  474    HB   VAL  61           HB       VAL  61   6.001  -8.259   1.842
  475   1HG1  VAL  61          HG11      VAL  61   6.924  -6.112   1.146
  476   2HG1  VAL  61          HG12      VAL  61   6.164  -5.987   2.732
  477   3HG1  VAL  61          HG13      VAL  61   5.334  -5.363   1.305
  478   1HG2  VAL  61          HG21      VAL  61   3.624  -8.573   2.197
  479   2HG2  VAL  61          HG22      VAL  61   3.335  -6.858   1.906
  480   3HG2  VAL  61          HG23      VAL  61   4.257  -7.369   3.321
  481    H    ARG  62           HN       ARG  62   6.815  -9.473  -0.824
  482    HA   ARG  62           HA       ARG  62   8.787  -7.500  -1.349
  483   1HB   ARG  62          HB2       ARG  62   9.119  -9.902  -0.507
  484   2HB   ARG  62          HB1       ARG  62   8.999 -10.360  -2.200
  485   1HG   ARG  62          HG2       ARG  62  10.864  -8.916  -2.735
  486   2HG   ARG  62          HG1       ARG  62  10.976  -8.418  -1.048
  487   1HD   ARG  62          HD2       ARG  62  11.412 -10.788  -0.449
  488   2HD   ARG  62          HD1       ARG  62  11.421 -11.182  -2.169
  489    HE   ARG  62           HE       ARG  62  13.259  -9.216  -1.003
  490   1HH1  ARG  62          HH11      ARG  62  12.805 -12.234  -2.776
  491   2HH1  ARG  62          HH12      ARG  62  14.398 -12.296  -3.375
  492   1HH2  ARG  62          HH21      ARG  62  15.442  -9.306  -1.761
  493   2HH2  ARG  62          HH22      ARG  62  15.952 -10.573  -2.772
  494    H    GLN  63           HN       GLN  63   6.254  -8.739  -3.289
  495    HA   GLN  63           HA       GLN  63   7.766  -8.053  -5.704
  496   1HB   GLN  63          HB2       GLN  63   5.149  -9.575  -5.568
  497   2HB   GLN  63          HB1       GLN  63   6.022  -9.175  -7.031
  498   1HG   GLN  63          HG2       GLN  63   6.586 -11.396  -6.689
  499   2HG   GLN  63          HG1       GLN  63   7.959 -10.528  -6.010
  500   1HE2  GLN  63          HE21      GLN  63   4.843 -10.838  -4.493
  501   2HE2  GLN  63          HE22      GLN  63   5.364 -11.860  -3.201
  502    H    LEU  64           HN       LEU  64   6.066  -6.507  -3.600
  503    HA   LEU  64           HA       LEU  64   4.198  -5.089  -5.199
  504   1HB   LEU  64          HB2       LEU  64   5.614  -4.264  -2.650
  505   2HB   LEU  64          HB1       LEU  64   4.229  -3.440  -3.350
  506    HG   LEU  64           HG       LEU  64   4.285  -6.216  -2.180
  507   1HD1  LEU  64          HD11      LEU  64   2.970  -3.688  -1.231
  508   2HD1  LEU  64          HD12      LEU  64   4.371  -4.480  -0.509
  509   3HD1  LEU  64          HD13      LEU  64   2.798  -5.279  -0.491
  510   1HD2  LEU  64          HD21      LEU  64   1.865  -6.238  -2.543
  511   2HD2  LEU  64          HD22      LEU  64   2.746  -6.122  -4.065
  512   3HD2  LEU  64          HD23      LEU  64   1.978  -4.690  -3.379
  513    H    THR  65           HN       THR  65   4.502  -3.064  -6.251
  514    HA   THR  65           HA       THR  65   7.266  -2.536  -6.914
  515    HB   THR  65           HB       THR  65   6.225  -1.104  -8.733
  516    HG1  THR  65           HG1      THR  65   4.000  -1.376  -9.082
  517   1HG2  THR  65          HG21      THR  65   5.502  -3.024 -10.071
  518   2HG2  THR  65          HG22      THR  65   5.321  -3.970  -8.591
  519   3HG2  THR  65          HG23      THR  65   6.928  -3.443  -9.100
  520    H    LEU  66           HN       LEU  66   4.678  -0.246  -6.889
  521    HA   LEU  66           HA       LEU  66   5.430   0.970  -4.425
  522   1HB   LEU  66          HB2       LEU  66   7.200   1.898  -5.958
  523   2HB   LEU  66          HB1       LEU  66   5.937   2.584  -6.951
  524    HG   LEU  66           HG       LEU  66   7.201   4.154  -5.337
  525   1HD1  LEU  66          HD11      LEU  66   5.150   4.790  -6.459
  526   2HD1  LEU  66          HD12      LEU  66   5.201   5.434  -4.809
  527   3HD1  LEU  66          HD13      LEU  66   4.209   4.018  -5.186
  528   1HD2  LEU  66          HD21      LEU  66   7.101   2.659  -3.379
  529   2HD2  LEU  66          HD22      LEU  66   5.330   2.857  -3.409
  530   3HD2  LEU  66          HD23      LEU  66   6.355   4.243  -3.082
  531    H    ARG  67           HN       ARG  67   3.904   1.913  -7.494
  532    HA   ARG  67           HA       ARG  67   1.763   3.085  -6.011
  533   1HB   ARG  67          HB2       ARG  67   2.115   2.720  -8.986
  534   2HB   ARG  67          HB1       ARG  67   0.695   3.468  -8.276
  535   1HG   ARG  67          HG2       ARG  67   3.539   4.486  -8.077
  536   2HG   ARG  67          HG1       ARG  67   2.256   5.162  -9.079
  537   1HD   ARG  67          HD2       ARG  67   0.969   5.533  -6.880
  538   2HD   ARG  67          HD1       ARG  67   2.501   5.154  -6.079
  539    HE   ARG  67           HE       ARG  67   3.446   7.105  -7.318
  540   1HH1  ARG  67          HH11      ARG  67  -0.016   7.039  -6.474
  541   2HH1  ARG  67          HH12      ARG  67  -0.218   8.702  -6.681
  542   1HH2  ARG  67          HH21      ARG  67   3.090   9.496  -7.570
  543   2HH2  ARG  67          HH22      ARG  67   1.517  10.059  -7.280
  544    H    LYS  68           HN       LYS  68   2.457  -0.027  -6.745
  545    HA   LYS  68           HA       LYS  68  -0.189  -1.040  -6.993
  546   1HB   LYS  68          HB2       LYS  68   1.775  -2.465  -7.599
  547   2HB   LYS  68          HB1       LYS  68   2.304  -2.436  -5.929
  548   1HG   LYS  68          HG2       LYS  68   0.469  -3.729  -5.198
  549   2HG   LYS  68          HG1       LYS  68  -0.345  -3.571  -6.752
  550   1HD   LYS  68          HD2       LYS  68   2.322  -4.902  -6.406
  551   2HD   LYS  68          HD1       LYS  68   0.790  -5.783  -6.321
  552   1HE   LYS  68          HE2       LYS  68   1.769  -4.167  -8.685
  553   2HE   LYS  68          HE1       LYS  68   1.802  -5.924  -8.556
  554   1HZ   LYS  68          HZ1       LYS  68  -0.108  -5.066  -9.837
  555   2HZ   LYS  68          HZ2       LYS  68  -0.737  -4.322  -8.462
  556   3HZ   LYS  68          HZ3       LYS  68  -0.571  -5.993  -8.519
  557    H    LEU  69           HN       LEU  69   1.759   0.113  -4.431
  558    HA   LEU  69           HA       LEU  69   0.397  -1.056  -2.271
  559   1HB   LEU  69          HB2       LEU  69   2.111   1.386  -2.504
  560   2HB   LEU  69          HB1       LEU  69   1.219   1.108  -1.027
  561    HG   LEU  69           HG       LEU  69   3.571   0.353  -0.898
  562   1HD1  LEU  69          HD11      LEU  69   1.525  -1.851  -0.721
  563   2HD1  LEU  69          HD12      LEU  69   1.886  -0.657   0.527
  564   3HD1  LEU  69          HD13      LEU  69   3.106  -1.844   0.063
  565   1HD2  LEU  69          HD21      LEU  69   4.258  -1.684  -2.094
  566   2HD2  LEU  69          HD22      LEU  69   3.859  -0.386  -3.231
  567   3HD2  LEU  69          HD23      LEU  69   2.711  -1.691  -2.940
  568    H    GLN  70           HN       GLN  70  -0.196   2.038  -3.885
  569    HA   GLN  70           HA       GLN  70  -2.449   2.607  -2.222
  570   1HB   GLN  70          HB2       GLN  70  -3.024   4.351  -3.951
  571   2HB   GLN  70          HB1       GLN  70  -1.421   4.499  -3.248
  572   1HG   GLN  70          HG2       GLN  70  -0.416   3.589  -5.178
  573   2HG   GLN  70          HG1       GLN  70  -1.994   3.248  -5.934
  574   1HE2  GLN  70          HE21      GLN  70  -1.565   4.529  -7.696
  575   2HE2  GLN  70          HE22      GLN  70  -1.518   6.244  -7.626
  576    H    GLU  71           HN       GLU  71  -1.946   0.829  -5.069
  577    HA   GLU  71           HA       GLU  71  -4.611   0.483  -5.961
  578   1HB   GLU  71          HB2       GLU  71  -2.649   0.062  -7.354
  579   2HB   GLU  71          HB1       GLU  71  -2.096  -1.171  -6.246
  580   1HG   GLU  71          HG2       GLU  71  -4.110  -2.506  -6.861
  581   2HG   GLU  71          HG1       GLU  71  -4.462  -1.286  -8.093
  582    H    MET  72           HN       MET  72  -2.688  -0.915  -3.440
  583    HA   MET  72           HA       MET  72  -4.767  -2.923  -2.851
  584   1HB   MET  72          HB2       MET  72  -1.885  -2.887  -1.915
  585   2HB   MET  72          HB1       MET  72  -3.052  -4.171  -1.661
  586   1HG   MET  72          HG2       MET  72  -3.074  -4.498  -4.167
  587   2HG   MET  72          HG1       MET  72  -1.785  -3.323  -4.234
  588   1HE   MET  72          HE1       MET  72  -1.356  -7.373  -2.064
  589   2HE   MET  72          HE2       MET  72  -2.831  -6.869  -2.888
  590   3HE   MET  72          HE3       MET  72  -2.306  -6.031  -1.428
  591    H    SER  73           HN       SER  73  -4.532   0.053  -2.092
  592    HA   SER  73           HA       SER  73  -3.691   0.057   0.592
  593   1HB   SER  73          HB2       SER  73  -4.439   2.393   0.699
  594   2HB   SER  73          HB1       SER  73  -3.543   2.070  -0.764
  595    HG   SER  73           HG       SER  73  -5.248   2.409  -1.967
  596    H    SER  74           HN       SER  74  -6.816  -0.280  -0.929
  597    HA   SER  74           HA       SER  74  -8.756  -1.197  -0.196
  598   1HB   SER  74          HB2       SER  74  -7.249  -2.957   0.739
  599   2HB   SER  74          HB1       SER  74  -7.116  -2.032   2.228
  600    HG   SER  74           HG       SER  74  -9.226  -2.443   2.681
  601    H    LYS  75           HN       LYS  75  -8.199   1.552   0.319
  602    HA   LYS  75           HA       LYS  75  -9.286   2.002   3.001
  603   1HB   LYS  75          HB2       LYS  75  -8.549   4.163   1.038
  604   2HB   LYS  75          HB1       LYS  75  -8.745   4.301   2.775
  605   1HG   LYS  75          HG2       LYS  75  -6.717   2.904   3.058
  606   2HG   LYS  75          HG1       LYS  75  -6.512   2.924   1.308
  607   1HD   LYS  75          HD2       LYS  75  -6.440   5.274   3.195
  608   2HD   LYS  75          HD1       LYS  75  -5.110   4.627   2.240
  609   1HE   LYS  75          HE2       LYS  75  -7.588   6.000   1.170
  610   2HE   LYS  75          HE1       LYS  75  -5.975   6.692   1.274
  611   1HZ   LYS  75          HZ1       LYS  75  -6.757   4.384  -0.468
  612   2HZ   LYS  75          HZ2       LYS  75  -5.210   5.081  -0.395
  613   3HZ   LYS  75          HZ3       LYS  75  -6.498   5.968  -0.945
  614    H    ALA  76           HN       ALA  76 -11.406   1.564   2.917
  615    HA   ALA  76           HA       ALA  76 -13.019   2.899   0.897
  616   1HB   ALA  76          HB1       ALA  76 -14.883   1.587   1.852
  617   2HB   ALA  76          HB2       ALA  76 -13.787   0.926   3.066
  618   3HB   ALA  76          HB3       ALA  76 -13.548   0.542   1.363
  619    H    GLY  77           HN       GLY  77 -12.561   2.569   4.373
  620   1HA   GLY  77          HA2       GLY  77 -12.631   4.167   6.033
  621   2HA   GLY  77          HA1       GLY  77 -12.996   5.375   4.810
  622    H    SER  78           HN       SER  78 -15.249   4.802   3.784
  623    HA   SER  78           HA       SER  78 -17.174   4.312   5.918
  624   1HB   SER  78          HB2       SER  78 -16.811   6.777   5.541
  625   2HB   SER  78          HB1       SER  78 -17.314   6.549   3.868
  626    HG   SER  78           HG       SER  78 -18.792   6.122   6.220
  627    H    ASP  79           HN       ASP  79 -19.131   3.414   5.077
  628    HA   ASP  79           HA       ASP  79 -18.789   2.291   2.385
  629   1HB   ASP  79          HB2       ASP  79 -20.153   0.427   3.033
  630   2HB   ASP  79          HB1       ASP  79 -18.971   0.656   4.313
  631    H    THR  80           HN       THR  80 -20.837   1.922   1.223
  632    HA   THR  80           HA       THR  80 -22.845   3.977   1.834
  633    HB   THR  80           HB       THR  80 -21.371   4.715  -0.039
  634    HG1  THR  80           HG1      THR  80 -23.472   5.402  -0.084
  635   1HG2  THR  80          HG21      THR  80 -22.412   2.276  -1.497
  636   2HG2  THR  80          HG22      THR  80 -20.748   2.539  -0.975
  637   3HG2  THR  80          HG23      THR  80 -21.453   3.565  -2.225
  638    H    GLU  81           HN       GLU  81 -22.722   1.112   2.480
  639    HA   GLU  81           HA       GLU  81 -24.367  -0.284   0.584
  640   1HB   GLU  81          HB2       GLU  81 -23.703  -1.065   3.416
  641   2HB   GLU  81          HB1       GLU  81 -24.267  -2.120   2.130
  642   1HG   GLU  81          HG2       GLU  81 -22.175  -1.695   0.910
  643   2HG   GLU  81          HG1       GLU  81 -21.616  -0.720   2.268
  644    H    LEU  82           HN       LEU  82 -26.498  -1.064   1.045
  645    HA   LEU  82           HA       LEU  82 -27.930   0.752   2.850
  646   1HB   LEU  82          HB2       LEU  82 -28.919  -0.527   0.305
  647   2HB   LEU  82          HB1       LEU  82 -29.895   0.444   1.384
  648    HG   LEU  82           HG       LEU  82 -27.518   1.419  -0.203
  649   1HD1  LEU  82          HD11      LEU  82 -29.451   0.960  -1.596
  650   2HD1  LEU  82          HD12      LEU  82 -29.180   2.697  -1.460
  651   3HD1  LEU  82          HD13      LEU  82 -30.469   1.927  -0.532
  652   1HD2  LEU  82          HD21      LEU  82 -27.736   2.603   1.926
  653   2HD2  LEU  82          HD22      LEU  82 -29.434   2.929   1.577
  654   3HD2  LEU  82          HD23      LEU  82 -28.171   3.649   0.575
  655    H    ALA  83           HN       ALA  83 -28.139  -0.385   4.645
  656    HA   ALA  83           HA       ALA  83 -29.040  -3.147   4.522
  657   1HB   ALA  83          HB1       ALA  83 -28.344  -1.416   6.902
  658   2HB   ALA  83          HB2       ALA  83 -27.268  -2.577   6.125
  659   3HB   ALA  83          HB3       ALA  83 -28.719  -3.139   6.953
  660    H    ALA  84           HN       ALA  84 -31.069  -2.925   3.759
  661    HA   ALA  84           HA       ALA  84 -33.133  -2.323   5.608
  662   1HB   ALA  84          HB1       ALA  84 -32.660  -0.023   4.873
  663   2HB   ALA  84          HB2       ALA  84 -34.225  -0.564   4.266
  664   3HB   ALA  84          HB3       ALA  84 -32.830  -0.522   3.189
  665    HA   PRO  85           HA       PRO  85 -34.883  -5.461   2.979
  666   1HB   PRO  85          HB2       PRO  85 -37.493  -4.272   3.754
  667   2HB   PRO  85          HB1       PRO  85 -36.916  -5.931   3.947
  668   1HG   PRO  85          HG2       PRO  85 -37.104  -4.321   6.046
  669   2HG   PRO  85          HG1       PRO  85 -35.733  -5.434   5.882
  670   1HD   PRO  85          HD2       PRO  85 -35.859  -2.495   5.354
  671   2HD   PRO  85          HD1       PRO  85 -34.582  -3.446   6.146
  672    H    LYS  86           HN       LYS  86 -35.896  -5.643   0.973
  673    HA   LYS  86           HA       LYS  86 -35.896  -3.159  -0.541
  674   1HB   LYS  86          HB2       LYS  86 -36.237  -6.004  -1.521
  675   2HB   LYS  86          HB1       LYS  86 -36.020  -4.586  -2.539
  676   1HG   LYS  86          HG2       LYS  86 -34.011  -5.703  -0.589
  677   2HG   LYS  86          HG1       LYS  86 -33.950  -5.830  -2.347
  678   1HD   LYS  86          HD2       LYS  86 -33.717  -3.429  -2.548
  679   2HD   LYS  86          HD1       LYS  86 -33.912  -3.235  -0.804
  680   1HE   LYS  86          HE2       LYS  86 -31.853  -4.562  -0.466
  681   2HE   LYS  86          HE1       LYS  86 -31.653  -4.654  -2.215
  682   1HZ   LYS  86          HZ1       LYS  86 -31.744  -2.136  -0.652
  683   2HZ   LYS  86          HZ2       LYS  86 -31.381  -2.275  -2.310
  684   3HZ   LYS  86          HZ3       LYS  86 -30.323  -2.884  -1.166
  685    H    SER  87           HN       SER  87 -38.115  -5.572   0.571
  686    HA   SER  87           HA       SER  87 -40.361  -4.449  -0.816
  687   1HB   SER  87          HB2       SER  87 -40.305  -6.852  -0.217
  688   2HB   SER  87          HB1       SER  87 -40.190  -6.429   1.488
  689    HG   SER  87           HG       SER  87 -42.335  -6.986   0.792
  690    H    LYS  88           HN       LYS  88 -41.348  -2.636  -0.148
  691    HA   LYS  88           HA       LYS  88 -40.681  -1.717   2.538
  692   1HB   LYS  88          HB2       LYS  88 -41.384   0.581   1.737
  693   2HB   LYS  88          HB1       LYS  88 -39.926  -0.084   1.035
  694   1HG   LYS  88          HG2       LYS  88 -41.145   1.041  -0.683
  695   2HG   LYS  88          HG1       LYS  88 -41.242  -0.683  -0.994
  696   1HD   LYS  88          HD2       LYS  88 -43.389   0.382  -1.429
  697   2HD   LYS  88          HD1       LYS  88 -43.524  -0.698  -0.039
  698   1HE   LYS  88          HE2       LYS  88 -43.348   1.222   1.468
  699   2HE   LYS  88          HE1       LYS  88 -43.189   2.300   0.082
  700   1HZ   LYS  88          HZ1       LYS  88 -45.559   0.587   0.615
  701   2HZ   LYS  88          HZ2       LYS  88 -45.418   1.728  -0.609
  702   3HZ   LYS  88          HZ3       LYS  88 -45.454   2.218   1.011
  703    H    ASN  89           HN       ASN  89 -42.201  -0.426   3.728
  704    HA   ASN  89           HA       ASN  89 -44.998  -0.683   3.213
  705   1HB   ASN  89          HB2       ASN  89 -44.566  -2.868   4.318
  706   2HB   ASN  89          HB1       ASN  89 -43.780  -2.036   5.657
  707   1HD2  ASN  89          HD21      ASN  89 -45.039  -0.997   7.182
  708   2HD2  ASN  89          HD22      ASN  89 -46.755  -1.114   7.259
  Start of MODEL   12
    1   1H    GLY   1          HT1       GLY   1 -11.940   9.507  16.048
    2   2H    GLY   1          HT2       GLY   1 -13.270   8.930  16.960
    3   3H    GLY   1          HT3       GLY   1 -13.448  10.263  15.923
    4   1HA   GLY   1          HA1       GLY   1 -12.824   7.522  15.057
    5   2HA   GLY   1          HA2       GLY   1 -14.402   8.302  14.965
    6    H    ASP   2           HN       ASP   2 -11.452   7.787  13.473
    7    HA   ASP   2           HA       ASP   2 -11.628  10.117  11.730
    8   1HB   ASP   2          HB2       ASP   2  -9.623   7.840  11.811
    9   2HB   ASP   2          HB1       ASP   2  -9.541   9.197  10.698
   10    H    GLY   3           HN       GLY   3 -12.897   7.017  11.853
   11   1HA   GLY   3          HA2       GLY   3 -14.296   6.029  10.273
   12   2HA   GLY   3          HA1       GLY   3 -13.636   7.106   9.032
   13    H    GLU   4           HN       GLU   4 -11.332   6.811   8.589
   14    HA   GLU   4           HA       GLU   4 -10.171   4.302   9.277
   15   1HB   GLU   4          HB2       GLU   4 -11.423   3.778   7.182
   16   2HB   GLU   4          HB1       GLU   4 -10.545   5.058   6.358
   17   1HG   GLU   4          HG2       GLU   4  -9.693   2.741   5.946
   18   2HG   GLU   4          HG1       GLU   4  -8.487   3.879   6.543
   19    H    ALA   5           HN       ALA   5  -8.115   4.561   9.606
   20    HA   ALA   5           HA       ALA   5  -7.002   7.209   9.056
   21   1HB   ALA   5          HB1       ALA   5  -5.421   6.742  10.848
   22   2HB   ALA   5          HB2       ALA   5  -6.092   5.124  11.038
   23   3HB   ALA   5          HB3       ALA   5  -7.079   6.541  11.409
   24    H    GLN   6           HN       GLN   6  -6.839   3.967   8.072
   25    HA   GLN   6           HA       GLN   6  -4.142   4.025   7.156
   26   1HB   GLN   6          HB2       GLN   6  -5.250   1.886   7.613
   27   2HB   GLN   6          HB1       GLN   6  -6.474   2.239   6.403
   28   1HG   GLN   6          HG2       GLN   6  -4.810   2.114   4.641
   29   2HG   GLN   6          HG1       GLN   6  -3.540   1.862   5.837
   30   1HE2  GLN   6          HE21      GLN   6  -3.389  -0.124   6.852
   31   2HE2  GLN   6          HE22      GLN   6  -4.182  -1.531   6.236
   32    H    ARG   7           HN       ARG   7  -3.439   4.997   5.477
   33    HA   ARG   7           HA       ARG   7  -5.337   6.212   3.569
   34   1HB   ARG   7          HB2       ARG   7  -3.641   7.921   3.221
   35   2HB   ARG   7          HB1       ARG   7  -3.978   7.791   4.940
   36   1HG   ARG   7          HG2       ARG   7  -1.937   6.347   5.130
   37   2HG   ARG   7          HG1       ARG   7  -1.586   6.746   3.452
   38   1HD   ARG   7          HD2       ARG   7  -1.795   8.689   5.762
   39   2HD   ARG   7          HD1       ARG   7  -0.318   8.182   4.955
   40    HE   ARG   7           HE       ARG   7  -2.282   9.441   3.239
   41   1HH1  ARG   7          HH11      ARG   7   0.687   9.853   5.117
   42   2HH1  ARG   7          HH12      ARG   7   1.047  11.400   4.548
   43   1HH2  ARG   7          HH21      ARG   7  -1.778  11.599   2.368
   44   2HH2  ARG   7          HH22      ARG   7  -0.428  12.438   2.989
   45    H    ASP   8           HN       ASP   8  -3.762   6.758   1.501
   46    HA   ASP   8           HA       ASP   8  -3.394   4.315   0.146
   47   1HB   ASP   8          HB2       ASP   8  -1.903   6.886  -0.469
   48   2HB   ASP   8          HB1       ASP   8  -2.214   5.543  -1.556
   49    H    LEU   9           HN       LEU   9  -1.773   2.893   0.272
   50    HA   LEU   9           HA       LEU   9   0.187   3.103   2.235
   51   1HB   LEU   9          HB2       LEU   9   0.103   1.258  -0.128
   52   2HB   LEU   9          HB1       LEU   9   1.230   1.113   1.201
   53    HG   LEU   9           HG       LEU   9  -1.757   0.810   1.340
   54   1HD1  LEU   9          HD11      LEU   9  -0.616  -1.056   0.309
   55   2HD1  LEU   9          HD12      LEU   9  -1.198  -1.505   1.914
   56   3HD1  LEU   9          HD13      LEU   9   0.509  -1.144   1.662
   57   1HD2  LEU   9          HD21      LEU   9   0.314   0.587   3.527
   58   2HD2  LEU   9          HD22      LEU   9  -1.395   0.193   3.690
   59   3HD2  LEU   9          HD23      LEU   9  -0.899   1.859   3.380
   60    H    VAL  10           HN       VAL  10   0.297   4.129  -1.044
   61    HA   VAL  10           HA       VAL  10   3.125   4.299  -1.226
   62    HB   VAL  10           HB       VAL  10   0.914   5.571  -2.865
   63   1HG1  VAL  10          HG11      VAL  10   2.899   7.050  -2.981
   64   2HG1  VAL  10          HG12      VAL  10   2.612   6.216  -4.509
   65   3HG1  VAL  10          HG13      VAL  10   3.888   5.661  -3.430
   66   1HG2  VAL  10          HG21      VAL  10   1.694   3.968  -4.526
   67   2HG2  VAL  10          HG22      VAL  10   1.148   3.195  -3.034
   68   3HG2  VAL  10          HG23      VAL  10   2.872   3.355  -3.367
   69    H    LYS  11           HN       LYS  11   0.789   6.256   0.333
   70    HA   LYS  11           HA       LYS  11   2.383   8.661   0.330
   71   1HB   LYS  11          HB2       LYS  11   0.106   7.930   2.179
   72   2HB   LYS  11          HB1       LYS  11   0.735   9.527   1.805
   73   1HG   LYS  11          HG2       LYS  11  -0.673   7.740  -0.172
   74   2HG   LYS  11          HG1       LYS  11  -1.447   9.020   0.752
   75   1HD   LYS  11          HD2       LYS  11  -0.017  10.673  -0.316
   76   2HD   LYS  11          HD1       LYS  11   0.818   9.394  -1.205
   77   1HE   LYS  11          HE2       LYS  11  -0.890  10.558  -2.572
   78   2HE   LYS  11          HE1       LYS  11  -1.215   8.836  -2.392
   79   1HZ   LYS  11          HZ1       LYS  11  -2.471  10.830  -0.601
   80   2HZ   LYS  11          HZ2       LYS  11  -3.055   9.271  -0.995
   81   3HZ   LYS  11          HZ3       LYS  11  -3.109  10.521  -2.110
   82    H    ALA  12           HN       ALA  12   2.474   5.711   1.841
   83    HA   ALA  12           HA       ALA  12   3.910   6.707   4.197
   84   1HB   ALA  12          HB1       ALA  12   2.582   4.028   3.728
   85   2HB   ALA  12          HB2       ALA  12   1.942   5.339   4.718
   86   3HB   ALA  12          HB3       ALA  12   3.424   4.513   5.200
   87    H    VAL  13           HN       VAL  13   3.865   3.923   1.997
   88    HA   VAL  13           HA       VAL  13   6.459   3.023   2.538
   89    HB   VAL  13           HB       VAL  13   4.700   2.491   0.130
   90   1HG1  VAL  13          HG11      VAL  13   7.001   1.986  -0.399
   91   2HG1  VAL  13          HG12      VAL  13   6.086   0.488  -0.219
   92   3HG1  VAL  13          HG13      VAL  13   7.168   1.027   1.073
   93   1HG2  VAL  13          HG21      VAL  13   5.148   0.908   2.659
   94   2HG2  VAL  13          HG22      VAL  13   4.160   0.399   1.292
   95   3HG2  VAL  13          HG23      VAL  13   3.693   1.813   2.240
   96    H    ALA  14           HN       ALA  14   5.263   4.973  -0.225
   97    HA   ALA  14           HA       ALA  14   7.855   5.133  -1.392
   98   1HB   ALA  14          HB1       ALA  14   6.905   6.920  -2.843
   99   2HB   ALA  14          HB2       ALA  14   5.455   6.933  -1.825
  100   3HB   ALA  14          HB3       ALA  14   5.852   5.500  -2.759
  101    H    HIS  15           HN       HIS  15   6.154   6.867   1.022
  102    HA   HIS  15           HA       HIS  15   7.768   9.192   1.018
  103   1HB   HIS  15          HB2       HIS  15   5.453   8.918   2.091
  104   2HB   HIS  15          HB1       HIS  15   6.268   8.091   3.407
  105    HD1  HIS  15           HD1      HIS  15   5.392  11.456   2.159
  106    HD2  HIS  15           HD2      HIS  15   8.048   9.817   4.921
  107    HE1  HIS  15           HE1      HIS  15   6.212  13.357   3.526
  108    HE2  HIS  15           HE2      HIS  15   7.879  12.382   5.121
  109    H    ILE  16           HN       ILE  16   8.141   6.010   2.338
  110    HA   ILE  16           HA       ILE  16  10.270   6.534   4.159
  111    HB   ILE  16           HB       ILE  16   9.582   3.968   2.670
  112   1HG1  ILE  16          HG12      ILE  16   7.719   4.679   4.034
  113   2HG1  ILE  16          HG11      ILE  16   8.477   3.274   4.768
  114   1HG2  ILE  16          HG21      ILE  16  11.863   3.864   3.497
  115   2HG2  ILE  16          HG22      ILE  16  10.827   2.776   4.413
  116   3HG2  ILE  16          HG23      ILE  16  11.317   4.319   5.111
  117   1HD1  ILE  16          HD11      ILE  16   9.609   4.736   6.370
  118   2HD1  ILE  16          HD12      ILE  16   7.852   4.911   6.442
  119   3HD1  ILE  16          HD13      ILE  16   8.829   6.135   5.632
  120    H    LEU  17           HN       LEU  17  10.012   5.974   0.752
  121    HA   LEU  17           HA       LEU  17  12.860   5.669   0.270
  122   1HB   LEU  17          HB2       LEU  17  10.553   6.015  -1.639
  123   2HB   LEU  17          HB1       LEU  17  12.191   5.613  -2.091
  124    HG   LEU  17           HG       LEU  17  10.393   3.854  -0.433
  125   1HD1  LEU  17          HD11      LEU  17  11.174   3.704  -3.338
  126   2HD1  LEU  17          HD12      LEU  17   9.578   4.120  -2.716
  127   3HD1  LEU  17          HD13      LEU  17  10.234   2.502  -2.457
  128   1HD2  LEU  17          HD21      LEU  17  12.773   3.524  -0.010
  129   2HD2  LEU  17          HD22      LEU  17  13.062   3.337  -1.739
  130   3HD2  LEU  17          HD23      LEU  17  12.083   2.153  -0.875
  131    H    GLY  18           HN       GLY  18  10.771   8.208   0.815
  132   1HA   GLY  18          HA2       GLY  18  11.311  10.480   0.829
  133   2HA   GLY  18          HA1       GLY  18  12.686  10.136  -0.214
  134    H    ILE  19           HN       ILE  19   9.655   8.794  -1.115
  135    HA   ILE  19           HA       ILE  19   9.217  10.927  -3.033
  136    HB   ILE  19           HB       ILE  19   8.291   9.026  -4.483
  137   1HG1  ILE  19          HG12      ILE  19  10.314   7.440  -2.899
  138   2HG1  ILE  19          HG11      ILE  19   8.571   7.211  -2.888
  139   1HG2  ILE  19          HG21      ILE  19  11.275   9.463  -4.195
  140   2HG2  ILE  19          HG22      ILE  19  10.164  10.435  -5.163
  141   3HG2  ILE  19          HG23      ILE  19  10.504   8.763  -5.619
  142   1HD1  ILE  19          HD11      ILE  19   9.673   5.530  -4.249
  143   2HD1  ILE  19          HD12      ILE  19  10.405   6.790  -5.238
  144   3HD1  ILE  19          HD13      ILE  19   8.657   6.568  -5.250
  145    H    ARG  20           HN       ARG  20   7.004   9.931  -4.205
  146    HA   ARG  20           HA       ARG  20   4.910   8.924  -2.655
  147   1HB   ARG  20          HB2       ARG  20   5.230  11.134  -1.413
  148   2HB   ARG  20          HB1       ARG  20   4.916  11.889  -2.985
  149   1HG   ARG  20          HG2       ARG  20   2.710  10.657  -2.993
  150   2HG   ARG  20          HG1       ARG  20   3.002  10.331  -1.281
  151   1HD   ARG  20          HD2       ARG  20   1.627  12.301  -1.538
  152   2HD   ARG  20          HD1       ARG  20   3.204  12.742  -0.884
  153    HE   ARG  20           HE       ARG  20   3.165  12.928  -3.718
  154   1HH1  ARG  20          HH11      ARG  20   2.246  14.736  -0.788
  155   2HH1  ARG  20          HH12      ARG  20   2.273  16.235  -1.615
  156   1HH2  ARG  20          HH21      ARG  20   3.204  14.940  -4.752
  157   2HH2  ARG  20          HH22      ARG  20   2.837  16.369  -3.896
  158    H    ASP  21           HN       ASP  21   5.891  11.511  -4.757
  159    HA   ASP  21           HA       ASP  21   3.841  11.072  -6.707
  160   1HB   ASP  21          HB2       ASP  21   6.381  12.710  -6.918
  161   2HB   ASP  21          HB1       ASP  21   4.931  12.869  -7.901
  162    H    LEU  22           HN       LEU  22   4.068   9.690  -8.300
  163    HA   LEU  22           HA       LEU  22   6.742   8.557  -8.809
  164   1HB   LEU  22          HB2       LEU  22   4.083   7.169  -8.605
  165   2HB   LEU  22          HB1       LEU  22   5.356   6.544  -9.631
  166    HG   LEU  22           HG       LEU  22   5.177   5.408  -7.432
  167   1HD1  LEU  22          HD11      LEU  22   7.538   5.301  -7.022
  168   2HD1  LEU  22          HD12      LEU  22   7.759   6.827  -7.866
  169   3HD1  LEU  22          HD13      LEU  22   7.226   5.409  -8.762
  170   1HD2  LEU  22          HD21      LEU  22   6.194   8.028  -6.301
  171   2HD2  LEU  22          HD22      LEU  22   6.094   6.510  -5.422
  172   3HD2  LEU  22          HD23      LEU  22   4.629   7.302  -5.984
  173    H    ALA  23           HN       ALA  23   5.021  10.722  -9.947
  174    HA   ALA  23           HA       ALA  23   4.287   9.817 -12.545
  175   1HB   ALA  23          HB1       ALA  23   4.617  12.643 -11.548
  176   2HB   ALA  23          HB2       ALA  23   3.130  11.698 -11.479
  177   3HB   ALA  23          HB3       ALA  23   3.811  12.157 -13.039
  178    H    GLY  24           HN       GLY  24   7.097  10.784 -11.103
  179   1HA   GLY  24          HA2       GLY  24   8.456  10.461 -13.655
  180   2HA   GLY  24          HA1       GLY  24   8.873  11.893 -12.692
  181    H    ILE  25           HN       ILE  25   8.090   8.718 -11.482
  182    HA   ILE  25           HA       ILE  25  10.897   8.240 -10.808
  183    HB   ILE  25           HB       ILE  25   8.524   7.823  -8.966
  184   1HG1  ILE  25          HG12      ILE  25   9.216  10.199  -9.062
  185   2HG1  ILE  25          HG11      ILE  25   9.457   9.493  -7.473
  186   1HG2  ILE  25          HG21      ILE  25  11.455   7.267  -8.469
  187   2HG2  ILE  25          HG22      ILE  25  10.184   6.062  -8.679
  188   3HG2  ILE  25          HG23      ILE  25  10.175   7.112  -7.263
  189   1HD1  ILE  25          HD11      ILE  25  11.300  10.930  -8.106
  190   2HD1  ILE  25          HD12      ILE  25  11.580   9.938  -9.544
  191   3HD1  ILE  25          HD13      ILE  25  11.817   9.251  -7.933
  192    H    ASN  26           HN       ASN  26  11.389   6.085 -11.146
  193    HA   ASN  26           HA       ASN  26   9.534   4.630 -12.729
  194   1HB   ASN  26          HB2       ASN  26  12.098   3.604 -11.493
  195   2HB   ASN  26          HB1       ASN  26  11.148   2.760 -12.705
  196   1HD2  ASN  26          HD21      ASN  26  11.126   3.592 -14.881
  197   2HD2  ASN  26          HD22      ASN  26  12.358   4.675 -15.390
  198    H    LEU  27           HN       LEU  27   7.898   3.638 -12.118
  199    HA   LEU  27           HA       LEU  27   7.710   2.525  -9.421
  200   1HB   LEU  27          HB2       LEU  27   5.202   2.555  -9.953
  201   2HB   LEU  27          HB1       LEU  27   5.995   4.085  -9.672
  202    HG   LEU  27           HG       LEU  27   6.082   4.369 -12.195
  203   1HD1  LEU  27          HD11      LEU  27   5.761   2.089 -12.875
  204   2HD1  LEU  27          HD12      LEU  27   4.497   3.132 -13.534
  205   3HD1  LEU  27          HD13      LEU  27   4.146   2.081 -12.157
  206   1HD2  LEU  27          HD21      LEU  27   3.380   4.216 -10.867
  207   2HD2  LEU  27          HD22      LEU  27   3.740   5.095 -12.348
  208   3HD2  LEU  27          HD23      LEU  27   4.497   5.576 -10.829
  209    H    ASP  28           HN       ASP  28   8.756   1.510 -12.103
  210    HA   ASP  28           HA       ASP  28   7.330  -1.053 -12.192
  211   1HB   ASP  28          HB2       ASP  28   9.533   0.017 -13.976
  212   2HB   ASP  28          HB1       ASP  28   8.826  -1.581 -14.141
  213    H    SER  29           HN       SER  29   9.623   0.218 -10.350
  214    HA   SER  29           HA       SER  29  11.601  -1.894 -10.396
  215   1HB   SER  29          HB2       SER  29  11.204   0.290  -8.344
  216   2HB   SER  29          HB1       SER  29  12.663  -0.639  -8.650
  217    HG   SER  29           HG       SER  29  12.183   0.433 -10.949
  218    H    SER  30           HN       SER  30  11.770  -3.521  -8.809
  219    HA   SER  30           HA       SER  30   9.389  -4.185  -7.346
  220   1HB   SER  30          HB2       SER  30  12.163  -5.392  -7.151
  221   2HB   SER  30          HB1       SER  30  10.651  -6.130  -6.619
  222    HG   SER  30           HG       SER  30   9.962  -6.028  -8.808
  223    H    LEU  31           HN       LEU  31   9.072  -3.976  -5.103
  224    HA   LEU  31           HA       LEU  31  10.252  -1.873  -3.738
  225   1HB   LEU  31          HB2       LEU  31   8.041  -3.115  -3.286
  226   2HB   LEU  31          HB1       LEU  31   8.998  -4.258  -2.372
  227    HG   LEU  31           HG       LEU  31   9.667  -2.408  -0.833
  228   1HD1  LEU  31          HD11      LEU  31   7.637  -0.881  -2.420
  229   2HD1  LEU  31          HD12      LEU  31   9.378  -0.560  -2.408
  230   3HD1  LEU  31          HD13      LEU  31   8.415  -0.317  -0.942
  231   1HD2  LEU  31          HD21      LEU  31   6.698  -2.769  -1.189
  232   2HD2  LEU  31          HD22      LEU  31   7.510  -2.195   0.270
  233   3HD2  LEU  31          HD23      LEU  31   7.769  -3.845  -0.294
  234    H    ALA  32           HN       ALA  32  11.130  -5.208  -3.897
  235    HA   ALA  32           HA       ALA  32  12.935  -5.378  -1.793
  236   1HB   ALA  32          HB1       ALA  32  13.940  -7.274  -2.990
  237   2HB   ALA  32          HB2       ALA  32  13.077  -6.794  -4.452
  238   3HB   ALA  32          HB3       ALA  32  12.178  -7.334  -3.035
  239    H    ASP  33           HN       ASP  33  13.325  -4.375  -5.110
  240    HA   ASP  33           HA       ASP  33  16.150  -4.176  -5.221
  241   1HB   ASP  33          HB2       ASP  33  14.724  -4.447  -7.217
  242   2HB   ASP  33          HB1       ASP  33  13.980  -2.897  -6.894
  243    H    LEU  34           HN       LEU  34  13.539  -2.047  -4.469
  244    HA   LEU  34           HA       LEU  34  14.837   0.446  -4.460
  245   1HB   LEU  34          HB2       LEU  34  12.594  -0.405  -2.653
  246   2HB   LEU  34          HB1       LEU  34  12.978   1.223  -3.186
  247    HG   LEU  34           HG       LEU  34  11.971  -1.008  -4.932
  248   1HD1  LEU  34          HD11      LEU  34  10.583   1.449  -3.922
  249   2HD1  LEU  34          HD12      LEU  34  10.360  -0.217  -3.377
  250   3HD1  LEU  34          HD13      LEU  34   9.917   0.227  -5.027
  251   1HD2  LEU  34          HD21      LEU  34  13.404   0.496  -6.142
  252   2HD2  LEU  34          HD22      LEU  34  12.465   1.888  -5.560
  253   3HD2  LEU  34          HD23      LEU  34  11.715   0.676  -6.615
  254    H    GLY  35           HN       GLY  35  14.184  -1.847  -1.871
  255   1HA   GLY  35          HA2       GLY  35  16.552  -1.736  -0.546
  256   2HA   GLY  35          HA1       GLY  35  15.706  -0.311   0.033
  257    H    LEU  36           HN       LEU  36  13.435  -2.752  -0.641
  258    HA   LEU  36           HA       LEU  36  13.173  -3.140   2.140
  259   1HB   LEU  36          HB2       LEU  36  11.107  -3.014   1.274
  260   2HB   LEU  36          HB1       LEU  36  11.445  -3.904  -0.172
  261    HG   LEU  36           HG       LEU  36  11.359  -6.022   1.146
  262   1HD1  LEU  36          HD11      LEU  36  10.616  -4.246   3.463
  263   2HD1  LEU  36          HD12      LEU  36  12.111  -5.174   3.303
  264   3HD1  LEU  36          HD13      LEU  36  10.562  -6.007   3.448
  265   1HD2  LEU  36          HD21      LEU  36   8.974  -4.262   1.603
  266   2HD2  LEU  36          HD22      LEU  36   8.989  -6.030   1.554
  267   3HD2  LEU  36          HD23      LEU  36   9.364  -5.088   0.103
  268    H    ASP  37           HN       ASP  37  14.272  -4.213   3.197
  269    HA   ASP  37           HA       ASP  37  14.805  -7.038   2.619
  270   1HB   ASP  37          HB2       ASP  37  16.924  -6.032   2.228
  271   2HB   ASP  37          HB1       ASP  37  16.737  -4.929   3.585
  272    H    SER  38           HN       SER  38  14.239  -4.422   4.896
  273    HA   SER  38           HA       SER  38  13.289  -6.357   6.816
  274   1HB   SER  38          HB2       SER  38  15.574  -6.102   7.520
  275   2HB   SER  38          HB1       SER  38  15.488  -4.353   7.371
  276    HG   SER  38           HG       SER  38  15.098  -4.421   9.346
  277    H    LEU  39           HN       LEU  39  13.988  -2.870   7.085
  278    HA   LEU  39           HA       LEU  39  11.705  -2.326   8.601
  279   1HB   LEU  39          HB2       LEU  39  13.776  -1.009   8.568
  280   2HB   LEU  39          HB1       LEU  39  13.295  -0.349   7.017
  281    HG   LEU  39           HG       LEU  39  11.312  -0.072   9.185
  282   1HD1  LEU  39          HD11      LEU  39  13.893   1.449   9.191
  283   2HD1  LEU  39          HD12      LEU  39  13.345   0.198  10.318
  284   3HD1  LEU  39          HD13      LEU  39  12.482   1.744  10.244
  285   1HD2  LEU  39          HD21      LEU  39  11.086   2.173   8.224
  286   2HD2  LEU  39          HD22      LEU  39  10.939   0.927   6.995
  287   3HD2  LEU  39          HD23      LEU  39  12.441   1.852   7.133
  288    H    MET  40           HN       MET  40  12.198  -2.062   5.127
  289    HA   MET  40           HA       MET  40   9.794  -0.556   4.650
  290   1HB   MET  40          HB2       MET  40  11.556  -2.047   2.718
  291   2HB   MET  40          HB1       MET  40  10.225  -0.990   2.264
  292   1HG   MET  40          HG2       MET  40  11.360   0.885   3.343
  293   2HG   MET  40          HG1       MET  40  12.698  -0.181   3.765
  294   1HE   MET  40          HE1       MET  40  14.295   2.041   1.026
  295   2HE   MET  40          HE2       MET  40  14.441   1.395   2.661
  296   3HE   MET  40          HE3       MET  40  13.147   2.528   2.273
  297    H    GLY  41           HN       GLY  41   9.905  -3.444   5.782
  298   1HA   GLY  41          HA2       GLY  41   7.440  -4.229   4.381
  299   2HA   GLY  41          HA1       GLY  41   8.675  -5.425   4.754
  300    H    VAL  42           HN       VAL  42   9.297  -4.109   7.350
  301    HA   VAL  42           HA       VAL  42   7.492  -5.578   8.938
  302    HB   VAL  42           HB       VAL  42   9.436  -3.422   9.841
  303   1HG1  VAL  42          HG11      VAL  42   8.060  -5.575  11.446
  304   2HG1  VAL  42          HG12      VAL  42   7.738  -3.842  11.533
  305   3HG1  VAL  42          HG13      VAL  42   9.300  -4.477  12.054
  306   1HG2  VAL  42          HG21      VAL  42  10.581  -5.242   8.699
  307   2HG2  VAL  42          HG22      VAL  42   9.770  -6.418   9.731
  308   3HG2  VAL  42          HG23      VAL  42  10.926  -5.285  10.428
  309    H    GLU  43           HN       GLU  43   7.896  -2.027   8.613
  310    HA   GLU  43           HA       GLU  43   5.683  -1.494  10.246
  311   1HB   GLU  43          HB2       GLU  43   7.430   0.205   9.685
  312   2HB   GLU  43          HB1       GLU  43   6.723   0.339   8.077
  313   1HG   GLU  43          HG2       GLU  43   4.622   1.086   9.025
  314   2HG   GLU  43          HG1       GLU  43   5.259   0.888  10.650
  315    H    VAL  44           HN       VAL  44   6.003  -2.102   6.861
  316    HA   VAL  44           HA       VAL  44   3.438  -1.366   5.944
  317    HB   VAL  44           HB       VAL  44   5.291  -3.546   4.918
  318   1HG1  VAL  44          HG11      VAL  44   3.012  -3.870   4.118
  319   2HG1  VAL  44          HG12      VAL  44   4.071  -3.350   2.805
  320   3HG1  VAL  44          HG13      VAL  44   2.956  -2.201   3.551
  321   1HG2  VAL  44          HG21      VAL  44   5.979  -1.876   3.273
  322   2HG2  VAL  44          HG22      VAL  44   6.320  -1.349   4.919
  323   3HG2  VAL  44          HG23      VAL  44   4.936  -0.682   4.047
  324    H    ARG  45           HN       ARG  45   4.684  -4.505   7.035
  325    HA   ARG  45           HA       ARG  45   2.331  -5.965   6.957
  326   1HB   ARG  45          HB2       ARG  45   4.819  -6.118   8.580
  327   2HB   ARG  45          HB1       ARG  45   3.459  -7.108   9.079
  328   1HG   ARG  45          HG2       ARG  45   3.430  -8.220   6.952
  329   2HG   ARG  45          HG1       ARG  45   4.667  -7.130   6.327
  330   1HD   ARG  45          HD2       ARG  45   5.168  -8.787   8.766
  331   2HD   ARG  45          HD1       ARG  45   5.362  -9.475   7.155
  332    HE   ARG  45           HE       ARG  45   6.827  -7.347   6.878
  333   1HH1  ARG  45          HH11      ARG  45   6.683  -9.068   9.940
  334   2HH1  ARG  45          HH12      ARG  45   8.368  -9.216  10.145
  335   1HH2  ARG  45          HH21      ARG  45   9.232  -7.599   7.101
  336   2HH2  ARG  45          HH22      ARG  45   9.836  -8.411   8.451
  337    H    GLN  46           HN       GLN  46   3.546  -3.866   9.493
  338    HA   GLN  46           HA       GLN  46   1.469  -4.384  11.329
  339   1HB   GLN  46          HB2       GLN  46   3.238  -1.958  11.100
  340   2HB   GLN  46          HB1       GLN  46   2.227  -2.352  12.484
  341   1HG   GLN  46          HG2       GLN  46   3.502  -4.428  12.792
  342   2HG   GLN  46          HG1       GLN  46   4.539  -3.962  11.445
  343   1HE2  GLN  46          HE21      GLN  46   3.266  -1.723  13.805
  344   2HE2  GLN  46          HE22      GLN  46   4.794  -1.364  14.532
  345    H    ILE  47           HN       ILE  47   1.616  -2.299   8.564
  346    HA   ILE  47           HA       ILE  47  -0.653  -0.727   9.391
  347    HB   ILE  47           HB       ILE  47   0.521  -1.018   6.590
  348   1HG1  ILE  47          HG12      ILE  47   0.952   1.168   8.632
  349   2HG1  ILE  47          HG11      ILE  47   2.125  -0.089   8.258
  350   1HG2  ILE  47          HG21      ILE  47  -1.782  -0.206   6.577
  351   2HG2  ILE  47          HG22      ILE  47  -0.668   1.077   6.108
  352   3HG2  ILE  47          HG23      ILE  47  -1.355   1.055   7.735
  353   1HD1  ILE  47          HD11      ILE  47   2.699   1.997   7.157
  354   2HD1  ILE  47          HD12      ILE  47   1.121   2.036   6.369
  355   3HD1  ILE  47          HD13      ILE  47   2.278   0.769   5.961
  356    H    LEU  48           HN       LEU  48  -0.086  -3.275   7.008
  357    HA   LEU  48           HA       LEU  48  -2.832  -3.390   6.273
  358   1HB   LEU  48          HB2       LEU  48  -0.514  -5.141   5.530
  359   2HB   LEU  48          HB1       LEU  48  -2.143  -5.468   4.985
  360    HG   LEU  48           HG       LEU  48  -1.007  -4.394   3.222
  361   1HD1  LEU  48          HD11      LEU  48  -2.791  -2.387   4.558
  362   2HD1  LEU  48          HD12      LEU  48  -3.291  -3.699   3.490
  363   3HD1  LEU  48          HD13      LEU  48  -2.316  -2.371   2.861
  364   1HD2  LEU  48          HD21      LEU  48  -0.260  -2.196   5.139
  365   2HD2  LEU  48          HD22      LEU  48   0.041  -2.188   3.401
  366   3HD2  LEU  48          HD23      LEU  48   0.834  -3.382   4.429
  367    H    GLU  49           HN       GLU  49  -0.943  -5.237   8.578
  368    HA   GLU  49           HA       GLU  49  -3.092  -7.149   8.794
  369   1HB   GLU  49          HB2       GLU  49  -0.707  -7.848   8.913
  370   2HB   GLU  49          HB1       GLU  49  -0.538  -6.940  10.405
  371   1HG   GLU  49          HG2       GLU  49  -2.116  -8.411  11.509
  372   2HG   GLU  49          HG1       GLU  49  -2.397  -9.275  10.003
  373    H    ARG  50           HN       ARG  50  -2.358  -4.149  10.219
  374    HA   ARG  50           HA       ARG  50  -3.946  -4.888  12.575
  375   1HB   ARG  50          HB2       ARG  50  -2.159  -2.502  12.251
  376   2HB   ARG  50          HB1       ARG  50  -3.173  -2.804  13.651
  377   1HG   ARG  50          HG2       ARG  50  -1.899  -4.881  14.072
  378   2HG   ARG  50          HG1       ARG  50  -0.849  -4.475  12.706
  379   1HD   ARG  50          HD2       ARG  50  -1.223  -2.929  15.266
  380   2HD   ARG  50          HD1       ARG  50   0.250  -3.710  14.685
  381    HE   ARG  50           HE       ARG  50  -0.565  -1.932  12.748
  382   1HH1  ARG  50          HH11      ARG  50   0.964  -1.815  15.955
  383   2HH1  ARG  50          HH12      ARG  50   1.366  -0.164  15.839
  384   1HH2  ARG  50          HH21      ARG  50   0.029   0.314  12.611
  385   2HH2  ARG  50          HH22      ARG  50   0.885   1.054  13.880
  386    H    GLU  51           HN       GLU  51  -3.797  -2.242  10.144
  387    HA   GLU  51           HA       GLU  51  -6.037  -0.876  11.261
  388   1HB   GLU  51          HB2       GLU  51  -5.109  -0.726   8.385
  389   2HB   GLU  51          HB1       GLU  51  -6.060   0.463   9.255
  390   1HG   GLU  51          HG2       GLU  51  -3.177  -0.241   9.714
  391   2HG   GLU  51          HG1       GLU  51  -3.808   1.244   9.009
  392    H    HIS  52           HN       HIS  52  -5.653  -3.272   8.787
  393    HA   HIS  52           HA       HIS  52  -8.524  -3.754   8.794
  394   1HB   HIS  52          HB2       HIS  52  -6.684  -3.519   6.401
  395   2HB   HIS  52          HB1       HIS  52  -8.125  -4.516   6.320
  396    HD1  HIS  52           HD1      HIS  52  -7.042  -1.195   5.423
  397    HD2  HIS  52           HD2      HIS  52 -10.513  -2.799   7.082
  398    HE1  HIS  52           HE1      HIS  52  -8.816   0.479   5.032
  399    HE2  HIS  52           HE2      HIS  52 -10.826  -0.392   6.237
  400    H    ASP  53           HN       ASP  53  -8.946  -6.108   8.333
  401    HA   ASP  53           HA       ASP  53  -6.737  -7.379   9.314
  402   1HB   ASP  53          HB2       ASP  53  -8.112  -9.469   9.698
  403   2HB   ASP  53          HB1       ASP  53  -8.619  -8.036  10.564
  404    H    LEU  54           HN       LEU  54  -5.452  -7.211   7.526
  405    HA   LEU  54           HA       LEU  54  -5.867  -9.325   5.518
  406   1HB   LEU  54          HB2       LEU  54  -4.533  -6.630   5.266
  407   2HB   LEU  54          HB1       LEU  54  -4.104  -7.946   4.208
  408    HG   LEU  54           HG       LEU  54  -6.459  -7.987   3.409
  409   1HD1  LEU  54          HD11      LEU  54  -7.564  -6.912   5.292
  410   2HD1  LEU  54          HD12      LEU  54  -7.874  -6.037   3.795
  411   3HD1  LEU  54          HD13      LEU  54  -6.701  -5.412   4.957
  412   1HD2  LEU  54          HD21      LEU  54  -6.213  -6.005   2.003
  413   2HD2  LEU  54          HD22      LEU  54  -4.709  -6.914   2.148
  414   3HD2  LEU  54          HD23      LEU  54  -4.930  -5.422   3.061
  415    H    VAL  55           HN       VAL  55  -3.926 -10.425   4.906
  416    HA   VAL  55           HA       VAL  55  -1.608  -9.873   6.585
  417    HB   VAL  55           HB       VAL  55  -2.481 -12.681   5.796
  418   1HG1  VAL  55          HG11      VAL  55  -0.089 -12.414   5.954
  419   2HG1  VAL  55          HG12      VAL  55  -0.664 -13.378   7.321
  420   3HG1  VAL  55          HG13      VAL  55  -0.252 -11.674   7.546
  421   1HG2  VAL  55          HG21      VAL  55  -2.602 -11.391   8.537
  422   2HG2  VAL  55          HG22      VAL  55  -2.938 -13.085   8.182
  423   3HG2  VAL  55          HG23      VAL  55  -3.986 -11.826   7.534
  424    H    LEU  56           HN       LEU  56  -0.460  -8.876   5.042
  425    HA   LEU  56           HA       LEU  56  -0.129 -10.261   2.484
  426   1HB   LEU  56          HB2       LEU  56   0.617  -7.424   3.183
  427   2HB   LEU  56          HB1       LEU  56   0.700  -8.149   1.596
  428    HG   LEU  56           HG       LEU  56  -1.817  -7.475   3.124
  429   1HD1  LEU  56          HD11      LEU  56  -0.733  -5.553   2.143
  430   2HD1  LEU  56          HD12      LEU  56  -2.222  -5.933   1.279
  431   3HD1  LEU  56          HD13      LEU  56  -0.661  -6.366   0.580
  432   1HD2  LEU  56          HD21      LEU  56  -2.103  -9.563   1.869
  433   2HD2  LEU  56          HD22      LEU  56  -1.546  -8.755   0.399
  434   3HD2  LEU  56          HD23      LEU  56  -3.049  -8.250   1.178
  435    HA   PRO  57           HA       PRO  57   3.707 -11.329   4.574
  436   1HB   PRO  57          HB2       PRO  57   3.983 -13.184   2.336
  437   2HB   PRO  57          HB1       PRO  57   3.820 -13.544   4.060
  438   1HG   PRO  57          HG2       PRO  57   1.857 -14.090   2.316
  439   2HG   PRO  57          HG1       PRO  57   1.499 -13.525   3.961
  440   1HD   PRO  57          HD2       PRO  57   1.569 -11.977   1.402
  441   2HD   PRO  57          HD1       PRO  57   0.338 -11.973   2.688
  442    H    ILE  58           HN       ILE  58   5.987 -11.627   3.818
  443    HA   ILE  58           HA       ILE  58   6.787  -9.435   2.234
  444    HB   ILE  58           HB       ILE  58   8.458 -11.778   3.249
  445   1HG1  ILE  58          HG12      ILE  58   9.540  -9.899   4.604
  446   2HG1  ILE  58          HG11      ILE  58   8.220  -8.895   4.012
  447   1HG2  ILE  58          HG21      ILE  58   9.493  -9.354   1.772
  448   2HG2  ILE  58          HG22      ILE  58   9.518 -11.013   1.187
  449   3HG2  ILE  58          HG23      ILE  58  10.482 -10.561   2.589
  450   1HD1  ILE  58          HD11      ILE  58   6.619 -10.306   5.126
  451   2HD1  ILE  58          HD12      ILE  58   7.821  -9.688   6.258
  452   3HD1  ILE  58          HD13      ILE  58   7.915 -11.356   5.693
  453    H    ARG  59           HN       ARG  59   6.245 -12.742   1.413
  454    HA   ARG  59           HA       ARG  59   7.308 -12.429  -1.181
  455   1HB   ARG  59          HB2       ARG  59   6.199 -14.606  -1.846
  456   2HB   ARG  59          HB1       ARG  59   7.360 -14.688  -0.550
  457   1HG   ARG  59          HG2       ARG  59   4.365 -14.722  -0.187
  458   2HG   ARG  59          HG1       ARG  59   5.385 -16.155  -0.285
  459   1HD   ARG  59          HD2       ARG  59   5.313 -14.048   1.865
  460   2HD   ARG  59          HD1       ARG  59   5.006 -15.768   2.012
  461    HE   ARG  59           HE       ARG  59   7.659 -15.290   1.109
  462   1HH1  ARG  59          HH11      ARG  59   5.641 -15.486   4.046
  463   2HH1  ARG  59          HH12      ARG  59   7.001 -15.444   5.084
  464   1HH2  ARG  59          HH21      ARG  59   9.502 -15.229   2.657
  465   2HH2  ARG  59          HH22      ARG  59   9.136 -15.328   4.321
  466    H    GLU  60           HN       GLU  60   4.688 -11.033  -0.019
  467    HA   GLU  60           HA       GLU  60   3.688 -10.584  -2.737
  468   1HB   GLU  60          HB2       GLU  60   2.522  -9.939  -0.013
  469   2HB   GLU  60          HB1       GLU  60   1.929  -9.182  -1.478
  470   1HG   GLU  60          HG2       GLU  60   1.915 -12.133  -0.915
  471   2HG   GLU  60          HG1       GLU  60   0.539 -11.043  -0.729
  472    H    VAL  61           HN       VAL  61   4.335  -8.842   0.252
  473    HA   VAL  61           HA       VAL  61   4.363  -6.284  -0.697
  474    HB   VAL  61           HB       VAL  61   5.915  -7.353   1.670
  475   1HG1  VAL  61          HG11      VAL  61   6.707  -5.135   1.065
  476   2HG1  VAL  61          HG12      VAL  61   5.777  -5.073   2.565
  477   3HG1  VAL  61          HG13      VAL  61   5.050  -4.529   1.053
  478   1HG2  VAL  61          HG21      VAL  61   3.537  -7.871   1.779
  479   2HG2  VAL  61          HG22      VAL  61   3.141  -6.178   1.489
  480   3HG2  VAL  61          HG23      VAL  61   3.964  -6.648   2.975
  481    H    ARG  62           HN       ARG  62   7.202  -8.409  -0.502
  482    HA   ARG  62           HA       ARG  62   9.023  -6.284  -1.071
  483   1HB   ARG  62          HB2       ARG  62   9.440  -8.510   0.171
  484   2HB   ARG  62          HB1       ARG  62   9.626  -9.210  -1.430
  485   1HG   ARG  62          HG2       ARG  62  11.453  -7.666  -1.888
  486   2HG   ARG  62          HG1       ARG  62  11.251  -6.958  -0.290
  487   1HD   ARG  62          HD2       ARG  62  11.769  -9.149   0.715
  488   2HD   ARG  62          HD1       ARG  62  12.040  -9.803  -0.900
  489    HE   ARG  62           HE       ARG  62  13.597  -7.463  -0.146
  490   1HH1  ARG  62          HH11      ARG  62  13.569 -10.999  -0.445
  491   2HH1  ARG  62          HH12      ARG  62  15.275 -11.132  -0.496
  492   1HH2  ARG  62          HH21      ARG  62  15.928  -7.649  -0.262
  493   2HH2  ARG  62          HH22      ARG  62  16.629  -9.187  -0.357
  494    H    GLN  63           HN       GLN  63   6.904  -7.952  -3.015
  495    HA   GLN  63           HA       GLN  63   8.532  -7.665  -5.430
  496   1HB   GLN  63          HB2       GLN  63   6.109  -9.379  -4.850
  497   2HB   GLN  63          HB1       GLN  63   6.707  -9.112  -6.474
  498   1HG   GLN  63          HG2       GLN  63   7.486 -11.241  -5.663
  499   2HG   GLN  63          HG1       GLN  63   8.843 -10.143  -5.854
  500   1HE2  GLN  63          HE21      GLN  63   6.615 -10.134  -3.189
  501   2HE2  GLN  63          HE22      GLN  63   7.735 -10.609  -1.963
  502    H    LEU  64           HN       LEU  64   6.325  -5.999  -3.684
  503    HA   LEU  64           HA       LEU  64   4.547  -5.197  -5.772
  504   1HB   LEU  64          HB2       LEU  64   5.117  -3.739  -3.188
  505   2HB   LEU  64          HB1       LEU  64   3.713  -3.551  -4.212
  506    HG   LEU  64           HG       LEU  64   4.418  -5.890  -2.478
  507   1HD1  LEU  64          HD11      LEU  64   2.134  -3.946  -2.370
  508   2HD1  LEU  64          HD12      LEU  64   3.501  -4.047  -1.259
  509   3HD1  LEU  64          HD13      LEU  64   2.322  -5.356  -1.331
  510   1HD2  LEU  64          HD21      LEU  64   3.418  -6.753  -4.511
  511   2HD2  LEU  64          HD22      LEU  64   2.078  -5.619  -4.362
  512   3HD2  LEU  64          HD23      LEU  64   2.285  -6.905  -3.172
  513    H    THR  65           HN       THR  65   4.710  -3.404  -7.074
  514    HA   THR  65           HA       THR  65   7.369  -2.406  -7.458
  515    HB   THR  65           HB       THR  65   6.257  -1.540  -9.525
  516    HG1  THR  65           HG1      THR  65   4.140  -1.855  -9.737
  517   1HG2  THR  65          HG21      THR  65   5.824  -4.407  -8.799
  518   2HG2  THR  65          HG22      THR  65   7.364  -3.736  -9.320
  519   3HG2  THR  65          HG23      THR  65   5.984  -3.795 -10.452
  520    H    LEU  66           HN       LEU  66   6.153  -1.398  -5.133
  521    HA   LEU  66           HA       LEU  66   5.726   0.523  -3.968
  522   1HB   LEU  66          HB2       LEU  66   7.759   1.307  -5.310
  523   2HB   LEU  66          HB1       LEU  66   6.642   2.022  -6.445
  524    HG   LEU  66           HG       LEU  66   7.647   3.672  -4.902
  525   1HD1  LEU  66          HD11      LEU  66   5.579   4.784  -4.175
  526   2HD1  LEU  66          HD12      LEU  66   4.713   3.273  -4.496
  527   3HD1  LEU  66          HD13      LEU  66   5.445   4.150  -5.823
  528   1HD2  LEU  66          HD21      LEU  66   7.021   3.676  -2.547
  529   2HD2  LEU  66          HD22      LEU  66   7.937   2.233  -2.978
  530   3HD2  LEU  66          HD23      LEU  66   6.185   2.138  -2.765
  531    H    ARG  67           HN       ARG  67   4.649   1.179  -7.289
  532    HA   ARG  67           HA       ARG  67   2.360   2.494  -6.206
  533   1HB   ARG  67          HB2       ARG  67   3.290   2.048  -8.998
  534   2HB   ARG  67          HB1       ARG  67   1.631   2.560  -8.702
  535   1HG   ARG  67          HG2       ARG  67   4.086   3.997  -7.716
  536   2HG   ARG  67          HG1       ARG  67   3.112   4.466  -9.119
  537   1HD   ARG  67          HD2       ARG  67   1.137   4.633  -7.627
  538   2HD   ARG  67          HD1       ARG  67   2.160   4.241  -6.281
  539    HE   ARG  67           HE       ARG  67   3.278   6.284  -6.480
  540   1HH1  ARG  67          HH11      ARG  67   0.639   6.119  -8.810
  541   2HH1  ARG  67          HH12      ARG  67   0.141   7.728  -8.625
  542   1HH2  ARG  67          HH21      ARG  67   2.614   8.583  -6.197
  543   2HH2  ARG  67          HH22      ARG  67   1.269   9.146  -7.082
  544    H    LYS  68           HN       LYS  68   3.002  -0.629  -6.658
  545    HA   LYS  68           HA       LYS  68   0.305  -1.486  -7.141
  546   1HB   LYS  68          HB2       LYS  68   2.374  -2.857  -7.616
  547   2HB   LYS  68          HB1       LYS  68   2.567  -3.048  -5.881
  548   1HG   LYS  68          HG2       LYS  68   0.431  -4.191  -5.750
  549   2HG   LYS  68          HG1       LYS  68   0.203  -3.967  -7.486
  550   1HD   LYS  68          HD2       LYS  68   2.248  -5.267  -7.894
  551   2HD   LYS  68          HD1       LYS  68   2.397  -5.543  -6.152
  552   1HE   LYS  68          HE2       LYS  68   0.206  -6.582  -6.161
  553   2HE   LYS  68          HE1       LYS  68   0.110  -6.383  -7.912
  554   1HZ   LYS  68          HZ1       LYS  68   1.864  -8.229  -6.361
  555   2HZ   LYS  68          HZ2       LYS  68   2.341  -7.669  -7.858
  556   3HZ   LYS  68          HZ3       LYS  68   0.931  -8.559  -7.742
  557    H    LEU  69           HN       LEU  69   2.203  -0.478  -4.548
  558    HA   LEU  69           HA       LEU  69   0.913  -1.542  -2.270
  559   1HB   LEU  69          HB2       LEU  69   2.438   1.007  -2.643
  560   2HB   LEU  69          HB1       LEU  69   1.533   0.778  -1.171
  561    HG   LEU  69           HG       LEU  69   3.849   0.279  -0.817
  562   1HD1  LEU  69          HD11      LEU  69   2.285  -0.975   0.475
  563   2HD1  LEU  69          HD12      LEU  69   3.693  -1.971   0.102
  564   3HD1  LEU  69          HD13      LEU  69   2.182  -2.207  -0.780
  565   1HD2  LEU  69          HD21      LEU  69   4.985  -1.594  -1.910
  566   2HD2  LEU  69          HD22      LEU  69   4.517  -0.350  -3.070
  567   3HD2  LEU  69          HD23      LEU  69   3.578  -1.836  -2.947
  568    H    GLN  70           HN       GLN  70  -0.038   1.201  -4.224
  569    HA   GLN  70           HA       GLN  70  -2.198   1.799  -2.385
  570   1HB   GLN  70          HB2       GLN  70  -2.766   3.644  -4.049
  571   2HB   GLN  70          HB1       GLN  70  -1.264   3.785  -3.154
  572   1HG   GLN  70          HG2       GLN  70  -0.005   3.061  -5.054
  573   2HG   GLN  70          HG1       GLN  70  -1.492   2.769  -5.980
  574   1HE2  GLN  70          HE21      GLN  70  -2.537   4.558  -6.862
  575   2HE2  GLN  70          HE22      GLN  70  -1.750   6.105  -6.864
  576    H    GLU  71           HN       GLU  71  -1.906  -0.514  -4.481
  577    HA   GLU  71           HA       GLU  71  -4.785  -0.444  -5.068
  578   1HB   GLU  71          HB2       GLU  71  -2.667  -2.090  -6.490
  579   2HB   GLU  71          HB1       GLU  71  -4.371  -1.993  -6.916
  580   1HG   GLU  71          HG2       GLU  71  -4.043   0.430  -7.388
  581   2HG   GLU  71          HG1       GLU  71  -2.319   0.196  -7.128
  582    H    MET  72           HN       MET  72  -2.211  -1.920  -3.502
  583    HA   MET  72           HA       MET  72  -3.918  -4.090  -2.529
  584   1HB   MET  72          HB2       MET  72  -0.909  -3.712  -2.363
  585   2HB   MET  72          HB1       MET  72  -1.792  -5.089  -1.711
  586   1HG   MET  72          HG2       MET  72  -1.635  -4.310  -4.612
  587   2HG   MET  72          HG1       MET  72  -0.743  -5.623  -3.844
  588   1HE   MET  72          HE1       MET  72  -1.766  -7.124  -5.904
  589   2HE   MET  72          HE2       MET  72  -2.754  -5.775  -6.464
  590   3HE   MET  72          HE3       MET  72  -3.496  -7.344  -6.151
  591    H    SER  73           HN       SER  73  -3.951  -1.196  -1.876
  592    HA   SER  73           HA       SER  73  -2.863  -0.917   0.727
  593   1HB   SER  73          HB2       SER  73  -3.955   1.365   0.482
  594   2HB   SER  73          HB1       SER  73  -2.757   0.922  -0.720
  595    HG   SER  73           HG       SER  73  -4.767   1.816  -1.570
  596    H    SER  74           HN       SER  74  -5.141  -2.769  -0.094
  597    HA   SER  74           HA       SER  74  -6.906  -3.815   0.914
  598   1HB   SER  74          HB2       SER  74  -6.983  -1.535   2.927
  599   2HB   SER  74          HB1       SER  74  -7.853  -3.062   3.054
  600    HG   SER  74           HG       SER  74  -5.085  -3.075   2.738
  601    H    LYS  75           HN       LYS  75  -6.854  -1.033  -0.653
  602    HA   LYS  75           HA       LYS  75  -9.692  -1.116  -1.123
  603   1HB   LYS  75          HB2       LYS  75  -9.757   1.413  -1.087
  604   2HB   LYS  75          HB1       LYS  75  -9.591   0.641   0.481
  605   1HG   LYS  75          HG2       LYS  75  -7.182   1.160   0.470
  606   2HG   LYS  75          HG1       LYS  75  -7.367   1.935  -1.105
  607   1HD   LYS  75          HD2       LYS  75  -8.960   3.524  -0.090
  608   2HD   LYS  75          HD1       LYS  75  -8.680   2.770   1.478
  609   1HE   LYS  75          HE2       LYS  75  -6.346   3.430   1.420
  610   2HE   LYS  75          HE1       LYS  75  -6.540   4.077  -0.208
  611   1HZ   LYS  75          HZ1       LYS  75  -6.651   5.886   1.410
  612   2HZ   LYS  75          HZ2       LYS  75  -7.880   5.079   2.248
  613   3HZ   LYS  75          HZ3       LYS  75  -8.161   5.651   0.698
  614    H    ALA  76           HN       ALA  76  -9.492  -1.934  -3.130
  615    HA   ALA  76           HA       ALA  76  -7.621  -0.987  -5.053
  616   1HB   ALA  76          HB1       ALA  76 -10.203  -2.511  -5.473
  617   2HB   ALA  76          HB2       ALA  76  -8.622  -3.231  -5.177
  618   3HB   ALA  76          HB3       ALA  76  -8.910  -2.320  -6.659
  619    H    GLY  77           HN       GLY  77 -10.640   0.078  -3.953
  620   1HA   GLY  77          HA2       GLY  77 -10.600   2.273  -5.873
  621   2HA   GLY  77          HA1       GLY  77 -12.096   1.360  -5.639
  622    H    SER  78           HN       SER  78 -13.138   3.189  -4.811
  623    HA   SER  78           HA       SER  78 -12.185   4.638  -2.567
  624   1HB   SER  78          HB2       SER  78 -15.060   4.262  -3.416
  625   2HB   SER  78          HB1       SER  78 -14.381   5.602  -2.494
  626    HG   SER  78           HG       SER  78 -14.527   5.193  -5.148
  627    H    ASP  79           HN       ASP  79 -12.697   4.428  -0.423
  628    HA   ASP  79           HA       ASP  79 -12.883   1.875   0.756
  629   1HB   ASP  79          HB2       ASP  79 -13.595   4.566   1.956
  630   2HB   ASP  79          HB1       ASP  79 -13.354   3.086   2.862
  631    H    THR  80           HN       THR  80 -15.233   4.384   0.139
  632    HA   THR  80           HA       THR  80 -17.351   3.135   1.509
  633    HB   THR  80           HB       THR  80 -18.523   5.125   0.380
  634    HG1  THR  80           HG1      THR  80 -17.273   6.396  -0.766
  635   1HG2  THR  80          HG21      THR  80 -17.771   5.077   2.736
  636   2HG2  THR  80          HG22      THR  80 -17.514   6.662   2.009
  637   3HG2  THR  80          HG23      THR  80 -16.154   5.555   2.218
  638    H    GLU  81           HN       GLU  81 -16.018   2.617  -1.544
  639    HA   GLU  81           HA       GLU  81 -18.628   1.922  -2.670
  640   1HB   GLU  81          HB2       GLU  81 -15.963   2.164  -4.060
  641   2HB   GLU  81          HB1       GLU  81 -17.450   1.651  -4.842
  642   1HG   GLU  81          HG2       GLU  81 -18.447   3.847  -4.215
  643   2HG   GLU  81          HG1       GLU  81 -16.854   4.336  -3.637
  644    H    LEU  82           HN       LEU  82 -15.527   0.546  -1.790
  645    HA   LEU  82           HA       LEU  82 -16.493  -2.067  -2.615
  646   1HB   LEU  82          HB2       LEU  82 -13.746  -1.072  -1.908
  647   2HB   LEU  82          HB1       LEU  82 -14.104  -2.781  -1.985
  648    HG   LEU  82           HG       LEU  82 -13.058  -2.190  -4.011
  649   1HD1  LEU  82          HD11      LEU  82 -16.004  -2.460  -4.486
  650   2HD1  LEU  82          HD12      LEU  82 -14.836  -3.762  -4.263
  651   3HD1  LEU  82          HD13      LEU  82 -14.743  -2.725  -5.690
  652   1HD2  LEU  82          HD21      LEU  82 -13.890  -0.455  -5.541
  653   2HD2  LEU  82          HD22      LEU  82 -13.402   0.232  -3.992
  654   3HD2  LEU  82          HD23      LEU  82 -15.114   0.001  -4.355
  655    H    ALA  83           HN       ALA  83 -17.108  -3.542  -1.313
  656    HA   ALA  83           HA       ALA  83 -17.823  -4.602   0.494
  657   1HB   ALA  83          HB1       ALA  83 -15.415  -5.101   0.739
  658   2HB   ALA  83          HB2       ALA  83 -16.250  -5.050   2.291
  659   3HB   ALA  83          HB3       ALA  83 -15.250  -3.689   1.786
  660    H    ALA  84           HN       ALA  84 -19.496  -3.047   0.578
  661    HA   ALA  84           HA       ALA  84 -19.372  -0.961   2.546
  662   1HB   ALA  84          HB1       ALA  84 -21.747  -0.630   2.020
  663   2HB   ALA  84          HB2       ALA  84 -21.746  -2.113   1.065
  664   3HB   ALA  84          HB3       ALA  84 -20.781  -0.731   0.546
  665    HA   PRO  85           HA       PRO  85 -20.271  -3.490   6.097
  666   1HB   PRO  85          HB2       PRO  85 -21.577  -1.511   7.556
  667   2HB   PRO  85          HB1       PRO  85 -19.827  -1.743   7.523
  668   1HG   PRO  85          HG2       PRO  85 -21.514   0.178   5.980
  669   2HG   PRO  85          HG1       PRO  85 -19.925   0.425   6.729
  670   1HD   PRO  85          HD2       PRO  85 -20.171   0.053   4.097
  671   2HD   PRO  85          HD1       PRO  85 -18.806  -0.641   4.998
  672    H    LYS  86           HN       LYS  86 -21.900  -4.840   6.355
  673    HA   LYS  86           HA       LYS  86 -24.284  -4.557   4.841
  674   1HB   LYS  86          HB2       LYS  86 -23.231  -6.748   5.265
  675   2HB   LYS  86          HB1       LYS  86 -23.613  -6.597   6.974
  676   1HG   LYS  86          HG2       LYS  86 -25.977  -6.707   6.497
  677   2HG   LYS  86          HG1       LYS  86 -25.664  -6.711   4.761
  678   1HD   LYS  86          HD2       LYS  86 -24.831  -8.852   6.731
  679   2HD   LYS  86          HD1       LYS  86 -26.157  -8.967   5.574
  680   1HE   LYS  86          HE2       LYS  86 -24.557  -8.725   3.729
  681   2HE   LYS  86          HE1       LYS  86 -23.242  -8.606   4.890
  682   1HZ   LYS  86          HZ1       LYS  86 -23.321 -10.804   4.035
  683   2HZ   LYS  86          HZ2       LYS  86 -24.948 -10.977   4.341
  684   3HZ   LYS  86          HZ3       LYS  86 -23.850 -10.893   5.638
  685    H    SER  87           HN       SER  87 -25.446  -2.921   5.443
  686    HA   SER  87           HA       SER  87 -27.004  -3.151   7.875
  687   1HB   SER  87          HB2       SER  87 -25.465  -0.610   7.237
  688   2HB   SER  87          HB1       SER  87 -26.591  -0.824   8.573
  689    HG   SER  87           HG       SER  87 -24.718  -2.756   8.540
  690    H    LYS  88           HN       LYS  88 -26.308  -1.567   4.780
  691    HA   LYS  88           HA       LYS  88 -29.038  -0.583   4.606
  692   1HB   LYS  88          HB2       LYS  88 -26.896  -0.389   2.492
  693   2HB   LYS  88          HB1       LYS  88 -28.297   0.644   2.722
  694   1HG   LYS  88          HG2       LYS  88 -27.219   1.382   4.895
  695   2HG   LYS  88          HG1       LYS  88 -25.759   0.581   4.319
  696   1HD   LYS  88          HD2       LYS  88 -25.575   2.873   3.724
  697   2HD   LYS  88          HD1       LYS  88 -25.944   1.991   2.240
  698   1HE   LYS  88          HE2       LYS  88 -27.282   4.036   2.412
  699   2HE   LYS  88          HE1       LYS  88 -28.302   2.598   2.450
  700   1HZ   LYS  88          HZ1       LYS  88 -27.444   4.167   4.834
  701   2HZ   LYS  88          HZ2       LYS  88 -28.409   2.810   4.895
  702   3HZ   LYS  88          HZ3       LYS  88 -28.989   4.204   4.151
  703    H    ASN  89           HN       ASN  89 -26.703  -2.752   3.114
  704    HA   ASN  89           HA       ASN  89 -28.820  -4.517   2.309
  705   1HB   ASN  89          HB2       ASN  89 -28.397  -3.125   0.289
  706   2HB   ASN  89          HB1       ASN  89 -26.690  -3.567   0.368
  707   1HD2  ASN  89          HD21      ASN  89 -29.889  -4.749  -0.130
  708   2HD2  ASN  89          HD22      ASN  89 -29.480  -6.196  -0.979
  Start of MODEL   13
    1   1H    GLY   1          HT1       GLY   1  -7.953   0.423  21.178
    2   2H    GLY   1          HT2       GLY   1  -6.489   0.726  21.972
    3   3H    GLY   1          HT3       GLY   1  -6.591   0.819  20.271
    4   1HA   GLY   1          HA1       GLY   1  -7.996   2.596  22.148
    5   2HA   GLY   1          HA2       GLY   1  -6.537   3.007  21.252
    6    H    ASP   2           HN       ASP   2  -9.258   4.171  21.158
    7    HA   ASP   2           HA       ASP   2 -10.045   3.467  18.425
    8   1HB   ASP   2          HB2       ASP   2 -11.770   3.733  20.324
    9   2HB   ASP   2          HB1       ASP   2 -11.423   5.458  20.234
   10    H    GLY   3           HN       GLY   3  -9.720   4.840  16.810
   11   1HA   GLY   3          HA2       GLY   3  -9.417   7.131  16.028
   12   2HA   GLY   3          HA1       GLY   3  -8.441   7.410  17.470
   13    H    GLU   4           HN       GLU   4  -8.427   4.606  15.346
   14    HA   GLU   4           HA       GLU   4  -5.592   4.635  15.196
   15   1HB   GLU   4          HB2       GLU   4  -7.649   3.001  13.690
   16   2HB   GLU   4          HB1       GLU   4  -5.919   2.677  13.732
   17   1HG   GLU   4          HG2       GLU   4  -7.715   2.663  16.151
   18   2HG   GLU   4          HG1       GLU   4  -7.251   1.230  15.238
   19    H    ALA   5           HN       ALA   5  -4.584   6.012  13.997
   20    HA   ALA   5           HA       ALA   5  -5.945   7.123  11.663
   21   1HB   ALA   5          HB1       ALA   5  -5.143   8.731  13.331
   22   2HB   ALA   5          HB2       ALA   5  -4.368   8.958  11.763
   23   3HB   ALA   5          HB3       ALA   5  -3.492   8.164  13.073
   24    H    GLN   6           HN       GLN   6  -5.614   5.725  10.069
   25    HA   GLN   6           HA       GLN   6  -2.977   4.694   9.463
   26   1HB   GLN   6          HB2       GLN   6  -5.070   3.360   9.121
   27   2HB   GLN   6          HB1       GLN   6  -5.557   4.515   7.893
   28   1HG   GLN   6          HG2       GLN   6  -3.498   3.914   6.619
   29   2HG   GLN   6          HG1       GLN   6  -3.195   2.653   7.811
   30   1HE2  GLN   6          HE21      GLN   6  -6.075   2.099   8.067
   31   2HE2  GLN   6          HE22      GLN   6  -6.515   1.196   6.667
   32    H    ARG   7           HN       ARG   7  -1.872   5.274   7.610
   33    HA   ARG   7           HA       ARG   7  -2.696   7.822   6.402
   34   1HB   ARG   7          HB2       ARG   7  -0.316   8.145   5.905
   35   2HB   ARG   7          HB1       ARG   7  -0.581   7.935   7.626
   36   1HG   ARG   7          HG2       ARG   7   0.053   5.498   7.265
   37   2HG   ARG   7          HG1       ARG   7   0.626   6.009   5.673
   38   1HD   ARG   7          HD2       ARG   7   2.459   6.020   7.253
   39   2HD   ARG   7          HD1       ARG   7   2.080   7.672   6.758
   40    HE   ARG   7           HE       ARG   7   0.757   6.766   9.166
   41   1HH1  ARG   7          HH11      ARG   7   3.655   8.384   7.908
   42   2HH1  ARG   7          HH12      ARG   7   3.912   9.285   9.333
   43   1HH2  ARG   7          HH21      ARG   7   1.165   7.949  11.126
   44   2HH2  ARG   7          HH22      ARG   7   2.541   8.953  11.230
   45    H    ASP   8           HN       ASP   8  -1.857   7.975   4.059
   46    HA   ASP   8           HA       ASP   8  -2.834   5.752   2.560
   47   1HB   ASP   8          HB2       ASP   8  -0.920   7.910   1.615
   48   2HB   ASP   8          HB1       ASP   8  -1.656   6.711   0.583
   49    H    LEU   9           HN       LEU   9  -1.667   4.198   1.430
   50    HA   LEU   9           HA       LEU   9   0.541   3.201   2.935
   51   1HB   LEU   9          HB2       LEU   9  -0.755   2.188   0.399
   52   2HB   LEU   9          HB1       LEU   9   0.544   1.347   1.208
   53    HG   LEU   9           HG       LEU   9  -0.938   1.197   3.236
   54   1HD1  LEU   9          HD11      LEU   9  -3.390   1.350   2.833
   55   2HD1  LEU   9          HD12      LEU   9  -3.000   2.247   1.344
   56   3HD1  LEU   9          HD13      LEU   9  -2.517   2.875   2.907
   57   1HD2  LEU   9          HD21      LEU   9  -2.271  -0.648   2.383
   58   2HD2  LEU   9          HD22      LEU   9  -0.601  -0.711   1.814
   59   3HD2  LEU   9          HD23      LEU   9  -1.887  -0.162   0.730
   60    H    VAL  10           HN       VAL  10   0.203   4.877  -0.076
   61    HA   VAL  10           HA       VAL  10   2.982   4.604  -0.607
   62    HB   VAL  10           HB       VAL  10   0.837   6.292  -1.945
   63   1HG1  VAL  10          HG11      VAL  10   2.973   7.513  -2.150
   64   2HG1  VAL  10          HG12      VAL  10   2.470   6.838  -3.702
   65   3HG1  VAL  10          HG13      VAL  10   3.740   6.050  -2.766
   66   1HG2  VAL  10          HG21      VAL  10   2.425   3.892  -2.830
   67   2HG2  VAL  10          HG22      VAL  10   1.222   4.742  -3.799
   68   3HG2  VAL  10          HG23      VAL  10   0.730   3.898  -2.338
   69    H    LYS  11           HN       LYS  11   1.058   6.738   1.316
   70    HA   LYS  11           HA       LYS  11   3.191   8.719   1.490
   71   1HB   LYS  11          HB2       LYS  11   0.814   8.538   3.354
   72   2HB   LYS  11          HB1       LYS  11   1.918   9.875   3.101
   73   1HG   LYS  11          HG2       LYS  11  -0.205   8.888   1.230
   74   2HG   LYS  11          HG1       LYS  11  -0.212  10.378   2.157
   75   1HD   LYS  11          HD2       LYS  11   1.799  11.079   0.834
   76   2HD   LYS  11          HD1       LYS  11   1.531   9.655  -0.181
   77   1HE   LYS  11          HE2       LYS  11  -0.368  11.957   0.264
   78   2HE   LYS  11          HE1       LYS  11   0.478  11.544  -1.225
   79   1HZ   LYS  11          HZ1       LYS  11  -0.838   9.467  -1.311
   80   2HZ   LYS  11          HZ2       LYS  11  -1.816  10.825  -1.333
   81   3HZ   LYS  11          HZ3       LYS  11  -1.676   9.946   0.083
   82    H    ALA  12           HN       ALA  12   2.911   5.734   2.497
   83    HA   ALA  12           HA       ALA  12   4.375   6.244   4.978
   84   1HB   ALA  12          HB1       ALA  12   2.918   3.740   4.124
   85   2HB   ALA  12          HB2       ALA  12   2.349   4.909   5.316
   86   3HB   ALA  12          HB3       ALA  12   3.797   3.955   5.637
   87    H    VAL  13           HN       VAL  13   4.168   3.676   2.550
   88    HA   VAL  13           HA       VAL  13   6.781   2.747   2.908
   89    HB   VAL  13           HB       VAL  13   4.967   2.419   0.504
   90   1HG1  VAL  13          HG11      VAL  13   6.247   0.388   0.044
   91   2HG1  VAL  13          HG12      VAL  13   7.337   0.776   1.377
   92   3HG1  VAL  13          HG13      VAL  13   7.258   1.834  -0.038
   93   1HG2  VAL  13          HG21      VAL  13   3.906   1.686   2.558
   94   2HG2  VAL  13          HG22      VAL  13   5.313   0.698   2.955
   95   3HG2  VAL  13          HG23      VAL  13   4.321   0.300   1.550
   96    H    ALA  14           HN       ALA  14   5.465   4.699   0.218
   97    HA   ALA  14           HA       ALA  14   7.994   5.039  -1.001
   98   1HB   ALA  14          HB1       ALA  14   6.889   6.716  -2.427
   99   2HB   ALA  14          HB2       ALA  14   5.503   6.723  -1.332
  100   3HB   ALA  14          HB3       ALA  14   5.865   5.283  -2.263
  101    H    HIS  15           HN       HIS  15   6.204   6.750   1.384
  102    HA   HIS  15           HA       HIS  15   7.658   9.184   1.348
  103   1HB   HIS  15          HB2       HIS  15   5.376   8.858   2.276
  104   2HB   HIS  15          HB1       HIS  15   6.077   7.961   3.603
  105    HD1  HIS  15           HD1      HIS  15   6.236  11.451   2.125
  106    HD2  HIS  15           HD2      HIS  15   6.575   9.512   5.770
  107    HE1  HIS  15           HE1      HIS  15   6.268  13.271   3.860
  108    HE2  HIS  15           HE2      HIS  15   5.956  11.970   5.990
  109    H    ILE  16           HN       ILE  16   8.190   6.088   2.900
  110    HA   ILE  16           HA       ILE  16  10.227   6.837   4.688
  111    HB   ILE  16           HB       ILE  16   9.899   4.233   3.148
  112   1HG1  ILE  16          HG12      ILE  16   7.994   4.638   4.605
  113   2HG1  ILE  16          HG11      ILE  16   8.967   3.324   5.253
  114   1HG2  ILE  16          HG21      ILE  16  12.186   4.423   3.874
  115   2HG2  ILE  16          HG22      ILE  16  11.360   3.182   4.817
  116   3HG2  ILE  16          HG23      ILE  16  11.669   4.769   5.524
  117   1HD1  ILE  16          HD11      ILE  16   8.963   6.173   6.238
  118   2HD1  ILE  16          HD12      ILE  16   9.920   4.849   6.904
  119   3HD1  ILE  16          HD13      ILE  16   8.162   4.806   7.010
  120    H    LEU  17           HN       LEU  17  10.340   5.750   1.322
  121    HA   LEU  17           HA       LEU  17  13.139   6.058   0.991
  122   1HB   LEU  17          HB2       LEU  17  10.951   6.112  -1.091
  123   2HB   LEU  17          HB1       LEU  17  12.662   5.969  -1.436
  124    HG   LEU  17           HG       LEU  17  10.974   3.946   0.027
  125   1HD1  LEU  17          HD11      LEU  17  12.194   3.892  -2.724
  126   2HD1  LEU  17          HD12      LEU  17  10.477   4.040  -2.349
  127   3HD1  LEU  17          HD13      LEU  17  11.342   2.555  -1.953
  128   1HD2  LEU  17          HD21      LEU  17  13.878   3.843  -0.794
  129   2HD2  LEU  17          HD22      LEU  17  12.959   2.509  -0.095
  130   3HD2  LEU  17          HD23      LEU  17  13.270   3.961   0.857
  131    H    GLY  18           HN       GLY  18  10.399   8.127   0.380
  132   1HA   GLY  18          HA2       GLY  18  10.783  10.538   0.870
  133   2HA   GLY  18          HA1       GLY  18  12.273  10.377  -0.054
  134    H    ILE  19           HN       ILE  19   9.265   8.839  -0.942
  135    HA   ILE  19           HA       ILE  19   8.968  10.722  -3.115
  136    HB   ILE  19           HB       ILE  19   8.098   8.600  -4.364
  137   1HG1  ILE  19          HG12      ILE  19  10.230   7.412  -2.578
  138   2HG1  ILE  19          HG11      ILE  19   8.520   7.007  -2.571
  139   1HG2  ILE  19          HG21      ILE  19   9.787  10.068  -5.246
  140   2HG2  ILE  19          HG22      ILE  19  10.316   8.403  -5.458
  141   3HG2  ILE  19          HG23      ILE  19  11.002   9.385  -4.158
  142   1HD1  ILE  19          HD11      ILE  19  10.435   6.520  -4.841
  143   2HD1  ILE  19          HD12      ILE  19   8.727   6.080  -4.818
  144   3HD1  ILE  19          HD13      ILE  19   9.854   5.311  -3.696
  145    H    ARG  20           HN       ARG  20   6.984  10.865  -3.957
  146    HA   ARG  20           HA       ARG  20   4.665   9.559  -2.745
  147   1HB   ARG  20          HB2       ARG  20   5.100  11.542  -1.318
  148   2HB   ARG  20          HB1       ARG  20   5.061  12.543  -2.769
  149   1HG   ARG  20          HG2       ARG  20   2.717  11.651  -3.120
  150   2HG   ARG  20          HG1       ARG  20   2.811  11.073  -1.455
  151   1HD   ARG  20          HD2       ARG  20   1.760  13.225  -1.449
  152   2HD   ARG  20          HD1       ARG  20   3.370  13.373  -0.743
  153    HE   ARG  20           HE       ARG  20   3.711  13.962  -3.398
  154   1HH1  ARG  20          HH11      ARG  20   1.717  15.263  -0.797
  155   2HH1  ARG  20          HH12      ARG  20   1.694  16.847  -1.378
  156   1HH2  ARG  20          HH21      ARG  20   3.682  16.072  -4.284
  157   2HH2  ARG  20          HH22      ARG  20   2.868  17.343  -3.476
  158    H    ASP  21           HN       ASP  21   5.997  12.085  -4.750
  159    HA   ASP  21           HA       ASP  21   3.772  12.257  -6.565
  160   1HB   ASP  21          HB2       ASP  21   6.597  13.255  -7.000
  161   2HB   ASP  21          HB1       ASP  21   5.131  13.825  -7.790
  162    H    LEU  22           HN       LEU  22   6.919  10.760  -6.557
  163    HA   LEU  22           HA       LEU  22   7.766   9.027  -7.699
  164   1HB   LEU  22          HB2       LEU  22   4.866   8.639  -8.322
  165   2HB   LEU  22          HB1       LEU  22   6.048   7.746  -9.257
  166    HG   LEU  22           HG       LEU  22   5.151   6.423  -7.467
  167   1HD1  LEU  22          HD11      LEU  22   7.420   6.037  -8.203
  168   2HD1  LEU  22          HD12      LEU  22   7.305   5.716  -6.464
  169   3HD1  LEU  22          HD13      LEU  22   8.022   7.220  -7.055
  170   1HD2  LEU  22          HD21      LEU  22   4.616   8.145  -5.827
  171   2HD2  LEU  22          HD22      LEU  22   6.327   8.477  -5.589
  172   3HD2  LEU  22          HD23      LEU  22   5.657   6.919  -5.106
  173    H    ALA  23           HN       ALA  23   7.757  11.635  -8.589
  174    HA   ALA  23           HA       ALA  23   7.332  11.642 -11.406
  175   1HB   ALA  23          HB1       ALA  23   8.662  13.704  -9.638
  176   2HB   ALA  23          HB2       ALA  23   6.966  13.691 -10.124
  177   3HB   ALA  23          HB3       ALA  23   8.227  13.933 -11.332
  178    H    GLY  24           HN       GLY  24   8.643  10.032 -12.107
  179   1HA   GLY  24          HA2       GLY  24  10.481   9.518 -13.342
  180   2HA   GLY  24          HA1       GLY  24  11.435  10.779 -12.527
  181    H    ILE  25           HN       ILE  25   9.503   8.323 -11.023
  182    HA   ILE  25           HA       ILE  25  11.949   6.987 -10.098
  183    HB   ILE  25           HB       ILE  25   9.229   7.088  -8.748
  184   1HG1  ILE  25          HG12      ILE  25  10.387   9.266  -8.653
  185   2HG1  ILE  25          HG11      ILE  25  10.231   8.523  -7.067
  186   1HG2  ILE  25          HG21      ILE  25  10.411   5.014  -8.284
  187   2HG2  ILE  25          HG22      ILE  25  10.341   6.024  -6.839
  188   3HG2  ILE  25          HG23      ILE  25  11.837   5.916  -7.769
  189   1HD1  ILE  25          HD11      ILE  25  12.727   8.573  -8.763
  190   2HD1  ILE  25          HD12      ILE  25  12.564   7.818  -7.174
  191   3HD1  ILE  25          HD13      ILE  25  12.400   9.567  -7.338
  192    H    ASN  26           HN       ASN  26  12.019   4.833 -10.438
  193    HA   ASN  26           HA       ASN  26  10.434   3.802 -12.531
  194   1HB   ASN  26          HB2       ASN  26  12.401   2.438 -10.699
  195   2HB   ASN  26          HB1       ASN  26  11.586   1.611 -12.022
  196   1HD2  ASN  26          HD21      ASN  26  14.427   2.256 -11.518
  197   2HD2  ASN  26          HD22      ASN  26  14.962   3.069 -12.943
  198    H    LEU  27           HN       LEU  27   8.396   3.450 -12.311
  199    HA   LEU  27           HA       LEU  27   7.147   2.406  -9.917
  200   1HB   LEU  27          HB2       LEU  27   6.060   2.856 -12.708
  201   2HB   LEU  27          HB1       LEU  27   5.099   2.452 -11.301
  202    HG   LEU  27           HG       LEU  27   6.664   5.006 -11.670
  203   1HD1  LEU  27          HD11      LEU  27   4.732   4.863 -13.158
  204   2HD1  LEU  27          HD12      LEU  27   4.473   6.057 -11.886
  205   3HD1  LEU  27          HD13      LEU  27   3.696   4.476 -11.784
  206   1HD2  LEU  27          HD21      LEU  27   5.484   5.734  -9.664
  207   2HD2  LEU  27          HD22      LEU  27   6.494   4.323  -9.341
  208   3HD2  LEU  27          HD23      LEU  27   4.747   4.137  -9.516
  209    H    ASP  28           HN       ASP  28   8.609   1.341 -12.677
  210    HA   ASP  28           HA       ASP  28   7.366  -1.197 -13.100
  211   1HB   ASP  28          HB2       ASP  28   8.537   0.135 -14.836
  212   2HB   ASP  28          HB1       ASP  28  10.049  -0.128 -13.985
  213    H    SER  29           HN       SER  29   9.627  -0.051 -10.788
  214    HA   SER  29           HA       SER  29  11.007  -2.551 -10.599
  215   1HB   SER  29          HB2       SER  29  11.240  -0.019  -8.985
  216   2HB   SER  29          HB1       SER  29  12.282  -1.433  -8.846
  217    HG   SER  29           HG       SER  29  12.494  -1.049 -11.275
  218    H    SER  30           HN       SER  30  10.389  -4.121  -9.411
  219    HA   SER  30           HA       SER  30   8.278  -4.163  -7.562
  220   1HB   SER  30          HB2       SER  30  10.695  -5.925  -7.886
  221   2HB   SER  30          HB1       SER  30   9.269  -6.391  -6.986
  222    HG   SER  30           HG       SER  30   9.797  -6.719  -9.500
  223    H    LEU  31           HN       LEU  31   8.438  -4.294  -5.250
  224    HA   LEU  31           HA       LEU  31  10.198  -2.534  -3.990
  225   1HB   LEU  31          HB2       LEU  31   8.698  -4.791  -2.641
  226   2HB   LEU  31          HB1       LEU  31   9.369  -3.361  -1.908
  227    HG   LEU  31           HG       LEU  31   7.065  -3.370  -3.856
  228   1HD1  LEU  31          HD11      LEU  31   5.727  -2.687  -1.946
  229   2HD1  LEU  31          HD12      LEU  31   7.133  -2.878  -0.894
  230   3HD1  LEU  31          HD13      LEU  31   6.443  -4.280  -1.707
  231   1HD2  LEU  31          HD21      LEU  31   8.405  -1.352  -4.043
  232   2HD2  LEU  31          HD22      LEU  31   8.296  -1.117  -2.292
  233   3HD2  LEU  31          HD23      LEU  31   6.839  -1.024  -3.293
  234    H    ALA  32           HN       ALA  32  10.629  -5.838  -4.816
  235    HA   ALA  32           HA       ALA  32  12.745  -6.319  -2.995
  236   1HB   ALA  32          HB1       ALA  32  11.372  -8.102  -3.999
  237   2HB   ALA  32          HB2       ALA  32  13.106  -8.391  -4.136
  238   3HB   ALA  32          HB3       ALA  32  12.187  -7.829  -5.535
  239    H    ASP  33           HN       ASP  33  12.510  -4.822  -6.087
  240    HA   ASP  33           HA       ASP  33  15.224  -5.193  -6.823
  241   1HB   ASP  33          HB2       ASP  33  13.506  -4.669  -8.519
  242   2HB   ASP  33          HB1       ASP  33  13.236  -3.102  -7.767
  243    H    LEU  34           HN       LEU  34  13.254  -2.844  -5.301
  244    HA   LEU  34           HA       LEU  34  15.107  -0.825  -4.631
  245   1HB   LEU  34          HB2       LEU  34  12.522  -1.777  -3.396
  246   2HB   LEU  34          HB1       LEU  34  13.423  -0.449  -2.718
  247    HG   LEU  34           HG       LEU  34  12.844   1.004  -4.513
  248   1HD1  LEU  34          HD11      LEU  34  11.804  -1.390  -6.040
  249   2HD1  LEU  34          HD12      LEU  34  13.297  -0.529  -6.409
  250   3HD1  LEU  34          HD13      LEU  34  11.744   0.293  -6.567
  251   1HD2  LEU  34          HD21      LEU  34  11.017   0.602  -3.026
  252   2HD2  LEU  34          HD22      LEU  34  10.611  -0.859  -3.929
  253   3HD2  LEU  34          HD23      LEU  34  10.397   0.723  -4.695
  254    H    GLY  35           HN       GLY  35  13.790  -3.553  -2.791
  255   1HA   GLY  35          HA2       GLY  35  15.193  -5.127  -1.710
  256   2HA   GLY  35          HA1       GLY  35  16.403  -3.872  -1.518
  257    H    LEU  36           HN       LEU  36  12.986  -4.371  -0.581
  258    HA   LEU  36           HA       LEU  36  13.668  -3.165   1.951
  259   1HB   LEU  36          HB2       LEU  36  11.324  -3.261   2.571
  260   2HB   LEU  36          HB1       LEU  36  11.476  -2.592   0.973
  261    HG   LEU  36           HG       LEU  36  10.828  -4.948   0.160
  262   1HD1  LEU  36          HD11      LEU  36  11.047  -6.154   2.267
  263   2HD1  LEU  36          HD12      LEU  36   9.385  -6.231   1.682
  264   3HD1  LEU  36          HD13      LEU  36   9.806  -5.134   2.998
  265   1HD2  LEU  36          HD21      LEU  36   8.502  -4.396   0.261
  266   2HD2  LEU  36          HD22      LEU  36   9.435  -2.892   0.073
  267   3HD2  LEU  36          HD23      LEU  36   8.776  -3.340   1.640
  268    H    ASP  37           HN       ASP  37  14.097  -4.162   3.706
  269    HA   ASP  37           HA       ASP  37  13.345  -6.998   3.980
  270   1HB   ASP  37          HB2       ASP  37  15.726  -6.889   3.284
  271   2HB   ASP  37          HB1       ASP  37  16.076  -5.909   4.703
  272    H    SER  38           HN       SER  38  13.832  -3.884   5.359
  273    HA   SER  38           HA       SER  38  13.401  -5.094   7.978
  274   1HB   SER  38          HB2       SER  38  14.653  -3.151   8.939
  275   2HB   SER  38          HB1       SER  38  15.612  -4.244   7.936
  276    HG   SER  38           HG       SER  38  16.033  -2.615   6.676
  277    H    LEU  39           HN       LEU  39  13.329  -1.664   7.346
  278    HA   LEU  39           HA       LEU  39  11.072  -1.302   9.000
  279   1HB   LEU  39          HB2       LEU  39  12.730   0.465   8.696
  280   2HB   LEU  39          HB1       LEU  39  12.240   0.643   7.019
  281    HG   LEU  39           HG       LEU  39   9.946   1.235   7.836
  282   1HD1  LEU  39          HD11      LEU  39   9.699   2.015  10.137
  283   2HD1  LEU  39          HD12      LEU  39  11.311   1.403  10.505
  284   3HD1  LEU  39          HD13      LEU  39  10.030   0.286  10.037
  285   1HD2  LEU  39          HD21      LEU  39  11.493   2.932   7.073
  286   2HD2  LEU  39          HD22      LEU  39  12.181   3.060   8.700
  287   3HD2  LEU  39          HD23      LEU  39  10.501   3.519   8.402
  288    H    MET  40           HN       MET  40  11.411  -1.046   5.486
  289    HA   MET  40           HA       MET  40   8.653  -0.468   5.067
  290   1HB   MET  40          HB2       MET  40  10.791  -1.493   3.213
  291   2HB   MET  40          HB1       MET  40   9.144  -1.217   2.670
  292   1HG   MET  40          HG2       MET  40   9.344   1.145   3.318
  293   2HG   MET  40          HG1       MET  40  10.995   0.854   3.850
  294   1HE   MET  40          HE1       MET  40  12.873   0.186   0.498
  295   2HE   MET  40          HE2       MET  40  12.232  -1.005   1.632
  296   3HE   MET  40          HE3       MET  40  13.031   0.447   2.234
  297    H    GLY  41           HN       GLY  41  10.313  -3.458   5.509
  298   1HA   GLY  41          HA2       GLY  41   8.187  -5.111   4.570
  299   2HA   GLY  41          HA1       GLY  41   9.498  -5.621   5.626
  300    H    VAL  42           HN       VAL  42   8.899  -3.492   7.558
  301    HA   VAL  42           HA       VAL  42   6.773  -4.858   8.986
  302    HB   VAL  42           HB       VAL  42   8.492  -2.509   9.862
  303   1HG1  VAL  42          HG11      VAL  42   6.403  -2.576  11.067
  304   2HG1  VAL  42          HG12      VAL  42   7.736  -3.017  12.133
  305   3HG1  VAL  42          HG13      VAL  42   6.666  -4.267  11.492
  306   1HG2  VAL  42          HG21      VAL  42   8.766  -5.439  10.514
  307   2HG2  VAL  42          HG22      VAL  42   9.699  -4.134  11.252
  308   3HG2  VAL  42          HG23      VAL  42   9.867  -4.468   9.529
  309    H    GLU  43           HN       GLU  43   7.461  -1.674   7.698
  310    HA   GLU  43           HA       GLU  43   5.265  -0.241   8.508
  311   1HB   GLU  43          HB2       GLU  43   7.234   0.629   7.217
  312   2HB   GLU  43          HB1       GLU  43   6.551  -0.103   5.774
  313   1HG   GLU  43          HG2       GLU  43   5.925   2.187   5.689
  314   2HG   GLU  43          HG1       GLU  43   4.511   1.269   6.178
  315    H    VAL  44           HN       VAL  44   5.629  -2.276   5.644
  316    HA   VAL  44           HA       VAL  44   3.067  -1.797   4.576
  317    HB   VAL  44           HB       VAL  44   4.964  -4.133   4.151
  318   1HG1  VAL  44          HG11      VAL  44   2.688  -4.820   3.654
  319   2HG1  VAL  44          HG12      VAL  44   3.657  -4.663   2.180
  320   3HG1  VAL  44          HG13      VAL  44   2.485  -3.405   2.612
  321   1HG2  VAL  44          HG21      VAL  44   5.802  -1.986   3.382
  322   2HG2  VAL  44          HG22      VAL  44   4.320  -1.724   2.460
  323   3HG2  VAL  44          HG23      VAL  44   5.417  -3.032   2.015
  324    H    ARG  45           HN       ARG  45   4.281  -4.331   6.683
  325    HA   ARG  45           HA       ARG  45   1.843  -5.737   6.799
  326   1HB   ARG  45          HB2       ARG  45   4.311  -5.817   8.497
  327   2HB   ARG  45          HB1       ARG  45   2.907  -6.790   8.904
  328   1HG   ARG  45          HG2       ARG  45   3.025  -7.868   6.702
  329   2HG   ARG  45          HG1       ARG  45   4.441  -6.890   6.313
  330   1HD   ARG  45          HD2       ARG  45   4.271  -8.796   8.635
  331   2HD   ARG  45          HD1       ARG  45   4.964  -9.201   7.064
  332    HE   ARG  45           HE       ARG  45   6.297  -6.991   7.726
  333   1HH1  ARG  45          HH11      ARG  45   5.714 -10.012   9.501
  334   2HH1  ARG  45          HH12      ARG  45   7.191  -9.961  10.358
  335   1HH2  ARG  45          HH21      ARG  45   8.371  -6.978   8.856
  336   2HH2  ARG  45          HH22      ARG  45   8.742  -8.184   9.974
  337    H    GLN  46           HN       GLN  46   3.164  -3.160   8.782
  338    HA   GLN  46           HA       GLN  46   1.031  -3.348  10.638
  339   1HB   GLN  46          HB2       GLN  46   3.091  -1.209  10.188
  340   2HB   GLN  46          HB1       GLN  46   1.843  -1.081  11.424
  341   1HG   GLN  46          HG2       GLN  46   2.635  -3.181  12.414
  342   2HG   GLN  46          HG1       GLN  46   3.903  -3.255  11.199
  343   1HE2  GLN  46          HE21      GLN  46   3.980  -3.088  14.115
  344   2HE2  GLN  46          HE22      GLN  46   4.998  -1.749  14.478
  345    H    ILE  47           HN       ILE  47   1.053  -2.229   7.541
  346    HA   ILE  47           HA       ILE  47  -1.248  -0.482   8.045
  347    HB   ILE  47           HB       ILE  47   0.089  -1.123   5.412
  348   1HG1  ILE  47          HG12      ILE  47   0.310   1.368   7.085
  349   2HG1  ILE  47          HG11      ILE  47   1.555   0.119   7.009
  350   1HG2  ILE  47          HG21      ILE  47  -1.192   0.844   4.603
  351   2HG2  ILE  47          HG22      ILE  47  -1.922   1.003   6.200
  352   3HG2  ILE  47          HG23      ILE  47  -2.258  -0.421   5.219
  353   1HD1  ILE  47          HD11      ILE  47   0.632   1.885   4.741
  354   2HD1  ILE  47          HD12      ILE  47   1.813   0.581   4.601
  355   3HD1  ILE  47          HD13      ILE  47   2.174   1.981   5.597
  356    H    LEU  48           HN       LEU  48  -0.327  -3.310   6.088
  357    HA   LEU  48           HA       LEU  48  -3.036  -3.767   5.416
  358   1HB   LEU  48          HB2       LEU  48  -0.587  -5.431   4.914
  359   2HB   LEU  48          HB1       LEU  48  -2.188  -6.012   4.513
  360    HG   LEU  48           HG       LEU  48  -1.279  -5.187   2.514
  361   1HD1  LEU  48          HD11      LEU  48  -2.731  -3.357   1.879
  362   2HD1  LEU  48          HD12      LEU  48  -3.076  -3.049   3.578
  363   3HD1  LEU  48          HD13      LEU  48  -3.592  -4.571   2.836
  364   1HD2  LEU  48          HD21      LEU  48  -0.375  -2.921   2.220
  365   2HD2  LEU  48          HD22      LEU  48   0.563  -3.861   3.382
  366   3HD2  LEU  48          HD23      LEU  48  -0.570  -2.635   3.949
  367    H    GLU  49           HN       GLU  49  -0.885  -5.451   7.683
  368    HA   GLU  49           HA       GLU  49  -2.858  -7.355   8.420
  369   1HB   GLU  49          HB2       GLU  49  -0.522  -7.853   8.732
  370   2HB   GLU  49          HB1       GLU  49  -0.322  -6.462   9.782
  371   1HG   GLU  49          HG2       GLU  49  -2.056  -7.606  11.287
  372   2HG   GLU  49          HG1       GLU  49  -1.708  -9.052  10.336
  373    H    ARG  50           HN       ARG  50  -1.532  -4.539  10.121
  374    HA   ARG  50           HA       ARG  50  -3.151  -4.804  12.411
  375   1HB   ARG  50          HB2       ARG  50  -1.862  -2.317  11.297
  376   2HB   ARG  50          HB1       ARG  50  -2.573  -2.442  12.890
  377   1HG   ARG  50          HG2       ARG  50  -0.223  -4.080  11.937
  378   2HG   ARG  50          HG1       ARG  50  -0.082  -2.567  12.824
  379   1HD   ARG  50          HD2       ARG  50   0.161  -4.179  14.480
  380   2HD   ARG  50          HD1       ARG  50  -1.539  -3.741  14.603
  381    HE   ARG  50           HE       ARG  50  -0.626  -6.137  13.149
  382   1HH1  ARG  50          HH11      ARG  50  -2.857  -4.619  15.486
  383   2HH1  ARG  50          HH12      ARG  50  -3.583  -6.095  15.930
  384   1HH2  ARG  50          HH21      ARG  50  -1.604  -8.081  13.753
  385   2HH2  ARG  50          HH22      ARG  50  -2.869  -8.150  14.891
  386    H    GLU  51           HN       GLU  51  -3.522  -2.463   9.779
  387    HA   GLU  51           HA       GLU  51  -6.025  -1.473  10.716
  388   1HB   GLU  51          HB2       GLU  51  -4.569  -1.151   8.133
  389   2HB   GLU  51          HB1       GLU  51  -6.058  -0.329   8.518
  390   1HG   GLU  51          HG2       GLU  51  -3.592  -0.053  10.212
  391   2HG   GLU  51          HG1       GLU  51  -4.001   1.039   8.886
  392    H    HIS  52           HN       HIS  52  -5.132  -3.529   7.960
  393    HA   HIS  52           HA       HIS  52  -7.968  -3.584   7.213
  394   1HB   HIS  52          HB2       HIS  52  -5.638  -4.620   5.571
  395   2HB   HIS  52          HB1       HIS  52  -7.329  -4.433   5.115
  396    HD1  HIS  52           HD1      HIS  52  -4.307  -2.249   5.905
  397    HD2  HIS  52           HD2      HIS  52  -8.014  -2.084   4.030
  398    HE1  HIS  52           HE1      HIS  52  -4.306  -0.139   4.614
  399    HE2  HIS  52           HE2      HIS  52  -6.342  -0.355   3.182
  400    H    ASP  53           HN       ASP  53  -5.650  -5.551   8.744
  401    HA   ASP  53           HA       ASP  53  -5.649  -7.594   9.566
  402   1HB   ASP  53          HB2       ASP  53  -7.996  -7.273  10.218
  403   2HB   ASP  53          HB1       ASP  53  -8.538  -7.731   8.617
  404    H    LEU  54           HN       LEU  54  -5.058  -6.911   6.734
  405    HA   LEU  54           HA       LEU  54  -5.175  -9.543   5.451
  406   1HB   LEU  54          HB2       LEU  54  -4.347  -6.831   4.447
  407   2HB   LEU  54          HB1       LEU  54  -3.825  -8.271   3.611
  408    HG   LEU  54           HG       LEU  54  -6.198  -8.845   3.177
  409   1HD1  LEU  54          HD11      LEU  54  -7.908  -7.106   3.516
  410   2HD1  LEU  54          HD12      LEU  54  -6.691  -6.187   4.428
  411   3HD1  LEU  54          HD13      LEU  54  -7.253  -7.733   5.038
  412   1HD2  LEU  54          HD21      LEU  54  -6.577  -7.108   1.504
  413   2HD2  LEU  54          HD22      LEU  54  -4.899  -7.651   1.520
  414   3HD2  LEU  54          HD23      LEU  54  -5.334  -6.112   2.262
  415    H    VAL  55           HN       VAL  55  -3.718 -10.872   6.212
  416    HA   VAL  55           HA       VAL  55  -1.141  -9.935   7.049
  417    HB   VAL  55           HB       VAL  55  -2.160 -12.784   6.763
  418   1HG1  VAL  55          HG11      VAL  55   0.270 -12.694   6.674
  419   2HG1  VAL  55          HG12      VAL  55  -0.271 -13.409   8.192
  420   3HG1  VAL  55          HG13      VAL  55   0.301 -11.739   8.155
  421   1HG2  VAL  55          HG21      VAL  55  -3.423 -11.520   8.424
  422   2HG2  VAL  55          HG22      VAL  55  -1.923 -11.020   9.205
  423   3HG2  VAL  55          HG23      VAL  55  -2.396 -12.719   9.209
  424    H    LEU  56           HN       LEU  56  -0.203  -9.068   5.295
  425    HA   LEU  56           HA       LEU  56   0.433 -10.890   3.082
  426   1HB   LEU  56          HB2       LEU  56   0.624  -7.895   3.127
  427   2HB   LEU  56          HB1       LEU  56   0.872  -8.921   1.739
  428    HG   LEU  56           HG       LEU  56  -1.778  -8.453   3.123
  429   1HD1  LEU  56          HD11      LEU  56  -0.778  -7.602   0.418
  430   2HD1  LEU  56          HD12      LEU  56  -1.050  -6.555   1.812
  431   3HD1  LEU  56          HD13      LEU  56  -2.413  -7.363   1.037
  432   1HD2  LEU  56          HD21      LEU  56  -1.624 -10.736   2.264
  433   2HD2  LEU  56          HD22      LEU  56  -1.150 -10.118   0.681
  434   3HD2  LEU  56          HD23      LEU  56  -2.759  -9.774   1.318
  435    HA   PRO  57           HA       PRO  57   4.336 -10.470   5.265
  436   1HB   PRO  57          HB2       PRO  57   5.002 -13.012   4.075
  437   2HB   PRO  57          HB1       PRO  57   4.712 -12.642   5.780
  438   1HG   PRO  57          HG2       PRO  57   3.026 -14.175   4.288
  439   2HG   PRO  57          HG1       PRO  57   2.451 -13.147   5.616
  440   1HD   PRO  57          HD2       PRO  57   2.474 -12.612   2.670
  441   2HD   PRO  57          HD1       PRO  57   1.163 -12.358   3.850
  442    H    ILE  58           HN       ILE  58   6.657 -10.954   4.504
  443    HA   ILE  58           HA       ILE  58   7.109  -9.060   2.479
  444    HB   ILE  58           HB       ILE  58   9.000 -10.770   4.090
  445   1HG1  ILE  58          HG12      ILE  58   9.814  -8.430   4.768
  446   2HG1  ILE  58          HG11      ILE  58   8.402  -7.870   3.865
  447   1HG2  ILE  58          HG21      ILE  58  10.077 -10.642   1.937
  448   2HG2  ILE  58          HG22      ILE  58  10.926  -9.628   3.105
  449   3HG2  ILE  58          HG23      ILE  58   9.869  -8.893   1.903
  450   1HD1  ILE  58          HD11      ILE  58   8.004  -7.937   6.269
  451   2HD1  ILE  58          HD12      ILE  58   8.315  -9.673   6.256
  452   3HD1  ILE  58          HD13      ILE  58   6.932  -9.018   5.376
  453    H    ARG  59           HN       ARG  59   7.323 -12.530   2.405
  454    HA   ARG  59           HA       ARG  59   8.562 -12.752  -0.083
  455   1HB   ARG  59          HB2       ARG  59   7.801 -15.043  -0.238
  456   2HB   ARG  59          HB1       ARG  59   8.263 -14.710   1.414
  457   1HG   ARG  59          HG2       ARG  59   5.406 -14.722   0.441
  458   2HG   ARG  59          HG1       ARG  59   6.236 -16.114   1.125
  459   1HD   ARG  59          HD2       ARG  59   5.897 -13.502   2.560
  460   2HD   ARG  59          HD1       ARG  59   4.771 -14.851   2.716
  461    HE   ARG  59           HE       ARG  59   7.632 -15.019   3.457
  462   1HH1  ARG  59          HH11      ARG  59   4.209 -15.841   4.164
  463   2HH1  ARG  59          HH12      ARG  59   4.569 -16.516   5.670
  464   1HH2  ARG  59          HH21      ARG  59   8.072 -16.040   5.479
  465   2HH2  ARG  59          HH22      ARG  59   6.811 -16.635   6.453
  466    H    GLU  60           HN       GLU  60   5.353 -11.723   0.577
  467    HA   GLU  60           HA       GLU  60   4.577 -11.997  -2.245
  468   1HB   GLU  60          HB2       GLU  60   2.999 -11.021   0.150
  469   2HB   GLU  60          HB1       GLU  60   2.365 -11.230  -1.473
  470   1HG   GLU  60          HG2       GLU  60   3.438 -13.435   0.259
  471   2HG   GLU  60          HG1       GLU  60   1.734 -13.033   0.069
  472    H    VAL  61           HN       VAL  61   5.011  -9.648   0.344
  473    HA   VAL  61           HA       VAL  61   4.328  -7.299  -0.963
  474    HB   VAL  61           HB       VAL  61   6.327  -7.714   1.285
  475   1HG1  VAL  61          HG11      VAL  61   4.991  -5.159   0.394
  476   2HG1  VAL  61          HG12      VAL  61   6.705  -5.543   0.233
  477   3HG1  VAL  61          HG13      VAL  61   5.990  -5.354   1.833
  478   1HG2  VAL  61          HG21      VAL  61   3.419  -6.941   1.309
  479   2HG2  VAL  61          HG22      VAL  61   4.468  -7.024   2.724
  480   3HG2  VAL  61          HG23      VAL  61   4.094  -8.490   1.813
  481    H    ARG  62           HN       ARG  62   7.356  -9.021  -1.013
  482    HA   ARG  62           HA       ARG  62   8.877  -6.947  -2.057
  483   1HB   ARG  62          HB2       ARG  62   9.249  -9.815  -1.736
  484   2HB   ARG  62          HB1       ARG  62  10.298  -9.094  -2.928
  485   1HG   ARG  62          HG2       ARG  62  10.917  -7.399  -1.164
  486   2HG   ARG  62          HG1       ARG  62   9.995  -8.381  -0.024
  487   1HD   ARG  62          HD2       ARG  62  11.431 -10.288  -0.472
  488   2HD   ARG  62          HD1       ARG  62  12.333  -9.344  -1.659
  489    HE   ARG  62           HE       ARG  62  12.793  -7.828   0.362
  490   1HH1  ARG  62          HH11      ARG  62  12.547 -11.353   0.527
  491   2HH1  ARG  62          HH12      ARG  62  13.586 -11.473   1.884
  492   1HH2  ARG  62          HH21      ARG  62  14.201  -8.002   2.117
  493   2HH2  ARG  62          HH22      ARG  62  14.580  -9.503   2.831
  494    H    GLN  63           HN       GLN  63   6.553  -8.830  -3.772
  495    HA   GLN  63           HA       GLN  63   7.863  -8.107  -6.293
  496   1HB   GLN  63          HB2       GLN  63   5.425  -9.844  -5.943
  497   2HB   GLN  63          HB1       GLN  63   6.162  -9.437  -7.449
  498   1HG   GLN  63          HG2       GLN  63   6.922 -11.624  -6.983
  499   2HG   GLN  63          HG1       GLN  63   8.282 -10.540  -6.742
  500   1HE2  GLN  63          HE21      GLN  63   5.644 -11.059  -4.475
  501   2HE2  GLN  63          HE22      GLN  63   6.611 -11.861  -3.287
  502    H    LEU  64           HN       LEU  64   5.838  -6.746  -4.192
  503    HA   LEU  64           HA       LEU  64   3.903  -5.648  -5.963
  504   1HB   LEU  64          HB2       LEU  64   4.890  -4.427  -3.385
  505   2HB   LEU  64          HB1       LEU  64   3.366  -4.132  -4.184
  506    HG   LEU  64           HG       LEU  64   4.215  -6.555  -2.656
  507   1HD1  LEU  64          HD11      LEU  64   2.297  -5.999  -1.233
  508   2HD1  LEU  64          HD12      LEU  64   2.016  -4.558  -2.213
  509   3HD1  LEU  64          HD13      LEU  64   3.508  -4.718  -1.287
  510   1HD2  LEU  64          HD21      LEU  64   2.959  -7.318  -4.595
  511   2HD2  LEU  64          HD22      LEU  64   1.668  -6.172  -4.227
  512   3HD2  LEU  64          HD23      LEU  64   1.999  -7.510  -3.129
  513    H    THR  65           HN       THR  65   3.967  -3.515  -6.780
  514    HA   THR  65           HA       THR  65   6.637  -2.451  -7.160
  515    HB   THR  65           HB       THR  65   5.417  -1.145  -8.925
  516    HG1  THR  65           HG1      THR  65   3.191  -2.213  -9.298
  517   1HG2  THR  65          HG21      THR  65   5.018  -3.088 -10.401
  518   2HG2  THR  65          HG22      THR  65   5.044  -4.141  -8.965
  519   3HG2  THR  65          HG23      THR  65   6.497  -3.281  -9.450
  520    H    LEU  66           HN       LEU  66   6.387   0.104  -7.289
  521    HA   LEU  66           HA       LEU  66   6.053   0.785  -4.551
  522   1HB   LEU  66          HB2       LEU  66   7.706   1.759  -6.258
  523   2HB   LEU  66          HB1       LEU  66   6.372   2.707  -6.868
  524    HG   LEU  66           HG       LEU  66   7.875   3.995  -5.397
  525   1HD1  LEU  66          HD11      LEU  66   6.172   4.967  -3.937
  526   2HD1  LEU  66          HD12      LEU  66   5.146   3.559  -4.291
  527   3HD1  LEU  66          HD13      LEU  66   5.578   4.675  -5.585
  528   1HD2  LEU  66          HD21      LEU  66   8.581   2.210  -3.902
  529   2HD2  LEU  66          HD22      LEU  66   6.946   2.102  -3.246
  530   3HD2  LEU  66          HD23      LEU  66   7.903   3.561  -2.989
  531    H    ARG  67           HN       ARG  67   4.100   1.433  -7.415
  532    HA   ARG  67           HA       ARG  67   2.195   2.858  -5.782
  533   1HB   ARG  67          HB2       ARG  67   2.277   2.206  -8.695
  534   2HB   ARG  67          HB1       ARG  67   0.870   2.934  -7.933
  535   1HG   ARG  67          HG2       ARG  67   3.637   4.118  -7.952
  536   2HG   ARG  67          HG1       ARG  67   2.315   4.576  -9.029
  537   1HD   ARG  67          HD2       ARG  67   0.975   5.037  -6.892
  538   2HD   ARG  67          HD1       ARG  67   2.507   4.911  -6.055
  539    HE   ARG  67           HE       ARG  67   3.154   6.936  -6.835
  540   1HH1  ARG  67          HH11      ARG  67   0.278   5.914  -8.656
  541   2HH1  ARG  67          HH12      ARG  67   0.092   7.346  -9.525
  542   1HH2  ARG  67          HH21      ARG  67   2.842   9.058  -8.009
  543   2HH2  ARG  67          HH22      ARG  67   1.562   9.163  -9.115
  544    H    LYS  68           HN       LYS  68   2.799  -0.322  -6.454
  545    HA   LYS  68           HA       LYS  68   0.257  -1.512  -6.673
  546   1HB   LYS  68          HB2       LYS  68   2.515  -2.643  -6.823
  547   2HB   LYS  68          HB1       LYS  68   2.578  -2.566  -5.074
  548   1HG   LYS  68          HG2       LYS  68   1.844  -4.721  -5.537
  549   2HG   LYS  68          HG1       LYS  68   0.379  -3.815  -5.121
  550   1HD   LYS  68          HD2       LYS  68  -0.117  -3.508  -7.490
  551   2HD   LYS  68          HD1       LYS  68   1.387  -4.380  -7.858
  552   1HE   LYS  68          HE2       LYS  68  -0.847  -5.553  -6.273
  553   2HE   LYS  68          HE1       LYS  68  -0.698  -5.763  -8.027
  554   1HZ   LYS  68          HZ1       LYS  68   0.280  -7.648  -6.857
  555   2HZ   LYS  68          HZ2       LYS  68   1.255  -6.646  -5.953
  556   3HZ   LYS  68          HZ3       LYS  68   1.516  -6.771  -7.610
  557    H    LEU  69           HN       LEU  69   2.077  -0.219  -4.099
  558    HA   LEU  69           HA       LEU  69   0.730  -1.208  -1.860
  559   1HB   LEU  69          HB2       LEU  69   2.239   1.359  -2.237
  560   2HB   LEU  69          HB1       LEU  69   1.404   1.047  -0.737
  561    HG   LEU  69           HG       LEU  69   3.689   0.515  -0.425
  562   1HD1  LEU  69          HD11      LEU  69   3.619  -1.837   0.199
  563   2HD1  LEU  69          HD12      LEU  69   2.127  -2.026  -0.720
  564   3HD1  LEU  69          HD13      LEU  69   2.165  -0.964   0.685
  565   1HD2  LEU  69          HD21      LEU  69   3.485  -1.305  -2.814
  566   2HD2  LEU  69          HD22      LEU  69   4.886  -1.159  -1.752
  567   3HD2  LEU  69          HD23      LEU  69   4.379   0.213  -2.741
  568    H    GLN  70           HN       GLN  70  -0.135   1.542  -3.898
  569    HA   GLN  70           HA       GLN  70  -2.452   1.817  -2.195
  570   1HB   GLN  70          HB2       GLN  70  -3.046   3.838  -3.539
  571   2HB   GLN  70          HB1       GLN  70  -1.566   3.951  -2.616
  572   1HG   GLN  70          HG2       GLN  70  -0.276   3.601  -4.649
  573   2HG   GLN  70          HG1       GLN  70  -1.784   3.494  -5.594
  574   1HE2  GLN  70          HE21      GLN  70  -1.234   5.326  -6.812
  575   2HE2  GLN  70          HE22      GLN  70  -1.277   6.913  -6.121
  576    H    GLU  71           HN       GLU  71  -1.566   0.443  -5.115
  577    HA   GLU  71           HA       GLU  71  -4.118   0.379  -6.351
  578   1HB   GLU  71          HB2       GLU  71  -1.938  -0.029  -7.531
  579   2HB   GLU  71          HB1       GLU  71  -1.816  -1.561  -6.683
  580   1HG   GLU  71          HG2       GLU  71  -2.569  -1.942  -8.915
  581   2HG   GLU  71          HG1       GLU  71  -3.881  -2.299  -7.795
  582    H    MET  72           HN       MET  72  -2.457  -1.795  -4.204
  583    HA   MET  72           HA       MET  72  -5.003  -3.257  -3.886
  584   1HB   MET  72          HB2       MET  72  -3.688  -5.169  -3.059
  585   2HB   MET  72          HB1       MET  72  -3.212  -4.727  -4.691
  586   1HG   MET  72          HG2       MET  72  -1.255  -3.548  -3.725
  587   2HG   MET  72          HG1       MET  72  -1.737  -4.137  -2.133
  588   1HE   MET  72          HE1       MET  72  -2.773  -7.067  -2.728
  589   2HE   MET  72          HE2       MET  72  -1.671  -6.686  -1.405
  590   3HE   MET  72          HE3       MET  72  -1.296  -8.006  -2.512
  591    H    SER  73           HN       SER  73  -4.381  -0.794  -2.693
  592    HA   SER  73           HA       SER  73  -3.407  -1.076  -0.053
  593   1HB   SER  73          HB2       SER  73  -4.336   1.188   0.290
  594   2HB   SER  73          HB1       SER  73  -3.312   1.077  -1.146
  595    HG   SER  73           HG       SER  73  -5.050   1.312  -2.417
  596    H    SER  74           HN       SER  74  -6.488  -1.483  -1.537
  597    HA   SER  74           HA       SER  74  -8.554  -2.080  -0.787
  598   1HB   SER  74          HB2       SER  74  -7.252  -3.855   0.526
  599   2HB   SER  74          HB1       SER  74  -7.169  -2.720   1.868
  600    HG   SER  74           HG       SER  74  -9.222  -3.096   2.339
  601    H    LYS  75           HN       LYS  75  -7.542   0.450  -0.764
  602    HA   LYS  75           HA       LYS  75  -9.235   1.804   1.152
  603   1HB   LYS  75          HB2       LYS  75  -7.210   1.897   2.416
  604   2HB   LYS  75          HB1       LYS  75  -6.243   2.251   0.988
  605   1HG   LYS  75          HG2       LYS  75  -7.451   4.444   0.811
  606   2HG   LYS  75          HG1       LYS  75  -8.220   4.082   2.351
  607   1HD   LYS  75          HD2       LYS  75  -5.233   4.127   2.041
  608   2HD   LYS  75          HD1       LYS  75  -6.151   5.595   2.355
  609   1HE   LYS  75          HE2       LYS  75  -6.100   3.120   4.070
  610   2HE   LYS  75          HE1       LYS  75  -5.258   4.633   4.404
  611   1HZ   LYS  75          HZ1       LYS  75  -7.294   4.604   5.659
  612   2HZ   LYS  75          HZ2       LYS  75  -8.179   4.162   4.338
  613   3HZ   LYS  75          HZ3       LYS  75  -7.498   5.724   4.399
  614    H    ALA  76           HN       ALA  76  -6.643   2.515  -1.214
  615    HA   ALA  76           HA       ALA  76  -6.362   4.067  -2.793
  616   1HB   ALA  76          HB1       ALA  76  -9.391   4.094  -3.020
  617   2HB   ALA  76          HB2       ALA  76  -8.315   3.032  -3.927
  618   3HB   ALA  76          HB3       ALA  76  -8.268   4.773  -4.196
  619    H    GLY  77           HN       GLY  77  -9.222   4.990  -0.999
  620   1HA   GLY  77          HA2       GLY  77  -8.013   7.049   0.457
  621   2HA   GLY  77          HA1       GLY  77  -8.948   7.716  -0.888
  622    H    SER  78           HN       SER  78 -10.791   8.365  -0.122
  623    HA   SER  78           HA       SER  78 -12.694   6.423   0.897
  624   1HB   SER  78          HB2       SER  78 -12.139   9.045   2.380
  625   2HB   SER  78          HB1       SER  78 -13.367   7.853   2.810
  626    HG   SER  78           HG       SER  78 -11.084   6.582   2.662
  627    H    ASP  79           HN       ASP  79 -12.137   7.636  -1.483
  628    HA   ASP  79           HA       ASP  79 -13.800  10.049  -1.684
  629   1HB   ASP  79          HB2       ASP  79 -11.497   9.135  -3.421
  630   2HB   ASP  79          HB1       ASP  79 -12.388  10.641  -3.596
  631    H    THR  80           HN       THR  80 -13.620   6.792  -2.523
  632    HA   THR  80           HA       THR  80 -15.101   7.055  -4.973
  633    HB   THR  80           HB       THR  80 -13.432   5.176  -4.563
  634    HG1  THR  80           HG1      THR  80 -15.729   3.749  -5.071
  635   1HG2  THR  80          HG21      THR  80 -14.192   3.211  -3.280
  636   2HG2  THR  80          HG22      THR  80 -15.649   4.084  -2.812
  637   3HG2  THR  80          HG23      THR  80 -14.072   4.635  -2.244
  638    H    GLU  81           HN       GLU  81 -15.911   7.512  -1.892
  639    HA   GLU  81           HA       GLU  81 -18.497   6.233  -1.904
  640   1HB   GLU  81          HB2       GLU  81 -17.184   6.567   0.205
  641   2HB   GLU  81          HB1       GLU  81 -17.329   8.301  -0.012
  642   1HG   GLU  81          HG2       GLU  81 -19.683   8.223   0.334
  643   2HG   GLU  81          HG1       GLU  81 -19.682   6.459   0.309
  644    H    LEU  82           HN       LEU  82 -20.315   7.171  -2.646
  645    HA   LEU  82           HA       LEU  82 -19.971   9.649  -4.115
  646   1HB   LEU  82          HB2       LEU  82 -22.183   7.585  -4.133
  647   2HB   LEU  82          HB1       LEU  82 -22.293   9.100  -4.993
  648    HG   LEU  82           HG       LEU  82 -20.321   8.385  -6.376
  649   1HD1  LEU  82          HD11      LEU  82 -20.745   5.722  -5.048
  650   2HD1  LEU  82          HD12      LEU  82 -19.333   6.759  -4.863
  651   3HD1  LEU  82          HD13      LEU  82 -19.698   6.039  -6.431
  652   1HD2  LEU  82          HD21      LEU  82 -22.721   6.576  -6.421
  653   2HD2  LEU  82          HD22      LEU  82 -21.580   6.811  -7.745
  654   3HD2  LEU  82          HD23      LEU  82 -22.583   8.154  -7.198
  655    H    ALA  83           HN       ALA  83 -21.473  11.344  -3.965
  656    HA   ALA  83           HA       ALA  83 -22.703  11.494  -1.314
  657   1HB   ALA  83          HB1       ALA  83 -22.373  13.896  -1.437
  658   2HB   ALA  83          HB2       ALA  83 -21.663  13.726  -3.041
  659   3HB   ALA  83          HB3       ALA  83 -20.843  13.043  -1.638
  660    H    ALA  84           HN       ALA  84 -24.735  11.013  -1.580
  661    HA   ALA  84           HA       ALA  84 -26.295  12.593  -3.492
  662   1HB   ALA  84          HB1       ALA  84 -26.289  10.249  -4.213
  663   2HB   ALA  84          HB2       ALA  84 -27.884  10.698  -3.613
  664   3HB   ALA  84          HB3       ALA  84 -26.797   9.739  -2.604
  665    HA   PRO  85           HA       PRO  85 -27.654  14.404   0.332
  666   1HB   PRO  85          HB2       PRO  85 -30.027  14.939  -1.404
  667   2HB   PRO  85          HB1       PRO  85 -29.168  16.032  -0.309
  668   1HG   PRO  85          HG2       PRO  85 -28.743  16.172  -2.914
  669   2HG   PRO  85          HG1       PRO  85 -27.390  16.317  -1.775
  670   1HD   PRO  85          HD2       PRO  85 -28.159  14.029  -3.523
  671   2HD   PRO  85          HD1       PRO  85 -26.548  14.573  -3.017
  672    H    LYS  86           HN       LYS  86 -28.019  12.801   1.665
  673    HA   LYS  86           HA       LYS  86 -30.299  11.024   1.490
  674   1HB   LYS  86          HB2       LYS  86 -28.147  10.240   2.331
  675   2HB   LYS  86          HB1       LYS  86 -28.176  11.456   3.596
  676   1HG   LYS  86          HG2       LYS  86 -30.056  10.341   4.646
  677   2HG   LYS  86          HG1       LYS  86 -30.110   9.161   3.336
  678   1HD   LYS  86          HD2       LYS  86 -28.956   8.243   5.275
  679   2HD   LYS  86          HD1       LYS  86 -27.848   8.411   3.916
  680   1HE   LYS  86          HE2       LYS  86 -27.022  10.525   4.898
  681   2HE   LYS  86          HE1       LYS  86 -28.099  10.286   6.273
  682   1HZ   LYS  86          HZ1       LYS  86 -25.867   8.510   5.458
  683   2HZ   LYS  86          HZ2       LYS  86 -26.952   8.179   6.697
  684   3HZ   LYS  86          HZ3       LYS  86 -25.904   9.512   6.834
  685    H    SER  87           HN       SER  87 -29.260  13.805   3.245
  686    HA   SER  87           HA       SER  87 -32.030  14.335   3.996
  687   1HB   SER  87          HB2       SER  87 -31.131  15.227   6.223
  688   2HB   SER  87          HB1       SER  87 -31.096  13.470   6.038
  689    HG   SER  87           HG       SER  87 -28.798  13.990   5.174
  690    H    LYS  88           HN       LYS  88 -29.402  16.263   5.122
  691    HA   LYS  88           HA       LYS  88 -29.832  18.261   2.995
  692   1HB   LYS  88          HB2       LYS  88 -28.339  18.433   5.649
  693   2HB   LYS  88          HB1       LYS  88 -28.264  19.690   4.434
  694   1HG   LYS  88          HG2       LYS  88 -29.784  20.387   6.123
  695   2HG   LYS  88          HG1       LYS  88 -30.733  19.987   4.699
  696   1HD   LYS  88          HD2       LYS  88 -31.323  17.834   5.692
  697   2HD   LYS  88          HD1       LYS  88 -30.321  18.204   7.096
  698   1HE   LYS  88          HE2       LYS  88 -32.657  18.638   7.586
  699   2HE   LYS  88          HE1       LYS  88 -31.737  20.138   7.593
  700   1HZ   LYS  88          HZ1       LYS  88 -33.831  20.414   6.443
  701   2HZ   LYS  88          HZ2       LYS  88 -33.491  19.165   5.390
  702   3HZ   LYS  88          HZ3       LYS  88 -32.591  20.576   5.318
  703    H    ASN  89           HN       ASN  89 -27.953  15.779   4.136
  704    HA   ASN  89           HA       ASN  89 -25.949  16.013   2.118
  705   1HB   ASN  89          HB2       ASN  89 -25.413  15.383   5.066
  706   2HB   ASN  89          HB1       ASN  89 -24.234  15.283   3.772
  707   1HD2  ASN  89          HD21      ASN  89 -25.897  17.348   5.971
  708   2HD2  ASN  89          HD22      ASN  89 -25.000  18.794   5.620
  Start of MODEL   14
    1   1H    GLY   1          HT1       GLY   1 -13.915  12.894  16.602
    2   2H    GLY   1          HT2       GLY   1 -14.922  13.458  15.336
    3   3H    GLY   1          HT3       GLY   1 -13.230  13.681  15.278
    4   1HA   GLY   1          HA1       GLY   1 -14.510  11.038  15.282
    5   2HA   GLY   1          HA2       GLY   1 -13.976  11.892  13.835
    6    H    ASP   2           HN       ASP   2 -12.274  10.729  13.189
    7    HA   ASP   2           HA       ASP   2 -10.173  10.202  12.983
    8   1HB   ASP   2          HB2       ASP   2  -9.795  11.836  15.458
    9   2HB   ASP   2          HB1       ASP   2  -8.462  10.861  14.845
   10    H    GLY   3           HN       GLY   3  -8.288   9.001  14.019
   11   1HA   GLY   3          HA2       GLY   3  -7.617   6.970  14.926
   12   2HA   GLY   3          HA1       GLY   3  -9.217   6.797  15.667
   13    H    GLU   4           HN       GLU   4  -8.956   7.757  12.450
   14    HA   GLU   4           HA       GLU   4 -10.034   5.182  11.496
   15   1HB   GLU   4          HB2       GLU   4 -11.482   6.550  10.024
   16   2HB   GLU   4          HB1       GLU   4 -11.807   6.809  11.735
   17   1HG   GLU   4          HG2       GLU   4 -10.481   8.858  11.686
   18   2HG   GLU   4          HG1       GLU   4 -10.141   8.607   9.982
   19    H    ALA   5           HN       ALA   5  -7.539   7.370  11.281
   20    HA   ALA   5           HA       ALA   5  -7.289   7.377   8.420
   21   1HB   ALA   5          HB1       ALA   5  -6.679   9.361   9.717
   22   2HB   ALA   5          HB2       ALA   5  -5.331   8.744   8.763
   23   3HB   ALA   5          HB3       ALA   5  -5.392   8.443  10.499
   24    H    GLN   6           HN       GLN   6  -6.621   5.658   7.466
   25    HA   GLN   6           HA       GLN   6  -4.388   4.101   8.553
   26   1HB   GLN   6          HB2       GLN   6  -6.308   2.861   7.605
   27   2HB   GLN   6          HB1       GLN   6  -6.121   3.731   6.089
   28   1HG   GLN   6          HG2       GLN   6  -3.723   2.736   6.117
   29   2HG   GLN   6          HG1       GLN   6  -4.411   1.588   7.266
   30   1HE2  GLN   6          HE21      GLN   6  -4.146  -0.122   5.813
   31   2HE2  GLN   6          HE22      GLN   6  -5.115  -0.271   4.389
   32    H    ARG   7           HN       ARG   7  -2.383   4.770   7.846
   33    HA   ARG   7           HA       ARG   7  -2.253   6.721   5.753
   34   1HB   ARG   7          HB2       ARG   7  -0.667   6.789   7.675
   35   2HB   ARG   7          HB1       ARG   7   0.041   5.279   7.116
   36   1HG   ARG   7          HG2       ARG   7   0.776   6.305   5.084
   37   2HG   ARG   7          HG1       ARG   7  -0.057   7.795   5.483
   38   1HD   ARG   7          HD2       ARG   7   2.278   8.103   5.950
   39   2HD   ARG   7          HD1       ARG   7   1.416   8.034   7.481
   40    HE   ARG   7           HE       ARG   7   2.217   5.491   7.209
   41   1HH1  ARG   7          HH11      ARG   7   3.989   8.565   6.954
   42   2HH1  ARG   7          HH12      ARG   7   5.503   7.856   7.283
   43   1HH2  ARG   7          HH21      ARG   7   4.382   4.550   7.683
   44   2HH2  ARG   7          HH22      ARG   7   5.702   5.575   7.767
   45    H    ASP   8           HN       ASP   8  -1.980   6.410   3.678
   46    HA   ASP   8           HA       ASP   8  -2.183   3.863   2.530
   47   1HB   ASP   8          HB2       ASP   8  -2.924   5.882   1.381
   48   2HB   ASP   8          HB1       ASP   8  -1.258   6.438   1.258
   49    H    LEU   9           HN       LEU   9  -0.750   2.579   1.471
   50    HA   LEU   9           HA       LEU   9   1.742   2.285   2.626
   51   1HB   LEU   9          HB2       LEU   9   0.675   1.090   0.096
   52   2HB   LEU   9          HB1       LEU   9   2.150   0.571   0.883
   53    HG   LEU   9           HG       LEU   9  -0.655   0.354   1.954
   54   1HD1  LEU   9          HD11      LEU   9  -0.070  -1.318   0.299
   55   2HD1  LEU   9          HD12      LEU   9  -0.213  -2.028   1.905
   56   3HD1  LEU   9          HD13      LEU   9   1.385  -1.732   1.210
   57   1HD2  LEU   9          HD21      LEU   9   0.851   0.951   3.739
   58   2HD2  LEU   9          HD22      LEU   9   1.953  -0.351   3.277
   59   3HD2  LEU   9          HD23      LEU   9   0.339  -0.729   3.901
   60    H    VAL  10           HN       VAL  10   0.958   4.084  -0.337
   61    HA   VAL  10           HA       VAL  10   3.735   4.212  -1.110
   62    HB   VAL  10           HB       VAL  10   1.341   5.854  -2.034
   63   1HG1  VAL  10          HG11      VAL  10   3.405   7.186  -2.286
   64   2HG1  VAL  10          HG12      VAL  10   2.770   6.684  -3.851
   65   3HG1  VAL  10          HG13      VAL  10   4.154   5.846  -3.152
   66   1HG2  VAL  10          HG21      VAL  10   2.928   3.669  -3.327
   67   2HG2  VAL  10          HG22      VAL  10   1.627   4.579  -4.083
   68   3HG2  VAL  10          HG23      VAL  10   1.289   3.541  -2.682
   69    H    LYS  11           HN       LYS  11   1.522   6.086   0.722
   70    HA   LYS  11           HA       LYS  11   3.433   8.202   1.129
   71   1HB   LYS  11          HB2       LYS  11   0.614   7.742   1.901
   72   2HB   LYS  11          HB1       LYS  11   1.515   8.974   2.797
   73   1HG   LYS  11          HG2       LYS  11   0.285  10.057   1.034
   74   2HG   LYS  11          HG1       LYS  11   1.985  10.087   0.598
   75   1HD   LYS  11          HD2       LYS  11   0.897   9.519  -1.397
   76   2HD   LYS  11          HD1       LYS  11   1.464   7.972  -0.771
   77   1HE   LYS  11          HE2       LYS  11  -0.766   7.683  -1.556
   78   2HE   LYS  11          HE1       LYS  11  -0.805   7.625   0.206
   79   1HZ   LYS  11          HZ1       LYS  11  -1.549   9.944  -1.501
   80   2HZ   LYS  11          HZ2       LYS  11  -1.532  10.004   0.167
   81   3HZ   LYS  11          HZ3       LYS  11  -2.621   8.991  -0.617
   82    H    ALA  12           HN       ALA  12   3.406   5.291   2.149
   83    HA   ALA  12           HA       ALA  12   4.498   5.923   4.790
   84   1HB   ALA  12          HB1       ALA  12   3.365   3.301   3.784
   85   2HB   ALA  12          HB2       ALA  12   2.575   4.404   4.910
   86   3HB   ALA  12          HB3       ALA  12   4.057   3.572   5.384
   87    H    VAL  13           HN       VAL  13   4.816   3.371   2.313
   88    HA   VAL  13           HA       VAL  13   7.495   2.746   3.014
   89    HB   VAL  13           HB       VAL  13   5.889   1.952   0.570
   90   1HG1  VAL  13          HG11      VAL  13   8.405   0.737   1.708
   91   2HG1  VAL  13          HG12      VAL  13   8.273   1.656   0.208
   92   3HG1  VAL  13          HG13      VAL  13   7.466   0.096   0.355
   93   1HG2  VAL  13          HG21      VAL  13   5.473  -0.134   1.791
   94   2HG2  VAL  13          HG22      VAL  13   4.825   1.271   2.642
   95   3HG2  VAL  13          HG23      VAL  13   6.332   0.528   3.184
   96    H    ALA  14           HN       ALA  14   6.088   4.273   0.118
   97    HA   ALA  14           HA       ALA  14   8.609   4.812  -1.060
   98   1HB   ALA  14          HB1       ALA  14   7.333   6.259  -2.628
   99   2HB   ALA  14          HB2       ALA  14   5.915   6.095  -1.584
  100   3HB   ALA  14          HB3       ALA  14   6.560   4.687  -2.410
  101    H    HIS  15           HN       HIS  15   6.572   6.426   1.164
  102    HA   HIS  15           HA       HIS  15   7.750   9.005   0.998
  103   1HB   HIS  15          HB2       HIS  15   5.440   8.395   1.864
  104   2HB   HIS  15          HB1       HIS  15   6.231   7.858   3.332
  105    HD1  HIS  15           HD1      HIS  15   4.682   9.689   4.495
  106    HD2  HIS  15           HD2      HIS  15   7.596  11.200   1.946
  107    HE1  HIS  15           HE1      HIS  15   4.801  12.129   4.976
  108    HE2  HIS  15           HE2      HIS  15   6.227  13.036   3.170
  109    H    ILE  16           HN       ILE  16   8.644   6.063   2.621
  110    HA   ILE  16           HA       ILE  16  10.412   7.175   4.549
  111    HB   ILE  16           HB       ILE  16  10.396   4.457   3.183
  112   1HG1  ILE  16          HG12      ILE  16   8.514   4.815   4.664
  113   2HG1  ILE  16          HG11      ILE  16   9.614   3.635   5.371
  114   1HG2  ILE  16          HG21      ILE  16  12.690   4.908   3.835
  115   2HG2  ILE  16          HG22      ILE  16  11.993   3.654   4.858
  116   3HG2  ILE  16          HG23      ILE  16  12.169   5.297   5.474
  117   1HD1  ILE  16          HD11      ILE  16   9.419   6.543   6.131
  118   2HD1  ILE  16          HD12      ILE  16  10.510   5.357   6.853
  119   3HD1  ILE  16          HD13      ILE  16   8.766   5.182   7.044
  120    H    LEU  17           HN       LEU  17  10.727   6.233   1.221
  121    HA   LEU  17           HA       LEU  17  13.514   6.895   1.022
  122   1HB   LEU  17          HB2       LEU  17  11.444   6.550  -1.155
  123   2HB   LEU  17          HB1       LEU  17  13.178   6.615  -1.393
  124    HG   LEU  17           HG       LEU  17  11.687   4.433   0.071
  125   1HD1  LEU  17          HD11      LEU  17  11.313   4.370  -2.325
  126   2HD1  LEU  17          HD12      LEU  17  12.345   3.034  -1.814
  127   3HD1  LEU  17          HD13      LEU  17  13.052   4.442  -2.610
  128   1HD2  LEU  17          HD21      LEU  17  14.609   4.697  -0.619
  129   2HD2  LEU  17          HD22      LEU  17  13.841   3.285   0.109
  130   3HD2  LEU  17          HD23      LEU  17  13.911   4.806   0.997
  131    H    GLY  18           HN       GLY  18  10.493   8.369   0.032
  132   1HA   GLY  18          HA2       GLY  18  10.406  10.849   0.515
  133   2HA   GLY  18          HA1       GLY  18  11.930  10.924  -0.362
  134    H    ILE  19           HN       ILE  19   9.504   8.716  -1.377
  135    HA   ILE  19           HA       ILE  19   8.900  10.452  -3.617
  136    HB   ILE  19           HB       ILE  19   8.314   8.124  -4.690
  137   1HG1  ILE  19          HG12      ILE  19  10.598   7.401  -2.845
  138   2HG1  ILE  19          HG11      ILE  19   8.958   6.775  -2.755
  139   1HG2  ILE  19          HG21      ILE  19  11.101   9.280  -4.605
  140   2HG2  ILE  19          HG22      ILE  19   9.762   9.753  -5.671
  141   3HG2  ILE  19          HG23      ILE  19  10.490   8.160  -5.834
  142   1HD1  ILE  19          HD11      ILE  19  10.898   6.334  -5.015
  143   2HD1  ILE  19          HD12      ILE  19   9.259   5.692  -4.923
  144   3HD1  ILE  19          HD13      ILE  19  10.478   5.170  -3.759
  145    H    ARG  20           HN       ARG  20   6.899  10.216  -4.541
  146    HA   ARG  20           HA       ARG  20   4.743   8.777  -3.344
  147   1HB   ARG  20          HB2       ARG  20   5.006  10.522  -1.617
  148   2HB   ARG  20          HB1       ARG  20   4.851  11.756  -2.863
  149   1HG   ARG  20          HG2       ARG  20   2.606  10.643  -3.397
  150   2HG   ARG  20          HG1       ARG  20   2.788   9.875  -1.824
  151   1HD   ARG  20          HD2       ARG  20   1.485  11.933  -1.627
  152   2HD   ARG  20          HD1       ARG  20   3.006  12.040  -0.737
  153    HE   ARG  20           HE       ARG  20   3.565  13.069  -3.208
  154   1HH1  ARG  20          HH11      ARG  20   1.220  13.902  -0.684
  155   2HH1  ARG  20          HH12      ARG  20   1.199  15.551  -1.111
  156   1HH2  ARG  20          HH21      ARG  20   3.582  15.199  -3.722
  157   2HH2  ARG  20          HH22      ARG  20   2.614  16.353  -2.884
  158    H    ASP  21           HN       ASP  21   5.825  11.572  -5.128
  159    HA   ASP  21           HA       ASP  21   3.521  11.498  -6.867
  160   1HB   ASP  21          HB2       ASP  21   5.940  13.312  -6.844
  161   2HB   ASP  21          HB1       ASP  21   4.583  13.473  -7.953
  162    H    LEU  22           HN       LEU  22   6.856  10.651  -6.920
  163    HA   LEU  22           HA       LEU  22   8.112   9.446  -8.341
  164   1HB   LEU  22          HB2       LEU  22   5.463   8.320  -9.285
  165   2HB   LEU  22          HB1       LEU  22   7.025   7.692  -9.734
  166    HG   LEU  22           HG       LEU  22   6.217   6.235  -8.175
  167   1HD1  LEU  22          HD11      LEU  22   7.682   6.391  -6.258
  168   2HD1  LEU  22          HD12      LEU  22   7.998   8.084  -6.681
  169   3HD1  LEU  22          HD13      LEU  22   8.473   6.808  -7.786
  170   1HD2  LEU  22          HD21      LEU  22   4.343   7.459  -7.308
  171   2HD2  LEU  22          HD22      LEU  22   5.419   8.525  -6.406
  172   3HD2  LEU  22          HD23      LEU  22   5.304   6.819  -5.978
  173    H    ALA  23           HN       ALA  23   8.575  11.526  -9.348
  174    HA   ALA  23           HA       ALA  23   7.080  12.085 -11.711
  175   1HB   ALA  23          HB1       ALA  23   8.499  14.062 -11.950
  176   2HB   ALA  23          HB2       ALA  23   9.517  13.492 -10.626
  177   3HB   ALA  23          HB3       ALA  23   7.841  13.951 -10.317
  178    H    GLY  24           HN       GLY  24  10.110  10.917 -10.811
  179   1HA   GLY  24          HA2       GLY  24  10.416   9.843 -13.494
  180   2HA   GLY  24          HA1       GLY  24  11.801  10.754 -12.845
  181    H    ILE  25           HN       ILE  25   9.559   8.466 -11.465
  182    HA   ILE  25           HA       ILE  25  11.814   6.711 -10.809
  183    HB   ILE  25           HB       ILE  25   9.191   7.057  -9.313
  184   1HG1  ILE  25          HG12      ILE  25  10.745   8.957  -8.986
  185   2HG1  ILE  25          HG11      ILE  25  10.505   8.043  -7.508
  186   1HG2  ILE  25          HG21      ILE  25   9.986   4.753  -9.166
  187   2HG2  ILE  25          HG22      ILE  25  10.153   5.561  -7.607
  188   3HG2  ILE  25          HG23      ILE  25  11.572   5.311  -8.626
  189   1HD1  ILE  25          HD11      ILE  25  12.899   7.855  -9.332
  190   2HD1  ILE  25          HD12      ILE  25  12.662   6.948  -7.834
  191   3HD1  ILE  25          HD13      ILE  25  12.831   8.702  -7.784
  192    H    ASN  26           HN       ASN  26  11.475   4.552 -11.256
  193    HA   ASN  26           HA       ASN  26   9.429   4.024 -13.240
  194   1HB   ASN  26          HB2       ASN  26  11.474   2.155 -12.020
  195   2HB   ASN  26          HB1       ASN  26  10.366   1.729 -13.312
  196   1HD2  ASN  26          HD21      ASN  26  13.205   1.628 -13.276
  197   2HD2  ASN  26          HD22      ASN  26  13.759   2.610 -14.572
  198    H    LEU  27           HN       LEU  27   7.617   2.957 -12.927
  199    HA   LEU  27           HA       LEU  27   6.986   2.277 -10.153
  200   1HB   LEU  27          HB2       LEU  27   5.165   2.781 -12.513
  201   2HB   LEU  27          HB1       LEU  27   4.611   2.334 -10.911
  202    HG   LEU  27           HG       LEU  27   6.045   4.886 -11.659
  203   1HD1  LEU  27          HD11      LEU  27   3.692   4.848 -12.337
  204   2HD1  LEU  27          HD12      LEU  27   4.025   5.987 -11.027
  205   3HD1  LEU  27          HD13      LEU  27   3.227   4.464 -10.665
  206   1HD2  LEU  27          HD21      LEU  27   5.071   3.918  -8.985
  207   2HD2  LEU  27          HD22      LEU  27   5.641   5.547  -9.337
  208   3HD2  LEU  27          HD23      LEU  27   6.749   4.184  -9.463
  209    H    ASP  28           HN       ASP  28   8.270   0.845 -12.573
  210    HA   ASP  28           HA       ASP  28   6.810  -1.681 -12.260
  211   1HB   ASP  28          HB2       ASP  28   8.739  -0.791 -14.417
  212   2HB   ASP  28          HB1       ASP  28   8.070  -2.415 -14.296
  213    H    SER  29           HN       SER  29   9.214  -0.113 -10.856
  214    HA   SER  29           HA       SER  29  11.201  -2.184 -10.779
  215   1HB   SER  29          HB2       SER  29  10.886   0.383  -9.211
  216   2HB   SER  29          HB1       SER  29  12.293  -0.674  -9.145
  217    HG   SER  29           HG       SER  29  12.815   0.797 -10.573
  218    H    SER  30           HN       SER  30  11.392  -3.674  -9.222
  219    HA   SER  30           HA       SER  30   9.195  -4.210  -7.504
  220   1HB   SER  30          HB2       SER  30  11.983  -5.362  -7.491
  221   2HB   SER  30          HB1       SER  30  10.534  -6.094  -6.811
  222    HG   SER  30           HG       SER  30  10.283  -6.950  -8.651
  223    H    LEU  31           HN       LEU  31   9.181  -4.088  -5.197
  224    HA   LEU  31           HA       LEU  31  10.328  -1.878  -3.980
  225   1HB   LEU  31          HB2       LEU  31   8.352  -3.401  -3.236
  226   2HB   LEU  31          HB1       LEU  31   9.583  -4.355  -2.442
  227    HG   LEU  31           HG       LEU  31  10.237  -2.279  -1.191
  228   1HD1  LEU  31          HD11      LEU  31   7.690  -1.316  -2.432
  229   2HD1  LEU  31          HD12      LEU  31   9.314  -0.708  -2.774
  230   3HD1  LEU  31          HD13      LEU  31   8.594  -0.469  -1.168
  231   1HD2  LEU  31          HD21      LEU  31   8.820  -3.998  -0.192
  232   2HD2  LEU  31          HD22      LEU  31   7.393  -3.231  -0.887
  233   3HD2  LEU  31          HD23      LEU  31   8.339  -2.386   0.339
  234    H    ALA  32           HN       ALA  32  11.475  -5.098  -4.397
  235    HA   ALA  32           HA       ALA  32  13.522  -4.987  -2.493
  236   1HB   ALA  32          HB1       ALA  32  13.268  -6.779  -4.889
  237   2HB   ALA  32          HB2       ALA  32  12.635  -7.089  -3.274
  238   3HB   ALA  32          HB3       ALA  32  14.379  -7.024  -3.542
  239    H    ASP  33           HN       ASP  33  13.241  -3.892  -5.771
  240    HA   ASP  33           HA       ASP  33  16.042  -3.733  -6.390
  241   1HB   ASP  33          HB2       ASP  33  14.445  -3.803  -8.226
  242   2HB   ASP  33          HB1       ASP  33  13.620  -2.377  -7.616
  243    H    LEU  34           HN       LEU  34  13.571  -1.699  -5.145
  244    HA   LEU  34           HA       LEU  34  15.015   0.696  -4.784
  245   1HB   LEU  34          HB2       LEU  34  12.633  -0.538  -3.421
  246   2HB   LEU  34          HB1       LEU  34  13.275   1.000  -2.913
  247    HG   LEU  34           HG       LEU  34  12.465   2.105  -4.859
  248   1HD1  LEU  34          HD11      LEU  34  11.562   0.984  -6.816
  249   2HD1  LEU  34          HD12      LEU  34  11.927  -0.590  -6.111
  250   3HD1  LEU  34          HD13      LEU  34  13.238   0.496  -6.571
  251   1HD2  LEU  34          HD21      LEU  34  10.740   1.529  -3.315
  252   2HD2  LEU  34          HD22      LEU  34  10.606  -0.064  -4.052
  253   3HD2  LEU  34          HD23      LEU  34  10.115   1.370  -4.973
  254    H    GLY  35           HN       GLY  35  14.244  -2.007  -2.660
  255   1HA   GLY  35          HA2       GLY  35  15.881  -3.032  -1.269
  256   2HA   GLY  35          HA1       GLY  35  16.706  -1.475  -1.164
  257    H    LEU  36           HN       LEU  36  14.072  -3.389  -0.035
  258    HA   LEU  36           HA       LEU  36  13.128  -1.219   1.612
  259   1HB   LEU  36          HB2       LEU  36  11.186  -2.567   2.044
  260   2HB   LEU  36          HB1       LEU  36  11.640  -2.936   0.423
  261    HG   LEU  36           HG       LEU  36  12.868  -4.988   1.531
  262   1HD1  LEU  36          HD11      LEU  36  12.397  -4.342   3.831
  263   2HD1  LEU  36          HD12      LEU  36  11.604  -5.867   3.428
  264   3HD1  LEU  36          HD13      LEU  36  10.666  -4.374   3.492
  265   1HD2  LEU  36          HD21      LEU  36   9.892  -4.819   1.111
  266   2HD2  LEU  36          HD22      LEU  36  10.846  -6.304   1.128
  267   3HD2  LEU  36          HD23      LEU  36  11.098  -5.105  -0.144
  268    H    ASP  37           HN       ASP  37  13.819  -0.859   3.582
  269    HA   ASP  37           HA       ASP  37  16.182  -2.124   4.438
  270   1HB   ASP  37          HB2       ASP  37  16.184  -0.530   6.296
  271   2HB   ASP  37          HB1       ASP  37  15.758   0.278   4.801
  272    H    SER  38           HN       SER  38  13.278  -1.812   6.307
  273    HA   SER  38           HA       SER  38  13.060  -4.533   7.106
  274   1HB   SER  38          HB2       SER  38  13.970  -2.514   9.220
  275   2HB   SER  38          HB1       SER  38  13.434  -4.158   9.548
  276    HG   SER  38           HG       SER  38  15.433  -4.075   7.709
  277    H    LEU  39           HN       LEU  39  12.520  -1.141   8.038
  278    HA   LEU  39           HA       LEU  39   9.956  -1.525   9.138
  279   1HB   LEU  39          HB2       LEU  39  11.405   0.409   9.608
  280   2HB   LEU  39          HB1       LEU  39  11.195   0.945   7.951
  281    HG   LEU  39           HG       LEU  39   8.723   1.014   8.448
  282   1HD1  LEU  39          HD11      LEU  39   9.702   0.858  11.283
  283   2HD1  LEU  39          HD12      LEU  39   8.671  -0.304  10.447
  284   3HD1  LEU  39          HD13      LEU  39   8.075   1.320  10.783
  285   1HD2  LEU  39          HD21      LEU  39  10.054   2.969   8.171
  286   2HD2  LEU  39          HD22      LEU  39  10.586   2.901   9.859
  287   3HD2  LEU  39          HD23      LEU  39   8.886   3.227   9.469
  288    H    MET  40           HN       MET  40  11.182  -0.711   5.962
  289    HA   MET  40           HA       MET  40   8.729  -0.100   4.702
  290   1HB   MET  40          HB2       MET  40  11.291  -1.147   3.484
  291   2HB   MET  40          HB1       MET  40   9.925  -0.488   2.605
  292   1HG   MET  40          HG2       MET  40  10.239   1.675   3.534
  293   2HG   MET  40          HG1       MET  40  11.476   1.074   4.638
  294   1HE   MET  40          HE1       MET  40  10.578   1.784   0.857
  295   2HE   MET  40          HE2       MET  40  11.032   0.079   0.842
  296   3HE   MET  40          HE3       MET  40  12.059   1.270   0.046
  297    H    GLY  41           HN       GLY  41   9.633  -3.002   5.964
  298   1HA   GLY  41          HA2       GLY  41   7.797  -4.431   4.153
  299   2HA   GLY  41          HA1       GLY  41   9.167  -5.211   4.945
  300    H    VAL  42           HN       VAL  42   8.878  -3.931   7.483
  301    HA   VAL  42           HA       VAL  42   6.943  -5.717   8.618
  302    HB   VAL  42           HB       VAL  42   8.539  -3.538  10.003
  303   1HG1  VAL  42          HG11      VAL  42   6.628  -4.234  11.326
  304   2HG1  VAL  42          HG12      VAL  42   8.128  -4.803  12.063
  305   3HG1  VAL  42          HG13      VAL  42   7.106  -5.923  11.164
  306   1HG2  VAL  42          HG21      VAL  42  10.005  -5.124   8.934
  307   2HG2  VAL  42          HG22      VAL  42   9.154  -6.473   9.699
  308   3HG2  VAL  42          HG23      VAL  42  10.062  -5.319  10.685
  309    H    GLU  43           HN       GLU  43   7.094  -2.180   8.224
  310    HA   GLU  43           HA       GLU  43   4.837  -1.673   9.834
  311   1HB   GLU  43          HB2       GLU  43   6.508   0.057   9.127
  312   2HB   GLU  43          HB1       GLU  43   5.820  -0.012   7.510
  313   1HG   GLU  43          HG2       GLU  43   3.649   0.673   8.412
  314   2HG   GLU  43          HG1       GLU  43   4.369   0.798  10.013
  315    H    VAL  44           HN       VAL  44   5.273  -2.394   6.478
  316    HA   VAL  44           HA       VAL  44   2.725  -1.903   5.439
  317    HB   VAL  44           HB       VAL  44   4.435  -4.275   4.698
  318   1HG1  VAL  44          HG11      VAL  44   3.500  -3.923   2.467
  319   2HG1  VAL  44          HG12      VAL  44   2.517  -2.599   3.117
  320   3HG1  VAL  44          HG13      VAL  44   2.274  -4.250   3.696
  321   1HG2  VAL  44          HG21      VAL  44   5.883  -2.339   4.759
  322   2HG2  VAL  44          HG22      VAL  44   4.764  -1.430   3.739
  323   3HG2  VAL  44          HG23      VAL  44   5.609  -2.846   3.100
  324    H    ARG  45           HN       ARG  45   4.134  -4.850   6.780
  325    HA   ARG  45           HA       ARG  45   1.919  -6.494   6.724
  326   1HB   ARG  45          HB2       ARG  45   4.275  -6.388   8.559
  327   2HB   ARG  45          HB1       ARG  45   3.044  -7.612   8.758
  328   1HG   ARG  45          HG2       ARG  45   3.500  -8.236   6.348
  329   2HG   ARG  45          HG1       ARG  45   4.923  -7.195   6.469
  330   1HD   ARG  45          HD2       ARG  45   4.341  -9.426   8.397
  331   2HD   ARG  45          HD1       ARG  45   5.294  -9.650   6.937
  332    HE   ARG  45           HE       ARG  45   6.941  -8.214   7.833
  333   1HH1  ARG  45          HH11      ARG  45   4.389  -8.719  10.311
  334   2HH1  ARG  45          HH12      ARG  45   5.516  -8.789  11.580
  335   1HH2  ARG  45          HH21      ARG  45   8.398  -8.355   9.632
  336   2HH2  ARG  45          HH22      ARG  45   7.819  -8.596  11.224
  337    H    GLN  46           HN       GLN  46   2.969  -4.292   9.269
  338    HA   GLN  46           HA       GLN  46   0.982  -4.966  11.138
  339   1HB   GLN  46          HB2       GLN  46   2.303  -2.262  10.866
  340   2HB   GLN  46          HB1       GLN  46   1.529  -2.916  12.299
  341   1HG   GLN  46          HG2       GLN  46   3.282  -4.683  12.355
  342   2HG   GLN  46          HG1       GLN  46   4.086  -3.850  11.023
  343   1HE2  GLN  46          HE21      GLN  46   3.372  -3.841  14.358
  344   2HE2  GLN  46          HE22      GLN  46   4.368  -2.502  14.816
  345    H    ILE  47           HN       ILE  47   1.052  -2.451   8.618
  346    HA   ILE  47           HA       ILE  47  -1.270  -1.051   9.386
  347    HB   ILE  47           HB       ILE  47  -0.051  -1.369   6.624
  348   1HG1  ILE  47          HG12      ILE  47   0.202   0.867   8.635
  349   2HG1  ILE  47          HG11      ILE  47   1.428  -0.357   8.283
  350   1HG2  ILE  47          HG21      ILE  47  -1.302   0.649   6.000
  351   2HG2  ILE  47          HG22      ILE  47  -2.099   0.630   7.579
  352   3HG2  ILE  47          HG23      ILE  47  -2.371  -0.684   6.437
  353   1HD1  ILE  47          HD11      ILE  47   1.622   0.486   6.007
  354   2HD1  ILE  47          HD12      ILE  47   1.938   1.758   7.188
  355   3HD1  ILE  47          HD13      ILE  47   0.389   1.699   6.346
  356    H    LEU  48           HN       LEU  48  -0.721  -3.550   7.061
  357    HA   LEU  48           HA       LEU  48  -3.461  -3.648   6.336
  358   1HB   LEU  48          HB2       LEU  48  -1.165  -5.424   5.625
  359   2HB   LEU  48          HB1       LEU  48  -2.797  -5.882   5.199
  360    HG   LEU  48           HG       LEU  48  -1.897  -4.884   3.282
  361   1HD1  LEU  48          HD11      LEU  48  -4.152  -4.161   3.750
  362   2HD1  LEU  48          HD12      LEU  48  -3.237  -2.890   2.929
  363   3HD1  LEU  48          HD13      LEU  48  -3.522  -2.788   4.664
  364   1HD2  LEU  48          HD21      LEU  48  -0.842  -2.679   3.225
  365   2HD2  LEU  48          HD22      LEU  48   0.044  -3.799   4.260
  366   3HD2  LEU  48          HD23      LEU  48  -0.993  -2.566   4.980
  367    H    GLU  49           HN       GLU  49  -1.558  -5.492   8.606
  368    HA   GLU  49           HA       GLU  49  -3.461  -7.521   9.041
  369   1HB   GLU  49          HB2       GLU  49  -1.080  -7.709   9.646
  370   2HB   GLU  49          HB1       GLU  49  -1.305  -6.489  10.887
  371   1HG   GLU  49          HG2       GLU  49  -2.814  -7.979  12.081
  372   2HG   GLU  49          HG1       GLU  49  -2.624  -9.188  10.814
  373    H    ARG  50           HN       ARG  50  -3.084  -4.315  10.402
  374    HA   ARG  50           HA       ARG  50  -5.021  -4.848  12.523
  375   1HB   ARG  50          HB2       ARG  50  -3.940  -2.157  11.777
  376   2HB   ARG  50          HB1       ARG  50  -4.654  -2.657  13.293
  377   1HG   ARG  50          HG2       ARG  50  -2.708  -4.034  13.758
  378   2HG   ARG  50          HG1       ARG  50  -2.000  -3.541  12.214
  379   1HD   ARG  50          HD2       ARG  50  -2.535  -1.887  14.651
  380   2HD   ARG  50          HD1       ARG  50  -1.024  -2.103  13.769
  381    HE   ARG  50           HE       ARG  50  -3.251  -0.751  12.410
  382   1HH1  ARG  50          HH11      ARG  50   0.049  -0.516  13.700
  383   2HH1  ARG  50          HH12      ARG  50   0.188   1.127  13.303
  384   1HH2  ARG  50          HH21      ARG  50  -3.038   1.459  11.893
  385   2HH2  ARG  50          HH22      ARG  50  -1.610   2.308  12.282
  386    H    GLU  51           HN       GLU  51  -4.763  -2.589   9.773
  387    HA   GLU  51           HA       GLU  51  -7.226  -1.355  10.382
  388   1HB   GLU  51          HB2       GLU  51  -5.733  -1.143   7.785
  389   2HB   GLU  51          HB1       GLU  51  -6.916  -0.017   8.423
  390   1HG   GLU  51          HG2       GLU  51  -4.124  -0.529   9.423
  391   2HG   GLU  51          HG1       GLU  51  -4.764   0.945   8.716
  392    H    HIS  52           HN       HIS  52  -6.386  -3.706   7.847
  393    HA   HIS  52           HA       HIS  52  -9.278  -3.988   7.465
  394   1HB   HIS  52          HB2       HIS  52  -7.270  -3.441   5.345
  395   2HB   HIS  52          HB1       HIS  52  -8.598  -4.528   4.951
  396    HD1  HIS  52           HD1      HIS  52 -10.653  -3.459   4.187
  397    HD2  HIS  52           HD2      HIS  52  -8.293  -0.806   6.332
  398    HE1  HIS  52           HE1      HIS  52 -11.828  -1.233   4.044
  399    HE2  HIS  52           HE2      HIS  52 -10.551   0.241   5.602
  400    H    ASP  53           HN       ASP  53  -6.985  -5.503   8.705
  401    HA   ASP  53           HA       ASP  53  -6.256  -7.580   9.036
  402   1HB   ASP  53          HB2       ASP  53  -8.584  -7.765   9.876
  403   2HB   ASP  53          HB1       ASP  53  -9.076  -8.385   8.303
  404    H    LEU  54           HN       LEU  54  -5.027  -7.125   7.099
  405    HA   LEU  54           HA       LEU  54  -5.334  -9.327   5.173
  406   1HB   LEU  54          HB2       LEU  54  -4.637  -6.482   4.812
  407   2HB   LEU  54          HB1       LEU  54  -3.545  -7.588   4.016
  408    HG   LEU  54           HG       LEU  54  -5.418  -8.486   2.723
  409   1HD1  LEU  54          HD11      LEU  54  -7.251  -8.040   4.308
  410   2HD1  LEU  54          HD12      LEU  54  -7.594  -7.302   2.743
  411   3HD1  LEU  54          HD13      LEU  54  -7.023  -6.308   4.085
  412   1HD2  LEU  54          HD21      LEU  54  -5.767  -6.520   1.304
  413   2HD2  LEU  54          HD22      LEU  54  -4.087  -6.677   1.815
  414   3HD2  LEU  54          HD23      LEU  54  -5.133  -5.489   2.585
  415    H    VAL  55           HN       VAL  55  -3.888 -10.861   5.728
  416    HA   VAL  55           HA       VAL  55  -1.448 -10.033   7.053
  417    HB   VAL  55           HB       VAL  55  -2.213 -12.837   6.138
  418   1HG1  VAL  55          HG11      VAL  55  -0.526 -13.579   7.763
  419   2HG1  VAL  55          HG12      VAL  55  -0.146 -11.894   8.125
  420   3HG1  VAL  55          HG13      VAL  55   0.181 -12.543   6.518
  421   1HG2  VAL  55          HG21      VAL  55  -3.863 -12.010   7.736
  422   2HG2  VAL  55          HG22      VAL  55  -2.577 -11.564   8.856
  423   3HG2  VAL  55          HG23      VAL  55  -2.865 -13.263   8.472
  424    H    LEU  56           HN       LEU  56  -0.286  -8.903   5.642
  425    HA   LEU  56           HA       LEU  56   0.164 -10.020   2.976
  426   1HB   LEU  56          HB2       LEU  56  -1.169  -7.924   3.347
  427   2HB   LEU  56          HB1       LEU  56   0.347  -7.168   3.827
  428    HG   LEU  56           HG       LEU  56   1.234  -7.859   1.587
  429   1HD1  LEU  56          HD11      LEU  56  -1.707  -8.332   1.080
  430   2HD1  LEU  56          HD12      LEU  56  -0.419  -9.534   1.022
  431   3HD1  LEU  56          HD13      LEU  56  -0.481  -8.245  -0.185
  432   1HD2  LEU  56          HD21      LEU  56  -1.048  -5.877   1.654
  433   2HD2  LEU  56          HD22      LEU  56   0.193  -5.959   0.405
  434   3HD2  LEU  56          HD23      LEU  56   0.636  -5.549   2.062
  435    HA   PRO  57           HA       PRO  57   4.186  -9.851   4.984
  436   1HB   PRO  57          HB2       PRO  57   4.862 -12.396   4.081
  437   2HB   PRO  57          HB1       PRO  57   3.919 -12.001   5.531
  438   1HG   PRO  57          HG2       PRO  57   3.025 -13.318   3.158
  439   2HG   PRO  57          HG1       PRO  57   2.150 -12.877   4.642
  440   1HD   PRO  57          HD2       PRO  57   2.345 -11.457   2.049
  441   2HD   PRO  57          HD1       PRO  57   0.987 -11.543   3.197
  442    H    ILE  58           HN       ILE  58   6.473 -10.682   4.028
  443    HA   ILE  58           HA       ILE  58   6.968  -8.768   2.014
  444    HB   ILE  58           HB       ILE  58   8.854 -10.738   3.367
  445   1HG1  ILE  58          HG12      ILE  58   9.843  -8.552   4.288
  446   2HG1  ILE  58          HG11      ILE  58   8.428  -7.777   3.590
  447   1HG2  ILE  58          HG21      ILE  58  10.754  -9.551   2.357
  448   2HG2  ILE  58          HG22      ILE  58   9.649  -8.586   1.391
  449   3HG2  ILE  58          HG23      ILE  58   9.748 -10.324   1.138
  450   1HD1  ILE  58          HD11      ILE  58   8.371  -9.875   5.739
  451   2HD1  ILE  58          HD12      ILE  58   6.981  -9.021   5.066
  452   3HD1  ILE  58          HD13      ILE  58   8.198  -8.138   5.985
  453    H    ARG  59           HN       ARG  59   6.538 -12.173   1.890
  454    HA   ARG  59           HA       ARG  59   7.455 -12.498  -0.759
  455   1HB   ARG  59          HB2       ARG  59   6.072 -14.592  -0.943
  456   2HB   ARG  59          HB1       ARG  59   7.195 -14.556   0.394
  457   1HG   ARG  59          HG2       ARG  59   4.278 -13.912   0.738
  458   2HG   ARG  59          HG1       ARG  59   4.886 -15.567   0.767
  459   1HD   ARG  59          HD2       ARG  59   5.614 -13.309   2.644
  460   2HD   ARG  59          HD1       ARG  59   4.729 -14.780   3.024
  461    HE   ARG  59           HE       ARG  59   7.446 -15.026   2.019
  462   1HH1  ARG  59          HH11      ARG  59   5.205 -15.465   4.720
  463   2HH1  ARG  59          HH12      ARG  59   6.380 -16.202   5.726
  464   1HH2  ARG  59          HH21      ARG  59   9.000 -16.032   3.357
  465   2HH2  ARG  59          HH22      ARG  59   8.615 -16.481   4.956
  466    H    GLU  60           HN       GLU  60   4.901 -10.762   0.247
  467    HA   GLU  60           HA       GLU  60   3.783 -10.684  -2.470
  468   1HB   GLU  60          HB2       GLU  60   2.698  -9.595   0.155
  469   2HB   GLU  60          HB1       GLU  60   1.915  -9.423  -1.403
  470   1HG   GLU  60          HG2       GLU  60   2.456 -12.045  -0.038
  471   2HG   GLU  60          HG1       GLU  60   0.928 -11.166   0.029
  472    H    VAL  61           HN       VAL  61   4.567  -8.664   0.304
  473    HA   VAL  61           HA       VAL  61   4.522  -6.174  -0.827
  474    HB   VAL  61           HB       VAL  61   6.192  -7.088   1.526
  475   1HG1  VAL  61          HG11      VAL  61   6.113  -4.762   2.280
  476   2HG1  VAL  61          HG12      VAL  61   5.281  -4.309   0.796
  477   3HG1  VAL  61          HG13      VAL  61   6.940  -4.903   0.729
  478   1HG2  VAL  61          HG21      VAL  61   4.298  -6.291   2.869
  479   2HG2  VAL  61          HG22      VAL  61   3.834  -7.601   1.785
  480   3HG2  VAL  61          HG23      VAL  61   3.409  -5.938   1.388
  481    H    ARG  62           HN       ARG  62   7.361  -8.301  -0.685
  482    HA   ARG  62           HA       ARG  62   9.228  -6.324  -1.485
  483   1HB   ARG  62          HB2       ARG  62   9.952  -8.309  -0.344
  484   2HB   ARG  62          HB1       ARG  62   9.301  -9.332  -1.611
  485   1HG   ARG  62          HG2       ARG  62  10.959  -8.512  -3.146
  486   2HG   ARG  62          HG1       ARG  62  11.578  -7.412  -1.908
  487   1HD   ARG  62          HD2       ARG  62  12.272  -9.276  -0.542
  488   2HD   ARG  62          HD1       ARG  62  11.466 -10.422  -1.617
  489    HE   ARG  62           HE       ARG  62  13.270  -9.088  -3.183
  490   1HH1  ARG  62          HH11      ARG  62  13.549 -11.108  -0.243
  491   2HH1  ARG  62          HH12      ARG  62  15.067 -11.721  -0.724
  492   1HH2  ARG  62          HH21      ARG  62  15.358  -9.980  -3.736
  493   2HH2  ARG  62          HH22      ARG  62  16.098 -11.078  -2.652
  494    H    GLN  63           HN       GLN  63   6.945  -8.142  -3.222
  495    HA   GLN  63           HA       GLN  63   8.283  -7.720  -5.781
  496   1HB   GLN  63          HB2       GLN  63   5.849  -9.372  -5.101
  497   2HB   GLN  63          HB1       GLN  63   6.474  -9.153  -6.703
  498   1HG   GLN  63          HG2       GLN  63   7.194 -11.317  -5.875
  499   2HG   GLN  63          HG1       GLN  63   8.571 -10.263  -6.128
  500   1HE2  GLN  63          HE21      GLN  63   6.440 -10.178  -3.368
  501   2HE2  GLN  63          HE22      GLN  63   7.597 -10.684  -2.190
  502    H    LEU  64           HN       LEU  64   6.320  -6.098  -3.774
  503    HA   LEU  64           HA       LEU  64   4.479  -5.127  -5.751
  504   1HB   LEU  64          HB2       LEU  64   5.211  -3.936  -3.063
  505   2HB   LEU  64          HB1       LEU  64   3.867  -3.439  -4.064
  506    HG   LEU  64           HG       LEU  64   4.193  -6.016  -2.564
  507   1HD1  LEU  64          HD11      LEU  64   3.526  -4.155  -1.187
  508   2HD1  LEU  64          HD12      LEU  64   2.183  -5.283  -1.368
  509   3HD1  LEU  64          HD13      LEU  64   2.204  -3.779  -2.290
  510   1HD2  LEU  64          HD21      LEU  64   1.955  -6.643  -3.386
  511   2HD2  LEU  64          HD22      LEU  64   3.128  -6.511  -4.697
  512   3HD2  LEU  64          HD23      LEU  64   1.955  -5.223  -4.431
  513    H    THR  65           HN       THR  65   4.634  -2.923  -6.549
  514    HA   THR  65           HA       THR  65   7.425  -2.334  -7.043
  515    HB   THR  65           HB       THR  65   6.385  -1.069  -8.978
  516    HG1  THR  65           HG1      THR  65   4.153  -1.741  -9.378
  517   1HG2  THR  65          HG21      THR  65   5.901  -3.165 -10.234
  518   2HG2  THR  65          HG22      THR  65   5.849  -4.051  -8.702
  519   3HG2  THR  65          HG23      THR  65   7.350  -3.327  -9.241
  520    H    LEU  66           HN       LEU  66   4.851  -0.067  -7.311
  521    HA   LEU  66           HA       LEU  66   5.845   1.300  -4.952
  522   1HB   LEU  66          HB2       LEU  66   7.043   2.002  -7.207
  523   2HB   LEU  66          HB1       LEU  66   5.577   2.923  -7.455
  524    HG   LEU  66           HG       LEU  66   7.277   4.368  -6.516
  525   1HD1  LEU  66          HD11      LEU  66   5.253   3.621  -4.468
  526   2HD1  LEU  66          HD12      LEU  66   5.001   4.763  -5.792
  527   3HD1  LEU  66          HD13      LEU  66   6.152   5.142  -4.486
  528   1HD2  LEU  66          HD21      LEU  66   8.652   2.657  -5.461
  529   2HD2  LEU  66          HD22      LEU  66   7.395   2.410  -4.242
  530   3HD2  LEU  66          HD23      LEU  66   8.248   3.950  -4.328
  531    H    ARG  67           HN       ARG  67   3.741   1.919  -7.776
  532    HA   ARG  67           HA       ARG  67   1.733   3.015  -6.028
  533   1HB   ARG  67          HB2       ARG  67   1.726   2.474  -8.993
  534   2HB   ARG  67          HB1       ARG  67   0.359   3.151  -8.131
  535   1HG   ARG  67          HG2       ARG  67   3.087   4.401  -8.397
  536   2HG   ARG  67          HG1       ARG  67   1.638   4.862  -9.291
  537   1HD   ARG  67          HD2       ARG  67   0.586   5.266  -6.982
  538   2HD   ARG  67          HD1       ARG  67   2.228   5.179  -6.370
  539    HE   ARG  67           HE       ARG  67   2.585   7.004  -8.261
  540   1HH1  ARG  67          HH11      ARG  67   0.072   6.910  -5.728
  541   2HH1  ARG  67          HH12      ARG  67  -0.283   8.566  -5.934
  542   1HH2  ARG  67          HH21      ARG  67   2.056   9.164  -8.477
  543   2HH2  ARG  67          HH22      ARG  67   0.866   9.903  -7.500
  544    H    LYS  68           HN       LYS  68   2.592  -0.036  -7.210
  545    HA   LYS  68           HA       LYS  68   0.056  -1.273  -6.968
  546   1HB   LYS  68          HB2       LYS  68   2.009  -2.360  -8.070
  547   2HB   LYS  68          HB1       LYS  68   2.762  -2.536  -6.487
  548   1HG   LYS  68          HG2       LYS  68   1.000  -4.025  -5.769
  549   2HG   LYS  68          HG1       LYS  68   0.150  -3.803  -7.298
  550   1HD   LYS  68          HD2       LYS  68   2.910  -4.938  -7.007
  551   2HD   LYS  68          HD1       LYS  68   1.451  -5.931  -7.158
  552   1HE   LYS  68          HE2       LYS  68   1.013  -4.812  -9.350
  553   2HE   LYS  68          HE1       LYS  68   2.555  -3.980  -9.190
  554   1HZ   LYS  68          HZ1       LYS  68   3.649  -6.199  -9.186
  555   2HZ   LYS  68          HZ2       LYS  68   2.808  -5.826 -10.574
  556   3HZ   LYS  68          HZ3       LYS  68   2.130  -6.910  -9.473
  557    H    LEU  69           HN       LEU  69   2.303  -0.054  -4.690
  558    HA   LEU  69           HA       LEU  69   1.542  -1.482  -2.384
  559   1HB   LEU  69          HB2       LEU  69   2.712   1.251  -2.808
  560   2HB   LEU  69          HB1       LEU  69   2.108   0.820  -1.226
  561    HG   LEU  69           HG       LEU  69   4.519   0.577  -1.353
  562   1HD1  LEU  69          HD11      LEU  69   3.316  -0.855   0.149
  563   2HD1  LEU  69          HD12      LEU  69   4.719  -1.704  -0.514
  564   3HD1  LEU  69          HD13      LEU  69   3.100  -2.055  -1.123
  565   1HD2  LEU  69          HD21      LEU  69   5.568  -1.156  -2.736
  566   2HD2  LEU  69          HD22      LEU  69   4.762   0.059  -3.732
  567   3HD2  LEU  69          HD23      LEU  69   4.003  -1.509  -3.469
  568    H    GLN  70           HN       GLN  70   0.270   1.493  -3.813
  569    HA   GLN  70           HA       GLN  70  -1.776   1.663  -1.877
  570   1HB   GLN  70          HB2       GLN  70  -2.811   3.336  -3.624
  571   2HB   GLN  70          HB1       GLN  70  -1.439   3.745  -2.610
  572   1HG   GLN  70          HG2       GLN  70   0.080   3.340  -4.474
  573   2HG   GLN  70          HG1       GLN  70  -1.274   2.832  -5.475
  574   1HE2  GLN  70          HE21      GLN  70  -2.180   4.341  -6.721
  575   2HE2  GLN  70          HE22      GLN  70  -2.112   6.038  -6.444
  576    H    GLU  71           HN       GLU  71  -1.566  -0.044  -4.808
  577    HA   GLU  71           HA       GLU  71  -4.392  -0.478  -4.952
  578   1HB   GLU  71          HB2       GLU  71  -2.119  -1.949  -6.287
  579   2HB   GLU  71          HB1       GLU  71  -3.826  -2.208  -6.634
  580   1HG   GLU  71          HG2       GLU  71  -2.226   0.294  -7.101
  581   2HG   GLU  71          HG1       GLU  71  -2.927  -0.779  -8.314
  582    H    MET  72           HN       MET  72  -1.922  -1.671  -3.026
  583    HA   MET  72           HA       MET  72  -3.553  -3.976  -2.154
  584   1HB   MET  72          HB2       MET  72  -0.561  -3.536  -1.900
  585   2HB   MET  72          HB1       MET  72  -1.439  -4.919  -1.274
  586   1HG   MET  72          HG2       MET  72  -1.131  -4.192  -4.185
  587   2HG   MET  72          HG1       MET  72  -0.250  -5.447  -3.325
  588   1HE   MET  72          HE1       MET  72  -2.499  -6.681  -1.452
  589   2HE   MET  72          HE2       MET  72  -1.345  -7.649  -2.365
  590   3HE   MET  72          HE3       MET  72  -3.067  -8.014  -2.459
  591    H    SER  73           HN       SER  73  -3.223  -0.966  -1.505
  592    HA   SER  73           HA       SER  73  -2.261  -0.840   1.165
  593   1HB   SER  73          HB2       SER  73  -2.051   0.964  -0.512
  594   2HB   SER  73          HB1       SER  73  -3.785   1.172  -0.510
  595    HG   SER  73           HG       SER  73  -2.818   2.691   0.659
  596    H    SER  74           HN       SER  74  -5.272  -1.263  -0.445
  597    HA   SER  74           HA       SER  74  -7.401  -1.548   0.102
  598   1HB   SER  74          HB2       SER  74  -6.361  -3.618   1.018
  599   2HB   SER  74          HB1       SER  74  -6.265  -2.846   2.592
  600    HG   SER  74           HG       SER  74  -8.799  -2.737   1.519
  601    H    LYS  75           HN       LYS  75  -7.715   0.699   0.262
  602    HA   LYS  75           HA       LYS  75  -8.071   1.870   2.876
  603   1HB   LYS  75          HB2       LYS  75  -8.425   2.779   0.064
  604   2HB   LYS  75          HB1       LYS  75  -9.437   3.553   1.271
  605   1HG   LYS  75          HG2       LYS  75  -7.402   4.813   0.835
  606   2HG   LYS  75          HG1       LYS  75  -7.488   4.259   2.504
  607   1HD   LYS  75          HD2       LYS  75  -6.017   2.329   1.797
  608   2HD   LYS  75          HD1       LYS  75  -5.781   3.190   0.271
  609   1HE   LYS  75          HE2       LYS  75  -3.972   3.687   1.869
  610   2HE   LYS  75          HE1       LYS  75  -4.912   5.127   1.500
  611   1HZ   LYS  75          HZ1       LYS  75  -4.441   4.843   3.890
  612   2HZ   LYS  75          HZ2       LYS  75  -5.389   3.424   3.862
  613   3HZ   LYS  75          HZ3       LYS  75  -6.079   4.910   3.521
  614    H    ALA  76           HN       ALA  76  -9.823   0.174   0.509
  615    HA   ALA  76           HA       ALA  76 -12.088   0.014   2.313
  616   1HB   ALA  76          HB1       ALA  76 -13.604   0.117   0.386
  617   2HB   ALA  76          HB2       ALA  76 -12.232   0.422  -0.679
  618   3HB   ALA  76          HB3       ALA  76 -12.676   1.610   0.548
  619    H    GLY  77           HN       GLY  77 -13.532  -1.804   1.268
  620   1HA   GLY  77          HA2       GLY  77 -12.070  -3.936  -0.021
  621   2HA   GLY  77          HA1       GLY  77 -12.614  -4.263   1.633
  622    H    SER  78           HN       SER  78 -13.766  -2.863  -1.352
  623    HA   SER  78           HA       SER  78 -16.464  -3.025  -0.491
  624   1HB   SER  78          HB2       SER  78 -15.302  -2.172  -3.125
  625   2HB   SER  78          HB1       SER  78 -16.926  -1.827  -2.513
  626    HG   SER  78           HG       SER  78 -14.678  -0.479  -2.093
  627    H    ASP  79           HN       ASP  79 -18.030  -4.208  -1.234
  628    HA   ASP  79           HA       ASP  79 -17.445  -6.458  -3.027
  629   1HB   ASP  79          HB2       ASP  79 -17.898  -7.237  -0.763
  630   2HB   ASP  79          HB1       ASP  79 -19.345  -6.242  -0.679
  631    H    THR  80           HN       THR  80 -18.463  -6.201  -4.916
  632    HA   THR  80           HA       THR  80 -20.393  -4.179  -5.256
  633    HB   THR  80           HB       THR  80 -20.563  -5.162  -7.601
  634    HG1  THR  80           HG1      THR  80 -19.841  -7.248  -7.184
  635   1HG2  THR  80          HG21      THR  80 -17.844  -4.308  -6.584
  636   2HG2  THR  80          HG22      THR  80 -19.149  -3.233  -7.085
  637   3HG2  THR  80          HG23      THR  80 -18.362  -4.275  -8.270
  638    H    GLU  81           HN       GLU  81 -22.204  -4.486  -4.270
  639    HA   GLU  81           HA       GLU  81 -23.668  -6.978  -4.565
  640   1HB   GLU  81          HB2       GLU  81 -23.692  -5.853  -2.372
  641   2HB   GLU  81          HB1       GLU  81 -24.360  -4.410  -3.113
  642   1HG   GLU  81          HG2       GLU  81 -26.386  -5.680  -3.688
  643   2HG   GLU  81          HG1       GLU  81 -25.702  -7.086  -2.871
  644    H    LEU  82           HN       LEU  82 -24.104  -7.017  -6.713
  645    HA   LEU  82           HA       LEU  82 -25.559  -4.724  -7.830
  646   1HB   LEU  82          HB2       LEU  82 -23.908  -6.826  -9.225
  647   2HB   LEU  82          HB1       LEU  82 -24.761  -5.514 -10.011
  648    HG   LEU  82           HG       LEU  82 -22.458  -5.177  -8.091
  649   1HD1  LEU  82          HD11      LEU  82 -22.564  -4.914 -11.089
  650   2HD1  LEU  82          HD12      LEU  82 -21.761  -6.198 -10.185
  651   3HD1  LEU  82          HD13      LEU  82 -21.181  -4.535 -10.063
  652   1HD2  LEU  82          HD21      LEU  82 -23.911  -3.170  -9.819
  653   2HD2  LEU  82          HD22      LEU  82 -22.486  -2.840  -8.834
  654   3HD2  LEU  82          HD23      LEU  82 -24.007  -3.281  -8.062
  655    H    ALA  83           HN       ALA  83 -27.594  -5.074  -8.277
  656    HA   ALA  83           HA       ALA  83 -28.788  -7.645  -8.063
  657   1HB   ALA  83          HB1       ALA  83 -30.860  -6.501  -8.707
  658   2HB   ALA  83          HB2       ALA  83 -29.939  -5.059  -9.127
  659   3HB   ALA  83          HB3       ALA  83 -30.008  -5.601  -7.451
  660    H    ALA  84           HN       ALA  84 -28.308  -9.063  -9.515
  661    HA   ALA  84           HA       ALA  84 -28.041  -8.344 -12.326
  662   1HB   ALA  84          HB1       ALA  84 -26.376  -9.864 -11.358
  663   2HB   ALA  84          HB2       ALA  84 -27.315 -10.684 -12.606
  664   3HB   ALA  84          HB3       ALA  84 -27.655 -10.992 -10.903
  665    HA   PRO  85           HA       PRO  85 -32.210  -9.381 -13.354
  666   1HB   PRO  85          HB2       PRO  85 -31.025 -10.817 -15.677
  667   2HB   PRO  85          HB1       PRO  85 -32.290  -9.585 -15.644
  668   1HG   PRO  85          HG2       PRO  85 -29.838  -8.969 -16.437
  669   2HG   PRO  85          HG1       PRO  85 -30.782  -7.844 -15.441
  670   1HD   PRO  85          HD2       PRO  85 -28.524  -9.630 -14.658
  671   2HD   PRO  85          HD1       PRO  85 -28.918  -7.992 -14.097
  672    H    LYS  86           HN       LYS  86 -33.413 -10.902 -12.625
  673    HA   LYS  86           HA       LYS  86 -32.411 -13.533 -11.961
  674   1HB   LYS  86          HB2       LYS  86 -35.239 -12.456 -11.865
  675   2HB   LYS  86          HB1       LYS  86 -34.613 -13.854 -11.004
  676   1HG   LYS  86          HG2       LYS  86 -33.267 -12.456  -9.594
  677   2HG   LYS  86          HG1       LYS  86 -33.691 -11.025 -10.535
  678   1HD   LYS  86          HD2       LYS  86 -36.070 -11.396  -9.927
  679   2HD   LYS  86          HD1       LYS  86 -35.551 -12.714  -8.874
  680   1HE   LYS  86          HE2       LYS  86 -34.218 -11.165  -7.564
  681   2HE   LYS  86          HE1       LYS  86 -34.664  -9.843  -8.643
  682   1HZ   LYS  86          HZ1       LYS  86 -36.043  -9.810  -6.649
  683   2HZ   LYS  86          HZ2       LYS  86 -36.520 -11.399  -6.932
  684   3HZ   LYS  86          HZ3       LYS  86 -36.992 -10.189  -7.991
  685    H    SER  87           HN       SER  87 -34.501 -11.946 -14.230
  686    HA   SER  87           HA       SER  87 -34.098 -14.018 -16.141
  687   1HB   SER  87          HB2       SER  87 -36.575 -14.157 -16.625
  688   2HB   SER  87          HB1       SER  87 -36.103 -14.865 -15.083
  689    HG   SER  87           HG       SER  87 -37.657 -12.682 -15.655
  690    H    LYS  88           HN       LYS  88 -33.494 -12.970 -17.877
  691    HA   LYS  88           HA       LYS  88 -33.931 -10.146 -18.156
  692   1HB   LYS  88          HB2       LYS  88 -32.629 -12.148 -20.016
  693   2HB   LYS  88          HB1       LYS  88 -32.623 -10.407 -20.249
  694   1HG   LYS  88          HG2       LYS  88 -31.303 -10.102 -18.243
  695   2HG   LYS  88          HG1       LYS  88 -31.400 -11.830 -17.891
  696   1HD   LYS  88          HD2       LYS  88 -30.110 -10.631 -20.347
  697   2HD   LYS  88          HD1       LYS  88 -29.241 -11.161 -18.908
  698   1HE   LYS  88          HE2       LYS  88 -30.980 -12.930 -20.628
  699   2HE   LYS  88          HE1       LYS  88 -29.225 -12.833 -20.737
  700   1HZ   LYS  88          HZ1       LYS  88 -30.124 -14.719 -19.419
  701   2HZ   LYS  88          HZ2       LYS  88 -30.609 -13.627 -18.207
  702   3HZ   LYS  88          HZ3       LYS  88 -28.989 -13.794 -18.618
  703    H    ASN  89           HN       ASN  89 -34.527 -12.880 -20.318
  704    HA   ASN  89           HA       ASN  89 -37.203 -12.359 -20.719
  705   1HB   ASN  89          HB2       ASN  89 -37.197 -11.615 -23.098
  706   2HB   ASN  89          HB1       ASN  89 -36.551 -10.396 -22.025
  707   1HD2  ASN  89          HD21      ASN  89 -36.300 -10.811 -24.866
  708   2HD2  ASN  89          HD22      ASN  89 -34.610 -10.870 -25.233
  Start of MODEL   15
    1   1H    GLY   1          HT1       GLY   1 -15.095   8.231  13.288
    2   2H    GLY   1          HT2       GLY   1 -15.986   9.273  12.301
    3   3H    GLY   1          HT3       GLY   1 -15.681   9.689  13.945
    4   1HA   GLY   1          HA1       GLY   1 -14.238  10.904  12.439
    5   2HA   GLY   1          HA2       GLY   1 -13.317   9.761  13.428
    6    H    ASP   2           HN       ASP   2 -13.051  10.918  10.584
    7    HA   ASP   2           HA       ASP   2 -13.031   8.336   9.210
    8   1HB   ASP   2          HB2       ASP   2 -13.240  11.098   8.000
    9   2HB   ASP   2          HB1       ASP   2 -13.126   9.601   7.084
   10    H    GLY   3           HN       GLY   3 -11.050  10.320  10.810
   11   1HA   GLY   3          HA2       GLY   3  -8.769  10.389   9.154
   12   2HA   GLY   3          HA1       GLY   3  -8.760  10.412  10.921
   13    H    GLU   4           HN       GLU   4 -10.145   8.038  11.326
   14    HA   GLU   4           HA       GLU   4  -8.080   6.094  10.866
   15   1HB   GLU   4          HB2       GLU   4 -10.778   5.839  12.219
   16   2HB   GLU   4          HB1       GLU   4  -9.561   4.575  12.164
   17   1HG   GLU   4          HG2       GLU   4  -9.216   7.263  13.469
   18   2HG   GLU   4          HG1       GLU   4  -9.614   5.761  14.305
   19    H    ALA   5           HN       ALA   5  -8.295   6.239   8.587
   20    HA   ALA   5           HA       ALA   5 -10.337   4.393   7.525
   21   1HB   ALA   5          HB1       ALA   5 -10.339   5.704   5.434
   22   2HB   ALA   5          HB2       ALA   5  -9.229   6.862   6.166
   23   3HB   ALA   5          HB3       ALA   5 -10.862   6.682   6.807
   24    H    GLN   6           HN       GLN   6  -7.501   4.370   8.515
   25    HA   GLN   6           HA       GLN   6  -5.517   3.455   8.156
   26   1HB   GLN   6          HB2       GLN   6  -6.749   1.488   7.389
   27   2HB   GLN   6          HB1       GLN   6  -6.845   2.159   5.766
   28   1HG   GLN   6          HG2       GLN   6  -4.393   2.054   5.607
   29   2HG   GLN   6          HG1       GLN   6  -4.342   1.314   7.205
   30   1HE2  GLN   6          HE21      GLN   6  -3.484   0.326   4.606
   31   2HE2  GLN   6          HE22      GLN   6  -4.353  -1.154   4.375
   32    H    ARG   7           HN       ARG   7  -3.665   4.181   7.423
   33    HA   ARG   7           HA       ARG   7  -3.616   6.302   5.526
   34   1HB   ARG   7          HB2       ARG   7  -1.190   6.280   5.799
   35   2HB   ARG   7          HB1       ARG   7  -1.987   6.175   7.365
   36   1HG   ARG   7          HG2       ARG   7  -1.567   3.753   7.396
   37   2HG   ARG   7          HG1       ARG   7  -0.759   3.904   5.833
   38   1HD   ARG   7          HD2       ARG   7   0.820   3.816   7.705
   39   2HD   ARG   7          HD1       ARG   7   0.931   5.307   6.779
   40    HE   ARG   7           HE       ARG   7  -0.128   6.460   8.582
   41   1HH1  ARG   7          HH11      ARG   7   0.382   3.087   9.409
   42   2HH1  ARG   7          HH12      ARG   7   0.777   3.380  11.032
   43   1HH2  ARG   7          HH21      ARG   7   0.294   6.890  10.778
   44   2HH2  ARG   7          HH22      ARG   7   0.710   5.633  11.869
   45    H    ASP   8           HN       ASP   8  -2.191   6.279   3.602
   46    HA   ASP   8           HA       ASP   8  -2.818   3.950   1.982
   47   1HB   ASP   8          HB2       ASP   8  -3.123   6.299   1.147
   48   2HB   ASP   8          HB1       ASP   8  -1.375   6.492   1.211
   49    H    LEU   9           HN       LEU   9  -1.040   3.010   0.609
   50    HA   LEU   9           HA       LEU   9   1.130   2.464   2.415
   51   1HB   LEU   9          HB2       LEU   9   0.385   1.153  -0.177
   52   2HB   LEU   9          HB1       LEU   9   1.718   0.659   0.846
   53    HG   LEU   9           HG       LEU   9  -1.207   0.561   1.549
   54   1HD1  LEU   9          HD11      LEU   9  -0.525  -1.167  -0.002
   55   2HD1  LEU   9          HD12      LEU   9  -0.845  -1.854   1.592
   56   3HD1  LEU   9          HD13      LEU   9   0.817  -1.610   1.055
   57   1HD2  LEU   9          HD21      LEU   9   0.130   1.142   3.490
   58   2HD2  LEU   9          HD22      LEU   9   1.208  -0.218   3.178
   59   3HD2  LEU   9          HD23      LEU   9  -0.474  -0.510   3.626
   60    H    VAL  10           HN       VAL  10   0.622   4.126  -0.629
   61    HA   VAL  10           HA       VAL  10   3.454   4.326  -1.079
   62    HB   VAL  10           HB       VAL  10   1.062   5.659  -2.407
   63   1HG1  VAL  10          HG11      VAL  10   2.925   7.292  -2.393
   64   2HG1  VAL  10          HG12      VAL  10   2.623   6.674  -4.016
   65   3HG1  VAL  10          HG13      VAL  10   3.990   6.068  -3.079
   66   1HG2  VAL  10          HG21      VAL  10   1.494   3.354  -2.944
   67   2HG2  VAL  10          HG22      VAL  10   3.158   3.744  -3.381
   68   3HG2  VAL  10          HG23      VAL  10   1.817   4.390  -4.334
   69    H    LYS  11           HN       LYS  11   0.908   6.147   0.369
   70    HA   LYS  11           HA       LYS  11   2.628   8.354   0.913
   71   1HB   LYS  11          HB2       LYS  11  -0.147   7.751   1.968
   72   2HB   LYS  11          HB1       LYS  11   0.826   9.137   2.450
   73   1HG   LYS  11          HG2       LYS  11  -0.695   9.921   0.805
   74   2HG   LYS  11          HG1       LYS  11   0.887   9.837   0.044
   75   1HD   LYS  11          HD2       LYS  11   0.219   7.675  -0.986
   76   2HD   LYS  11          HD1       LYS  11  -1.388   7.868  -0.277
   77   1HE   LYS  11          HE2       LYS  11  -1.578  10.040  -1.489
   78   2HE   LYS  11          HE1       LYS  11  -0.054   9.672  -2.288
   79   1HZ   LYS  11          HZ1       LYS  11  -2.663   8.270  -2.602
   80   2HZ   LYS  11          HZ2       LYS  11  -1.234   7.572  -3.134
   81   3HZ   LYS  11          HZ3       LYS  11  -1.710   9.030  -3.770
   82    H    ALA  12           HN       ALA  12   2.615   5.363   2.182
   83    HA   ALA  12           HA       ALA  12   3.784   6.312   4.695
   84   1HB   ALA  12          HB1       ALA  12   3.486   4.038   5.550
   85   2HB   ALA  12          HB2       ALA  12   2.820   3.534   3.996
   86   3HB   ALA  12          HB3       ALA  12   1.952   4.704   4.991
   87    H    VAL  13           HN       VAL  13   4.264   3.676   2.319
   88    HA   VAL  13           HA       VAL  13   6.944   3.183   3.112
   89    HB   VAL  13           HB       VAL  13   5.440   2.276   0.638
   90   1HG1  VAL  13          HG11      VAL  13   7.166   0.537   0.423
   91   2HG1  VAL  13          HG12      VAL  13   8.072   1.280   1.745
   92   3HG1  VAL  13          HG13      VAL  13   7.828   2.160   0.234
   93   1HG2  VAL  13          HG21      VAL  13   6.030   0.885   3.240
   94   2HG2  VAL  13          HG22      VAL  13   5.212   0.161   1.849
   95   3HG2  VAL  13          HG23      VAL  13   4.459   1.500   2.723
   96    H    ALA  14           HN       ALA  14   5.570   4.737   0.214
   97    HA   ALA  14           HA       ALA  14   8.104   5.326  -0.892
   98   1HB   ALA  14          HB1       ALA  14   6.062   5.257  -2.289
   99   2HB   ALA  14          HB2       ALA  14   6.890   6.807  -2.464
  100   3HB   ALA  14          HB3       ALA  14   5.448   6.673  -1.451
  101    H    HIS  15           HN       HIS  15   6.029   6.905   1.349
  102    HA   HIS  15           HA       HIS  15   7.148   9.481   1.389
  103   1HB   HIS  15          HB2       HIS  15   5.008   8.733   2.530
  104   2HB   HIS  15          HB1       HIS  15   6.005   8.014   3.780
  105    HD1  HIS  15           HD1      HIS  15   4.080  10.906   3.190
  106    HD2  HIS  15           HD2      HIS  15   7.780  10.255   4.956
  107    HE1  HIS  15           HE1      HIS  15   4.497  12.899   4.636
  108    HE2  HIS  15           HE2      HIS  15   6.890  12.629   5.337
  109    H    ILE  16           HN       ILE  16   8.255   6.463   2.815
  110    HA   ILE  16           HA       ILE  16  10.201   7.541   4.581
  111    HB   ILE  16           HB       ILE  16  10.212   4.853   3.148
  112   1HG1  ILE  16          HG12      ILE  16   8.217   5.142   4.554
  113   2HG1  ILE  16          HG11      ILE  16   9.286   3.910   5.212
  114   1HG2  ILE  16          HG21      ILE  16  12.435   5.396   3.957
  115   2HG2  ILE  16          HG22      ILE  16  11.743   4.087   4.912
  116   3HG2  ILE  16          HG23      ILE  16  11.791   5.725   5.566
  117   1HD1  ILE  16          HD11      ILE  16  10.102   5.513   6.870
  118   2HD1  ILE  16          HD12      ILE  16   8.350   5.311   6.964
  119   3HD1  ILE  16          HD13      ILE  16   9.035   6.745   6.199
  120    H    LEU  17           HN       LEU  17  10.255   6.575   1.210
  121    HA   LEU  17           HA       LEU  17  13.037   7.295   0.824
  122   1HB   LEU  17          HB2       LEU  17  10.882   6.581  -1.167
  123   2HB   LEU  17          HB1       LEU  17  12.572   6.810  -1.560
  124    HG   LEU  17           HG       LEU  17  11.502   4.646   0.254
  125   1HD1  LEU  17          HD11      LEU  17  10.821   4.315  -2.069
  126   2HD1  LEU  17          HD12      LEU  17  12.040   3.134  -1.589
  127   3HD1  LEU  17          HD13      LEU  17  12.495   4.512  -2.593
  128   1HD2  LEU  17          HD21      LEU  17  13.764   3.727   0.073
  129   2HD2  LEU  17          HD22      LEU  17  13.778   5.332   0.803
  130   3HD2  LEU  17          HD23      LEU  17  14.254   5.126  -0.883
  131    H    GLY  18           HN       GLY  18  10.212   8.996   1.064
  132   1HA   GLY  18          HA2       GLY  18  10.000  11.330   0.977
  133   2HA   GLY  18          HA1       GLY  18  11.435  11.401  -0.033
  134    H    ILE  19           HN       ILE  19   9.392   9.048  -1.149
  135    HA   ILE  19           HA       ILE  19   8.595  10.836  -3.291
  136    HB   ILE  19           HB       ILE  19   8.093   8.627  -4.490
  137   1HG1  ILE  19          HG12      ILE  19  10.138   7.651  -2.489
  138   2HG1  ILE  19          HG11      ILE  19   8.460   7.137  -2.597
  139   1HG2  ILE  19          HG21      ILE  19  10.905   9.612  -4.015
  140   2HG2  ILE  19          HG22      ILE  19   9.763  10.218  -5.214
  141   3HG2  ILE  19          HG23      ILE  19  10.418   8.587  -5.362
  142   1HD1  ILE  19          HD11      ILE  19   8.900   6.167  -4.793
  143   2HD1  ILE  19          HD12      ILE  19   9.968   5.492  -3.559
  144   3HD1  ILE  19          HD13      ILE  19  10.579   6.699  -4.688
  145    H    ARG  20           HN       ARG  20   6.770   9.913  -4.544
  146    HA   ARG  20           HA       ARG  20   4.533   8.652  -3.534
  147   1HB   ARG  20          HB2       ARG  20   4.440  10.629  -1.969
  148   2HB   ARG  20          HB1       ARG  20   4.448  11.660  -3.399
  149   1HG   ARG  20          HG2       ARG  20   2.280  10.727  -4.080
  150   2HG   ARG  20          HG1       ARG  20   2.265   9.723  -2.628
  151   1HD   ARG  20          HD2       ARG  20   0.922  11.782  -2.370
  152   2HD   ARG  20          HD1       ARG  20   2.262  11.697  -1.223
  153    HE   ARG  20           HE       ARG  20   3.190  13.043  -3.450
  154   1HH1  ARG  20          HH11      ARG  20   0.574  13.665  -1.130
  155   2HH1  ARG  20          HH12      ARG  20   0.867  15.350  -1.112
  156   1HH2  ARG  20          HH21      ARG  20   3.528  15.255  -3.433
  157   2HH2  ARG  20          HH22      ARG  20   2.587  16.301  -2.466
  158    H    ASP  21           HN       ASP  21   5.939  11.304  -5.310
  159    HA   ASP  21           HA       ASP  21   4.150  11.418  -7.457
  160   1HB   ASP  21          HB2       ASP  21   5.843  12.718  -8.664
  161   2HB   ASP  21          HB1       ASP  21   5.785  13.235  -6.990
  162    H    LEU  22           HN       LEU  22   7.361   9.872  -7.501
  163    HA   LEU  22           HA       LEU  22   8.191   8.132  -8.691
  164   1HB   LEU  22          HB2       LEU  22   5.256   7.494  -9.028
  165   2HB   LEU  22          HB1       LEU  22   6.504   6.554  -9.810
  166    HG   LEU  22           HG       LEU  22   5.568   5.527  -7.803
  167   1HD1  LEU  22          HD11      LEU  22   7.733   4.875  -6.822
  168   2HD1  LEU  22          HD12      LEU  22   8.478   6.249  -7.644
  169   3HD1  LEU  22          HD13      LEU  22   7.783   4.937  -8.587
  170   1HD2  LEU  22          HD21      LEU  22   5.190   7.487  -6.384
  171   2HD2  LEU  22          HD22      LEU  22   6.919   7.772  -6.288
  172   3HD2  LEU  22          HD23      LEU  22   6.226   6.327  -5.559
  173    H    ALA  23           HN       ALA  23   7.694  10.764  -9.790
  174    HA   ALA  23           HA       ALA  23   6.935  10.369 -12.533
  175   1HB   ALA  23          HB1       ALA  23   8.098  12.785 -11.154
  176   2HB   ALA  23          HB2       ALA  23   6.378  12.446 -11.361
  177   3HB   ALA  23          HB3       ALA  23   7.392  12.755 -12.769
  178    H    GLY  24           HN       GLY  24   9.625   9.999 -10.743
  179   1HA   GLY  24          HA2       GLY  24  11.179   9.348 -13.072
  180   2HA   GLY  24          HA1       GLY  24  11.867  10.670 -12.108
  181    H    ILE  25           HN       ILE  25  10.149   7.722 -11.253
  182    HA   ILE  25           HA       ILE  25  12.484   6.655  -9.885
  183    HB   ILE  25           HB       ILE  25   9.719   6.902  -8.613
  184   1HG1  ILE  25          HG12      ILE  25  10.973   9.068  -8.583
  185   2HG1  ILE  25          HG11      ILE  25  10.622   8.434  -6.980
  186   1HG2  ILE  25          HG21      ILE  25  10.834   4.848  -7.951
  187   2HG2  ILE  25          HG22      ILE  25  10.747   5.956  -6.582
  188   3HG2  ILE  25          HG23      ILE  25  12.265   5.755  -7.458
  189   1HD1  ILE  25          HD11      ILE  25  13.267   8.264  -8.414
  190   2HD1  ILE  25          HD12      ILE  25  12.905   7.633  -6.802
  191   3HD1  ILE  25          HD13      ILE  25  12.848   9.370  -7.099
  192    H    ASN  26           HN       ASN  26  12.299   4.360  -9.813
  193    HA   ASN  26           HA       ASN  26  10.892   3.138 -11.916
  194   1HB   ASN  26          HB2       ASN  26  12.294   1.998  -9.507
  195   2HB   ASN  26          HB1       ASN  26  11.498   0.977 -10.696
  196   1HD2  ASN  26          HD21      ASN  26  12.405   0.743 -12.689
  197   2HD2  ASN  26          HD22      ASN  26  14.019   1.211 -13.074
  198    H    LEU  27           HN       LEU  27   8.772   3.144 -11.976
  199    HA   LEU  27           HA       LEU  27   7.310   2.484  -9.544
  200   1HB   LEU  27          HB2       LEU  27   5.318   3.404 -10.719
  201   2HB   LEU  27          HB1       LEU  27   6.591   4.554 -10.420
  202    HG   LEU  27           HG       LEU  27   7.237   4.319 -12.862
  203   1HD1  LEU  27          HD11      LEU  27   4.583   2.910 -13.038
  204   2HD1  LEU  27          HD12      LEU  27   6.163   2.194 -13.356
  205   3HD1  LEU  27          HD13      LEU  27   5.544   3.472 -14.409
  206   1HD2  LEU  27          HD21      LEU  27   5.993   6.214 -12.017
  207   2HD2  LEU  27          HD22      LEU  27   4.480   5.330 -12.209
  208   3HD2  LEU  27          HD23      LEU  27   5.430   5.772 -13.630
  209    H    ASP  28           HN       ASP  28   8.477   0.960 -12.148
  210    HA   ASP  28           HA       ASP  28   6.314  -1.029 -12.159
  211   1HB   ASP  28          HB2       ASP  28   7.007  -1.645 -14.392
  212   2HB   ASP  28          HB1       ASP  28   6.717   0.089 -14.347
  213    H    SER  29           HN       SER  29   8.930  -0.510 -10.575
  214    HA   SER  29           HA       SER  29  10.153  -3.114 -11.064
  215   1HB   SER  29          HB2       SER  29  11.292  -0.706  -9.644
  216   2HB   SER  29          HB1       SER  29  12.131  -2.224  -9.960
  217    HG   SER  29           HG       SER  29  12.717  -1.266 -11.701
  218    H    SER  30           HN       SER  30  10.142  -4.565  -9.555
  219    HA   SER  30           HA       SER  30   8.333  -4.512  -7.416
  220   1HB   SER  30          HB2       SER  30  10.694  -6.323  -7.888
  221   2HB   SER  30          HB1       SER  30   9.258  -6.713  -6.953
  222    HG   SER  30           HG       SER  30   9.581  -6.374  -9.728
  223    H    LEU  31           HN       LEU  31   8.726  -4.356  -5.165
  224    HA   LEU  31           HA       LEU  31  10.699  -2.632  -4.236
  225   1HB   LEU  31          HB2       LEU  31   9.295  -4.745  -2.584
  226   2HB   LEU  31          HB1       LEU  31  10.109  -3.331  -1.964
  227    HG   LEU  31           HG       LEU  31   7.541  -3.398  -3.540
  228   1HD1  LEU  31          HD11      LEU  31   7.296  -4.090  -1.244
  229   2HD1  LEU  31          HD12      LEU  31   6.565  -2.506  -1.496
  230   3HD1  LEU  31          HD13      LEU  31   8.133  -2.638  -0.695
  231   1HD2  LEU  31          HD21      LEU  31   8.826  -1.428  -4.149
  232   2HD2  LEU  31          HD22      LEU  31   9.014  -1.013  -2.438
  233   3HD2  LEU  31          HD23      LEU  31   7.409  -1.017  -3.182
  234    H    ALA  32           HN       ALA  32  10.804  -6.056  -4.744
  235    HA   ALA  32           HA       ALA  32  13.084  -6.525  -3.123
  236   1HB   ALA  32          HB1       ALA  32  11.890  -8.170  -5.348
  237   2HB   ALA  32          HB2       ALA  32  11.763  -8.423  -3.586
  238   3HB   ALA  32          HB3       ALA  32  13.288  -8.668  -4.406
  239    H    ASP  33           HN       ASP  33  12.590  -5.365  -6.323
  240    HA   ASP  33           HA       ASP  33  15.230  -5.903  -7.290
  241   1HB   ASP  33          HB2       ASP  33  13.440  -5.587  -8.916
  242   2HB   ASP  33          HB1       ASP  33  13.118  -3.970  -8.290
  243    H    LEU  34           HN       LEU  34  13.488  -3.358  -5.823
  244    HA   LEU  34           HA       LEU  34  15.432  -1.305  -5.856
  245   1HB   LEU  34          HB2       LEU  34  13.387  -1.743  -3.702
  246   2HB   LEU  34          HB1       LEU  34  14.063  -0.230  -4.262
  247    HG   LEU  34           HG       LEU  34  12.140  -1.971  -5.789
  248   1HD1  LEU  34          HD11      LEU  34  10.544  -0.183  -5.365
  249   2HD1  LEU  34          HD12      LEU  34  11.736   0.608  -4.314
  250   3HD1  LEU  34          HD13      LEU  34  11.112  -0.999  -3.909
  251   1HD2  LEU  34          HD21      LEU  34  13.606  -0.720  -7.274
  252   2HD2  LEU  34          HD22      LEU  34  13.183   0.781  -6.423
  253   3HD2  LEU  34          HD23      LEU  34  11.942  -0.129  -7.306
  254    H    GLY  35           HN       GLY  35  14.333  -3.542  -3.346
  255   1HA   GLY  35          HA2       GLY  35  15.760  -4.705  -1.861
  256   2HA   GLY  35          HA1       GLY  35  16.973  -3.434  -2.082
  257    H    LEU  36           HN       LEU  36  13.975  -4.277  -0.579
  258    HA   LEU  36           HA       LEU  36  13.619  -1.669   0.508
  259   1HB   LEU  36          HB2       LEU  36  11.697  -2.529   1.712
  260   2HB   LEU  36          HB1       LEU  36  11.659  -3.062   0.055
  261    HG   LEU  36           HG       LEU  36  12.661  -5.286   1.075
  262   1HD1  LEU  36          HD11      LEU  36  12.977  -4.441   3.338
  263   2HD1  LEU  36          HD12      LEU  36  11.819  -5.773   3.304
  264   3HD1  LEU  36          HD13      LEU  36  11.245  -4.115   3.458
  265   1HD2  LEU  36          HD21      LEU  36   9.775  -4.475   1.389
  266   2HD2  LEU  36          HD22      LEU  36  10.382  -6.131   1.350
  267   3HD2  LEU  36          HD23      LEU  36  10.524  -5.103  -0.078
  268    H    ASP  37           HN       ASP  37  13.783  -0.985   2.543
  269    HA   ASP  37           HA       ASP  37  16.133  -1.377   3.907
  270   1HB   ASP  37          HB2       ASP  37  14.875   0.631   4.135
  271   2HB   ASP  37          HB1       ASP  37  13.475  -0.221   4.739
  272    H    SER  38           HN       SER  38  13.432  -1.825   5.932
  273    HA   SER  38           HA       SER  38  13.470  -4.623   6.409
  274   1HB   SER  38          HB2       SER  38  14.569  -2.772   8.597
  275   2HB   SER  38          HB1       SER  38  14.191  -4.477   8.808
  276    HG   SER  38           HG       SER  38  15.912  -3.925   6.741
  277    H    LEU  39           HN       LEU  39  12.949  -1.375   7.718
  278    HA   LEU  39           HA       LEU  39  10.500  -1.849   9.017
  279   1HB   LEU  39          HB2       LEU  39  11.896   0.135   9.364
  280   2HB   LEU  39          HB1       LEU  39  11.552   0.660   7.726
  281    HG   LEU  39           HG       LEU  39   9.116   0.657   8.417
  282   1HD1  LEU  39          HD11      LEU  39   9.278  -0.603  10.447
  283   2HD1  LEU  39          HD12      LEU  39   8.657   1.014  10.783
  284   3HD1  LEU  39          HD13      LEU  39  10.336   0.619  11.158
  285   1HD2  LEU  39          HD21      LEU  39  10.375   2.625   7.963
  286   2HD2  LEU  39          HD22      LEU  39  11.042   2.625   9.604
  287   3HD2  LEU  39          HD23      LEU  39   9.308   2.906   9.343
  288    H    MET  40           HN       MET  40  11.414  -1.186   5.775
  289    HA   MET  40           HA       MET  40   8.885  -0.512   4.643
  290   1HB   MET  40          HB2       MET  40  11.368  -1.601   3.317
  291   2HB   MET  40          HB1       MET  40   9.968  -0.940   2.490
  292   1HG   MET  40          HG2       MET  40  10.378   1.228   3.379
  293   2HG   MET  40          HG1       MET  40  11.678   0.608   4.402
  294   1HE   MET  40          HE1       MET  40  13.316   2.460   3.480
  295   2HE   MET  40          HE2       MET  40  12.029   3.098   2.455
  296   3HE   MET  40          HE3       MET  40  13.613   2.743   1.766
  297    H    GLY  41           HN       GLY  41   9.668  -3.271   6.031
  298   1HA   GLY  41          HA2       GLY  41   7.812  -4.780   4.326
  299   2HA   GLY  41          HA1       GLY  41   9.195  -5.552   5.106
  300    H    VAL  42           HN       VAL  42   9.177  -4.298   7.538
  301    HA   VAL  42           HA       VAL  42   7.231  -5.880   8.921
  302    HB   VAL  42           HB       VAL  42   9.143  -3.767   9.969
  303   1HG1  VAL  42          HG11      VAL  42   7.703  -5.958  11.449
  304   2HG1  VAL  42          HG12      VAL  42   7.381  -4.228  11.567
  305   3HG1  VAL  42          HG13      VAL  42   8.921  -4.881  12.131
  306   1HG2  VAL  42          HG21      VAL  42   9.488  -6.752   9.741
  307   2HG2  VAL  42          HG22      VAL  42  10.598  -5.645  10.560
  308   3HG2  VAL  42          HG23      VAL  42  10.339  -5.506   8.822
  309    H    GLU  43           HN       GLU  43   7.506  -2.369   8.357
  310    HA   GLU  43           HA       GLU  43   5.288  -1.861  10.050
  311   1HB   GLU  43          HB2       GLU  43   6.951  -0.122   9.656
  312   2HB   GLU  43          HB1       GLU  43   6.564  -0.111   7.942
  313   1HG   GLU  43          HG2       GLU  43   4.394   0.781   8.364
  314   2HG   GLU  43          HG1       GLU  43   4.589   0.567  10.100
  315    H    VAL  44           HN       VAL  44   5.708  -2.582   6.716
  316    HA   VAL  44           HA       VAL  44   3.223  -1.882   5.621
  317    HB   VAL  44           HB       VAL  44   4.767  -4.401   5.002
  318   1HG1  VAL  44          HG11      VAL  44   2.615  -4.307   3.947
  319   2HG1  VAL  44          HG12      VAL  44   3.901  -4.143   2.751
  320   3HG1  VAL  44          HG13      VAL  44   2.984  -2.719   3.264
  321   1HG2  VAL  44          HG21      VAL  44   6.286  -2.603   5.036
  322   2HG2  VAL  44          HG22      VAL  44   5.263  -1.621   3.972
  323   3HG2  VAL  44          HG23      VAL  44   6.032  -3.107   3.372
  324    H    ARG  45           HN       ARG  45   4.363  -4.826   7.108
  325    HA   ARG  45           HA       ARG  45   2.048  -6.356   7.122
  326   1HB   ARG  45          HB2       ARG  45   4.262  -6.229   9.155
  327   2HB   ARG  45          HB1       ARG  45   3.156  -7.566   9.056
  328   1HG   ARG  45          HG2       ARG  45   4.022  -7.966   6.729
  329   2HG   ARG  45          HG1       ARG  45   5.234  -6.725   7.065
  330   1HD   ARG  45          HD2       ARG  45   4.851  -9.376   8.432
  331   2HD   ARG  45          HD1       ARG  45   6.269  -8.792   7.556
  332    HE   ARG  45           HE       ARG  45   5.488  -7.233   9.834
  333   1HH1  ARG  45          HH11      ARG  45   7.756  -9.754   8.659
  334   2HH1  ARG  45          HH12      ARG  45   8.613  -9.791  10.115
  335   1HH2  ARG  45          HH21      ARG  45   6.635  -7.435  11.816
  336   2HH2  ARG  45          HH22      ARG  45   8.033  -8.424  11.940
  337    H    GLN  46           HN       GLN  46   3.299  -4.123   9.585
  338    HA   GLN  46           HA       GLN  46   1.192  -4.446  11.431
  339   1HB   GLN  46          HB2       GLN  46   3.130  -2.156  11.088
  340   2HB   GLN  46          HB1       GLN  46   2.046  -2.345  12.461
  341   1HG   GLN  46          HG2       GLN  46   3.125  -4.391  13.098
  342   2HG   GLN  46          HG1       GLN  46   4.122  -4.353  11.650
  343   1HE2  GLN  46          HE21      GLN  46   5.944  -4.404  12.788
  344   2HE2  GLN  46          HE22      GLN  46   6.623  -3.083  13.661
  345    H    ILE  47           HN       ILE  47   1.317  -2.617   8.523
  346    HA   ILE  47           HA       ILE  47  -0.864  -0.891   9.266
  347    HB   ILE  47           HB       ILE  47   0.422  -1.402   6.557
  348   1HG1  ILE  47          HG12      ILE  47   0.679   0.965   8.432
  349   2HG1  ILE  47          HG11      ILE  47   1.884  -0.298   8.206
  350   1HG2  ILE  47          HG21      ILE  47  -1.892  -0.687   6.273
  351   2HG2  ILE  47          HG22      ILE  47  -0.786   0.596   5.777
  352   3HG2  ILE  47          HG23      ILE  47  -1.609   0.694   7.335
  353   1HD1  ILE  47          HD11      ILE  47   0.951   1.646   6.102
  354   2HD1  ILE  47          HD12      ILE  47   2.177   0.395   5.886
  355   3HD1  ILE  47          HD13      ILE  47   2.467   1.734   6.999
  356    H    LEU  48           HN       LEU  48  -0.397  -3.353   6.787
  357    HA   LEU  48           HA       LEU  48  -3.139  -3.493   6.128
  358   1HB   LEU  48          HB2       LEU  48  -0.875  -5.369   5.508
  359   2HB   LEU  48          HB1       LEU  48  -2.498  -5.696   4.975
  360    HG   LEU  48           HG       LEU  48  -1.365  -4.806   3.139
  361   1HD1  LEU  48          HD11      LEU  48  -3.576  -3.932   3.348
  362   2HD1  LEU  48          HD12      LEU  48  -2.504  -2.712   2.648
  363   3HD1  LEU  48          HD13      LEU  48  -2.966  -2.615   4.354
  364   1HD2  LEU  48          HD21      LEU  48   0.559  -3.855   4.253
  365   2HD2  LEU  48          HD22      LEU  48  -0.436  -2.543   4.884
  366   3HD2  LEU  48          HD23      LEU  48  -0.154  -2.679   3.148
  367    H    GLU  49           HN       GLU  49  -1.173  -5.553   8.180
  368    HA   GLU  49           HA       GLU  49  -3.159  -7.504   8.601
  369   1HB   GLU  49          HB2       GLU  49  -0.830  -8.075   8.772
  370   2HB   GLU  49          HB1       GLU  49  -0.561  -6.868  10.000
  371   1HG   GLU  49          HG2       GLU  49  -2.337  -9.231  10.499
  372   2HG   GLU  49          HG1       GLU  49  -0.588  -9.358  10.622
  373    H    ARG  50           HN       ARG  50  -2.204  -4.659  10.447
  374    HA   ARG  50           HA       ARG  50  -4.036  -5.446  12.541
  375   1HB   ARG  50          HB2       ARG  50  -2.360  -2.950  12.382
  376   2HB   ARG  50          HB1       ARG  50  -3.273  -3.508  13.780
  377   1HG   ARG  50          HG2       ARG  50  -1.865  -5.553  13.793
  378   2HG   ARG  50          HG1       ARG  50  -0.887  -4.826  12.516
  379   1HD   ARG  50          HD2       ARG  50  -1.318  -3.774  15.306
  380   2HD   ARG  50          HD1       ARG  50   0.165  -4.457  14.649
  381    HE   ARG  50           HE       ARG  50  -0.723  -2.245  13.125
  382   1HH1  ARG  50          HH11      ARG  50   1.157  -3.140  16.002
  383   2HH1  ARG  50          HH12      ARG  50   1.846  -1.594  16.210
  384   1HH2  ARG  50          HH21      ARG  50   0.183  -0.123  13.438
  385   2HH2  ARG  50          HH22      ARG  50   1.292   0.166  14.708
  386    H    GLU  51           HN       GLU  51  -3.982  -3.081   9.947
  387    HA   GLU  51           HA       GLU  51  -6.262  -1.698  11.005
  388   1HB   GLU  51          HB2       GLU  51  -4.788  -1.474   8.397
  389   2HB   GLU  51          HB1       GLU  51  -6.186  -0.491   8.776
  390   1HG   GLU  51          HG2       GLU  51  -3.713  -0.553  10.488
  391   2HG   GLU  51          HG1       GLU  51  -3.919   0.558   9.136
  392    H    HIS  52           HN       HIS  52  -5.750  -3.992   8.293
  393    HA   HIS  52           HA       HIS  52  -8.690  -4.214   8.183
  394   1HB   HIS  52          HB2       HIS  52  -6.861  -3.595   5.934
  395   2HB   HIS  52          HB1       HIS  52  -8.222  -4.653   5.597
  396    HD1  HIS  52           HD1      HIS  52  -9.826  -3.227   4.384
  397    HD2  HIS  52           HD2      HIS  52  -8.258  -1.264   7.691
  398    HE1  HIS  52           HE1      HIS  52 -11.044  -1.045   4.514
  399    HE2  HIS  52           HE2      HIS  52 -10.261   0.000   6.644
  400    H    ASP  53           HN       ASP  53  -6.257  -6.009   9.055
  401    HA   ASP  53           HA       ASP  53  -5.992  -8.225   9.430
  402   1HB   ASP  53          HB2       ASP  53  -8.639  -8.589   8.002
  403   2HB   ASP  53          HB1       ASP  53  -7.740  -9.906   8.729
  404    H    LEU  54           HN       LEU  54  -5.328  -6.882   6.722
  405    HA   LEU  54           HA       LEU  54  -5.011  -9.278   5.105
  406   1HB   LEU  54          HB2       LEU  54  -4.304  -6.396   4.587
  407   2HB   LEU  54          HB1       LEU  54  -3.650  -7.667   3.578
  408    HG   LEU  54           HG       LEU  54  -6.038  -8.262   3.003
  409   1HD1  LEU  54          HD11      LEU  54  -6.614  -5.627   4.321
  410   2HD1  LEU  54          HD12      LEU  54  -7.150  -7.210   4.879
  411   3HD1  LEU  54          HD13      LEU  54  -7.740  -6.569   3.344
  412   1HD2  LEU  54          HD21      LEU  54  -6.275  -6.424   1.408
  413   2HD2  LEU  54          HD22      LEU  54  -4.617  -7.026   1.487
  414   3HD2  LEU  54          HD23      LEU  54  -5.046  -5.512   2.286
  415    H    VAL  55           HN       VAL  55  -3.607 -10.570   6.161
  416    HA   VAL  55           HA       VAL  55  -1.134  -9.437   7.122
  417    HB   VAL  55           HB       VAL  55  -1.811 -12.386   6.954
  418   1HG1  VAL  55          HG11      VAL  55   0.535 -11.908   7.296
  419   2HG1  VAL  55          HG12      VAL  55  -0.159 -12.594   8.763
  420   3HG1  VAL  55          HG13      VAL  55   0.148 -10.859   8.655
  421   1HG2  VAL  55          HG21      VAL  55  -2.332 -10.488   9.243
  422   2HG2  VAL  55          HG22      VAL  55  -2.535 -12.239   9.295
  423   3HG2  VAL  55          HG23      VAL  55  -3.555 -11.261   8.237
  424    H    LEU  56           HN       LEU  56  -0.371  -8.613   5.231
  425    HA   LEU  56           HA       LEU  56   0.335 -10.421   3.071
  426   1HB   LEU  56          HB2       LEU  56   0.844  -7.464   3.360
  427   2HB   LEU  56          HB1       LEU  56   1.114  -8.414   1.922
  428    HG   LEU  56           HG       LEU  56  -1.582  -7.812   3.145
  429   1HD1  LEU  56          HD11      LEU  56  -1.937  -6.498   1.118
  430   2HD1  LEU  56          HD12      LEU  56  -0.288  -6.851   0.604
  431   3HD1  LEU  56          HD13      LEU  56  -0.571  -5.892   2.056
  432   1HD2  LEU  56          HD21      LEU  56  -2.508  -8.893   1.156
  433   2HD2  LEU  56          HD22      LEU  56  -1.544 -10.024   2.105
  434   3HD2  LEU  56          HD23      LEU  56  -0.881  -9.325   0.627
  435    HA   PRO  57           HA       PRO  57   4.287 -10.752   5.118
  436   1HB   PRO  57          HB2       PRO  57   4.753 -12.963   3.333
  437   2HB   PRO  57          HB1       PRO  57   4.490 -13.012   5.077
  438   1HG   PRO  57          HG2       PRO  57   2.712 -14.007   3.278
  439   2HG   PRO  57          HG1       PRO  57   2.216 -13.318   4.840
  440   1HD   PRO  57          HD2       PRO  57   2.240 -12.053   2.132
  441   2HD   PRO  57          HD1       PRO  57   0.968 -12.022   3.379
  442    H    ILE  58           HN       ILE  58   6.531 -10.980   4.269
  443    HA   ILE  58           HA       ILE  58   6.991  -8.920   2.444
  444    HB   ILE  58           HB       ILE  58   8.819 -10.819   3.869
  445   1HG1  ILE  58          HG12      ILE  58   9.834  -8.561   4.563
  446   2HG1  ILE  58          HG11      ILE  58   8.478  -7.893   3.645
  447   1HG2  ILE  58          HG21      ILE  58   9.819  -8.988   1.686
  448   2HG2  ILE  58          HG22      ILE  58   9.849 -10.745   1.659
  449   3HG2  ILE  58          HG23      ILE  58  10.820  -9.867   2.837
  450   1HD1  ILE  58          HD11      ILE  58   6.898  -8.844   5.162
  451   2HD1  ILE  58          HD12      ILE  58   8.077  -7.891   6.062
  452   3HD1  ILE  58          HD13      ILE  58   8.186  -9.651   6.055
  453    H    ARG  59           HN       ARG  59   6.950 -12.323   1.903
  454    HA   ARG  59           HA       ARG  59   7.974 -12.138  -0.728
  455   1HB   ARG  59          HB2       ARG  59   7.281 -14.444  -1.117
  456   2HB   ARG  59          HB1       ARG  59   8.089 -14.264   0.422
  457   1HG   ARG  59          HG2       ARG  59   5.100 -14.486   0.091
  458   2HG   ARG  59          HG1       ARG  59   6.178 -15.836   0.434
  459   1HD   ARG  59          HD2       ARG  59   5.719 -13.415   2.173
  460   2HD   ARG  59          HD1       ARG  59   5.105 -15.034   2.476
  461    HE   ARG  59           HE       ARG  59   7.981 -14.818   2.258
  462   1HH1  ARG  59          HH11      ARG  59   5.241 -15.322   4.356
  463   2HH1  ARG  59          HH12      ARG  59   6.070 -15.189   5.836
  464   1HH2  ARG  59          HH21      ARG  59   9.254 -14.728   4.279
  465   2HH2  ARG  59          HH22      ARG  59   8.443 -14.875   5.773
  466    H    GLU  60           HN       GLU  60   4.990 -11.140   0.408
  467    HA   GLU  60           HA       GLU  60   3.805 -11.191  -2.307
  468   1HB   GLU  60          HB2       GLU  60   2.617 -10.301   0.341
  469   2HB   GLU  60          HB1       GLU  60   1.770 -10.345  -1.193
  470   1HG   GLU  60          HG2       GLU  60   2.832 -12.744   0.277
  471   2HG   GLU  60          HG1       GLU  60   1.158 -12.178   0.310
  472    H    VAL  61           HN       VAL  61   4.977  -9.149   0.262
  473    HA   VAL  61           HA       VAL  61   4.239  -6.692  -0.919
  474    HB   VAL  61           HB       VAL  61   6.360  -7.254   1.188
  475   1HG1  VAL  61          HG11      VAL  61   5.011  -4.653   0.476
  476   2HG1  VAL  61          HG12      VAL  61   6.699  -5.066   0.180
  477   3HG1  VAL  61          HG13      VAL  61   6.109  -4.908   1.833
  478   1HG2  VAL  61          HG21      VAL  61   4.643  -6.584   2.801
  479   2HG2  VAL  61          HG22      VAL  61   4.163  -8.011   1.883
  480   3HG2  VAL  61          HG23      VAL  61   3.473  -6.437   1.490
  481    H    ARG  62           HN       ARG  62   7.124  -8.655  -1.096
  482    HA   ARG  62           HA       ARG  62   8.771  -6.710  -2.215
  483   1HB   ARG  62          HB2       ARG  62   8.989  -9.613  -1.896
  484   2HB   ARG  62          HB1       ARG  62  10.066  -8.869  -3.063
  485   1HG   ARG  62          HG2       ARG  62  10.756  -7.265  -1.252
  486   2HG   ARG  62          HG1       ARG  62   9.775  -8.205  -0.133
  487   1HD   ARG  62          HD2       ARG  62  11.165 -10.151  -0.496
  488   2HD   ARG  62          HD1       ARG  62  12.094  -9.296  -1.730
  489    HE   ARG  62           HE       ARG  62  12.239  -7.766   0.566
  490   1HH1  ARG  62          HH11      ARG  62  13.324 -11.026  -0.400
  491   2HH1  ARG  62          HH12      ARG  62  14.642 -11.013   0.662
  492   1HH2  ARG  62          HH21      ARG  62  14.134  -7.821   2.056
  493   2HH2  ARG  62          HH22      ARG  62  15.090  -9.209   2.024
  494    H    GLN  63           HN       GLN  63   6.270  -8.313  -3.866
  495    HA   GLN  63           HA       GLN  63   7.648  -7.751  -6.396
  496   1HB   GLN  63          HB2       GLN  63   5.787  -8.923  -7.580
  497   2HB   GLN  63          HB1       GLN  63   6.616  -9.962  -6.435
  498   1HG   GLN  63          HG2       GLN  63   4.222  -8.555  -5.467
  499   2HG   GLN  63          HG1       GLN  63   3.970  -9.789  -6.700
  500   1HE2  GLN  63          HE21      GLN  63   6.647 -10.135  -4.590
  501   2HE2  GLN  63          HE22      GLN  63   5.952 -11.352  -3.569
  502    H    LEU  64           HN       LEU  64   5.868  -6.160  -4.257
  503    HA   LEU  64           HA       LEU  64   4.067  -4.873  -6.027
  504   1HB   LEU  64          HB2       LEU  64   5.096  -3.908  -3.350
  505   2HB   LEU  64          HB1       LEU  64   3.721  -3.249  -4.212
  506    HG   LEU  64           HG       LEU  64   3.937  -5.993  -3.018
  507   1HD1  LEU  64          HD11      LEU  64   2.276  -3.619  -2.213
  508   2HD1  LEU  64          HD12      LEU  64   3.654  -4.289  -1.339
  509   3HD1  LEU  64          HD13      LEU  64   2.170  -5.229  -1.501
  510   1HD2  LEU  64          HD21      LEU  64   1.563  -6.259  -3.617
  511   2HD2  LEU  64          HD22      LEU  64   2.589  -6.074  -5.040
  512   3HD2  LEU  64          HD23      LEU  64   1.619  -4.716  -4.470
  513    H    THR  65           HN       THR  65   4.409  -3.012  -7.203
  514    HA   THR  65           HA       THR  65   7.173  -2.447  -7.789
  515    HB   THR  65           HB       THR  65   6.019  -1.354  -9.738
  516    HG1  THR  65           HG1      THR  65   3.843  -1.549  -9.848
  517   1HG2  THR  65          HG21      THR  65   5.348  -4.225  -9.116
  518   2HG2  THR  65          HG22      THR  65   6.903  -3.677  -9.718
  519   3HG2  THR  65          HG23      THR  65   5.453  -3.527 -10.738
  520    H    LEU  66           HN       LEU  66   6.121  -1.328  -5.368
  521    HA   LEU  66           HA       LEU  66   6.081   0.551  -4.148
  522   1HB   LEU  66          HB2       LEU  66   8.213   0.992  -5.534
  523   2HB   LEU  66          HB1       LEU  66   7.233   2.038  -6.532
  524    HG   LEU  66           HG       LEU  66   8.610   3.298  -4.932
  525   1HD1  LEU  66          HD11      LEU  66   6.547   4.288  -5.634
  526   2HD1  LEU  66          HD12      LEU  66   6.870   4.697  -3.937
  527   3HD1  LEU  66          HD13      LEU  66   5.689   3.442  -4.354
  528   1HD2  LEU  66          HD21      LEU  66   8.736   1.665  -3.140
  529   2HD2  LEU  66          HD22      LEU  66   7.016   1.877  -2.810
  530   3HD2  LEU  66          HD23      LEU  66   8.137   3.212  -2.534
  531    H    ARG  67           HN       ARG  67   5.113   1.442  -7.427
  532    HA   ARG  67           HA       ARG  67   3.081   3.238  -6.604
  533   1HB   ARG  67          HB2       ARG  67   3.798   1.928  -9.150
  534   2HB   ARG  67          HB1       ARG  67   2.173   2.575  -9.001
  535   1HG   ARG  67          HG2       ARG  67   4.715   4.114  -8.577
  536   2HG   ARG  67          HG1       ARG  67   3.697   4.167 -10.022
  537   1HD   ARG  67          HD2       ARG  67   1.804   4.810  -8.431
  538   2HD   ARG  67          HD1       ARG  67   3.071   5.087  -7.245
  539    HE   ARG  67           HE       ARG  67   3.784   6.955  -8.411
  540   1HH1  ARG  67          HH11      ARG  67   1.160   5.333 -10.170
  541   2HH1  ARG  67          HH12      ARG  67   0.940   6.552 -11.306
  542   1HH2  ARG  67          HH21      ARG  67   3.513   8.686  -9.998
  543   2HH2  ARG  67          HH22      ARG  67   2.386   8.494 -11.259
  544    H    LYS  68           HN       LYS  68   3.076  -0.191  -7.242
  545    HA   LYS  68           HA       LYS  68   0.280  -0.545  -7.269
  546   1HB   LYS  68          HB2       LYS  68   1.985  -2.208  -8.063
  547   2HB   LYS  68          HB1       LYS  68   2.308  -2.578  -6.372
  548   1HG   LYS  68          HG2       LYS  68   0.022  -3.292  -6.054
  549   2HG   LYS  68          HG1       LYS  68  -0.348  -2.892  -7.730
  550   1HD   LYS  68          HD2       LYS  68   1.633  -4.911  -6.782
  551   2HD   LYS  68          HD1       LYS  68  -0.011  -5.243  -7.381
  552   1HE   LYS  68          HE2       LYS  68   2.244  -3.997  -8.987
  553   2HE   LYS  68          HE1       LYS  68   1.696  -5.663  -9.128
  554   1HZ   LYS  68          HZ1       LYS  68   0.053  -3.257  -9.714
  555   2HZ   LYS  68          HZ2       LYS  68  -0.453  -4.875  -9.888
  556   3HZ   LYS  68          HZ3       LYS  68   0.797  -4.248 -10.848
  557    H    LEU  69           HN       LEU  69   2.404   0.079  -4.733
  558    HA   LEU  69           HA       LEU  69   1.131  -1.073  -2.517
  559   1HB   LEU  69          HB2       LEU  69   2.759   1.431  -2.795
  560   2HB   LEU  69          HB1       LEU  69   1.939   1.110  -1.290
  561    HG   LEU  69           HG       LEU  69   4.296   0.496  -1.195
  562   1HD1  LEU  69          HD11      LEU  69   2.776  -0.719   0.209
  563   2HD1  LEU  69          HD12      LEU  69   4.077  -1.773  -0.346
  564   3HD1  LEU  69          HD13      LEU  69   2.478  -1.885  -1.081
  565   1HD2  LEU  69          HD21      LEU  69   3.650  -1.523  -3.329
  566   2HD2  LEU  69          HD22      LEU  69   5.190  -1.375  -2.470
  567   3HD2  LEU  69          HD23      LEU  69   4.633  -0.080  -3.534
  568    H    GLN  70           HN       GLN  70   0.268   1.831  -4.300
  569    HA   GLN  70           HA       GLN  70  -1.710   2.437  -2.308
  570   1HB   GLN  70          HB2       GLN  70  -2.191   4.498  -3.549
  571   2HB   GLN  70          HB1       GLN  70  -0.513   4.331  -3.084
  572   1HG   GLN  70          HG2       GLN  70   0.059   3.693  -5.334
  573   2HG   GLN  70          HG1       GLN  70  -1.628   3.911  -5.869
  574   1HE2  GLN  70          HE21      GLN  70   0.614   5.229  -6.906
  575   2HE2  GLN  70          HE22      GLN  70   0.499   6.919  -6.533
  576    H    GLU  71           HN       GLU  71  -1.760   0.392  -4.885
  577    HA   GLU  71           HA       GLU  71  -4.647   0.838  -5.214
  578   1HB   GLU  71          HB2       GLU  71  -4.607  -0.713  -7.096
  579   2HB   GLU  71          HB1       GLU  71  -3.290   0.427  -7.305
  580   1HG   GLU  71          HG2       GLU  71  -1.691  -1.152  -6.600
  581   2HG   GLU  71          HG1       GLU  71  -2.956  -2.310  -6.192
  582    H    MET  72           HN       MET  72  -2.486  -0.787  -3.408
  583    HA   MET  72           HA       MET  72  -4.425  -2.862  -2.609
  584   1HB   MET  72          HB2       MET  72  -1.392  -2.881  -2.421
  585   2HB   MET  72          HB1       MET  72  -2.446  -4.131  -1.791
  586   1HG   MET  72          HG2       MET  72  -2.141  -3.404  -4.702
  587   2HG   MET  72          HG1       MET  72  -1.369  -4.756  -3.893
  588   1HE   MET  72          HE1       MET  72  -3.604  -5.854  -1.958
  589   2HE   MET  72          HE2       MET  72  -2.622  -6.895  -2.986
  590   3HE   MET  72          HE3       MET  72  -4.376  -7.073  -2.972
  591    H    SER  73           HN       SER  73  -3.988   0.033  -1.845
  592    HA   SER  73           HA       SER  73  -2.658  -0.096   0.656
  593   1HB   SER  73          HB2       SER  73  -3.135   2.345   0.738
  594   2HB   SER  73          HB1       SER  73  -2.227   1.803  -0.671
  595    HG   SER  73           HG       SER  73  -3.863   3.265  -1.197
  596    H    SER  74           HN       SER  74  -5.702  -0.897  -0.230
  597    HA   SER  74           HA       SER  74  -7.661  -1.249   0.764
  598   1HB   SER  74          HB2       SER  74  -6.101  -0.931   3.340
  599   2HB   SER  74          HB1       SER  74  -7.686  -1.689   3.183
  600    HG   SER  74           HG       SER  74  -6.004  -2.783   1.413
  601    H    LYS  75           HN       LYS  75  -8.689   0.516  -0.031
  602    HA   LYS  75           HA       LYS  75  -9.177   2.670   1.881
  603   1HB   LYS  75          HB2       LYS  75  -8.621   2.948  -1.081
  604   2HB   LYS  75          HB1       LYS  75  -9.312   4.230  -0.095
  605   1HG   LYS  75          HG2       LYS  75  -6.668   2.930   0.485
  606   2HG   LYS  75          HG1       LYS  75  -6.853   4.404  -0.473
  607   1HD   LYS  75          HD2       LYS  75  -7.668   5.624   1.349
  608   2HD   LYS  75          HD1       LYS  75  -8.023   4.165   2.277
  609   1HE   LYS  75          HE2       LYS  75  -5.246   5.016   1.504
  610   2HE   LYS  75          HE1       LYS  75  -6.014   5.467   3.028
  611   1HZ   LYS  75          HZ1       LYS  75  -4.665   3.490   3.342
  612   2HZ   LYS  75          HZ2       LYS  75  -5.504   2.646   2.143
  613   3HZ   LYS  75          HZ3       LYS  75  -6.286   3.123   3.533
  614    H    ALA  76           HN       ALA  76 -11.116   2.142   2.492
  615    HA   ALA  76           HA       ALA  76 -13.037   1.057   0.605
  616   1HB   ALA  76          HB1       ALA  76 -12.819   0.020   2.815
  617   2HB   ALA  76          HB2       ALA  76 -14.437   0.678   2.568
  618   3HB   ALA  76          HB3       ALA  76 -13.275   1.546   3.575
  619    H    GLY  77           HN       GLY  77 -14.162   2.409  -0.550
  620   1HA   GLY  77          HA2       GLY  77 -14.657   5.116   0.377
  621   2HA   GLY  77          HA1       GLY  77 -15.050   4.457  -1.212
  622    H    SER  78           HN       SER  78 -17.078   5.697  -0.647
  623    HA   SER  78           HA       SER  78 -18.818   4.490   1.281
  624   1HB   SER  78          HB2       SER  78 -18.823   6.939   0.634
  625   2HB   SER  78          HB1       SER  78 -19.482   6.462  -0.926
  626    HG   SER  78           HG       SER  78 -20.788   5.562   1.366
  627    H    ASP  79           HN       ASP  79 -17.980   4.097  -2.032
  628    HA   ASP  79           HA       ASP  79 -20.332   2.831  -2.917
  629   1HB   ASP  79          HB2       ASP  79 -19.113   2.091  -4.857
  630   2HB   ASP  79          HB1       ASP  79 -18.590   3.720  -4.482
  631    H    THR  80           HN       THR  80 -21.035   0.842  -2.776
  632    HA   THR  80           HA       THR  80 -19.460  -1.275  -1.652
  633    HB   THR  80           HB       THR  80 -22.002  -0.215  -0.324
  634    HG1  THR  80           HG1      THR  80 -20.171   1.181  -0.011
  635   1HG2  THR  80          HG21      THR  80 -21.415  -1.741   1.515
  636   2HG2  THR  80          HG22      THR  80 -19.992  -2.276   0.618
  637   3HG2  THR  80          HG23      THR  80 -21.608  -2.624   0.001
  638    H    GLU  81           HN       GLU  81 -20.758  -3.245  -2.045
  639    HA   GLU  81           HA       GLU  81 -22.349  -3.227  -4.339
  640   1HB   GLU  81          HB2       GLU  81 -22.338  -5.243  -2.084
  641   2HB   GLU  81          HB1       GLU  81 -23.145  -5.492  -3.627
  642   1HG   GLU  81          HG2       GLU  81 -20.957  -5.251  -4.755
  643   2HG   GLU  81          HG1       GLU  81 -20.193  -5.142  -3.170
  644    H    LEU  82           HN       LEU  82 -23.401  -3.452  -0.956
  645    HA   LEU  82           HA       LEU  82 -25.923  -2.412  -1.854
  646   1HB   LEU  82          HB2       LEU  82 -26.589  -2.699   0.671
  647   2HB   LEU  82          HB1       LEU  82 -26.565  -4.062  -0.413
  648    HG   LEU  82           HG       LEU  82 -24.343  -4.716   0.555
  649   1HD1  LEU  82          HD11      LEU  82 -24.917  -2.580   2.594
  650   2HD1  LEU  82          HD12      LEU  82 -23.596  -2.578   1.428
  651   3HD1  LEU  82          HD13      LEU  82 -23.651  -3.803   2.699
  652   1HD2  LEU  82          HD21      LEU  82 -26.643  -4.493   2.474
  653   2HD2  LEU  82          HD22      LEU  82 -25.271  -5.592   2.628
  654   3HD2  LEU  82          HD23      LEU  82 -26.388  -5.762   1.276
  655    H    ALA  83           HN       ALA  83 -25.301  -0.465  -2.498
  656    HA   ALA  83           HA       ALA  83 -24.707   1.446  -0.330
  657   1HB   ALA  83          HB1       ALA  83 -23.501   2.807  -1.956
  658   2HB   ALA  83          HB2       ALA  83 -23.849   1.623  -3.216
  659   3HB   ALA  83          HB3       ALA  83 -22.812   1.185  -1.859
  660    H    ALA  84           HN       ALA  84 -27.104   0.406  -2.201
  661    HA   ALA  84           HA       ALA  84 -28.184   3.062  -2.768
  662   1HB   ALA  84          HB1       ALA  84 -28.130   1.517  -4.670
  663   2HB   ALA  84          HB2       ALA  84 -29.789   1.874  -4.198
  664   3HB   ALA  84          HB3       ALA  84 -29.055   0.337  -3.743
  665    HA   PRO  85           HA       PRO  85 -30.703   2.150   0.840
  666   1HB   PRO  85          HB2       PRO  85 -31.809   4.826   0.502
  667   2HB   PRO  85          HB1       PRO  85 -30.767   4.228   1.796
  668   1HG   PRO  85          HG2       PRO  85 -29.941   6.051  -0.056
  669   2HG   PRO  85          HG1       PRO  85 -28.845   4.905   0.741
  670   1HD   PRO  85          HD2       PRO  85 -30.084   4.763  -1.981
  671   2HD   PRO  85          HD1       PRO  85 -28.428   4.368  -1.480
  672    H    LYS  86           HN       LYS  86 -32.154   0.747   0.045
  673    HA   LYS  86           HA       LYS  86 -34.525   1.849  -1.285
  674   1HB   LYS  86          HB2       LYS  86 -32.980   0.856  -2.992
  675   2HB   LYS  86          HB1       LYS  86 -33.112  -0.681  -2.154
  676   1HG   LYS  86          HG2       LYS  86 -35.564  -0.639  -2.587
  677   2HG   LYS  86          HG1       LYS  86 -35.318   0.821  -3.548
  678   1HD   LYS  86          HD2       LYS  86 -34.110  -1.898  -4.082
  679   2HD   LYS  86          HD1       LYS  86 -35.429  -1.151  -4.978
  680   1HE   LYS  86          HE2       LYS  86 -32.610  -0.085  -4.777
  681   2HE   LYS  86          HE1       LYS  86 -33.274  -0.967  -6.151
  682   1HZ   LYS  86          HZ1       LYS  86 -34.877   0.862  -6.462
  683   2HZ   LYS  86          HZ2       LYS  86 -33.279   1.365  -6.558
  684   3HZ   LYS  86          HZ3       LYS  86 -34.144   1.727  -5.193
  685    H    SER  87           HN       SER  87 -32.967  -0.988   0.184
  686    HA   SER  87           HA       SER  87 -35.324  -2.353   0.801
  687   1HB   SER  87          HB2       SER  87 -32.538  -2.577   1.930
  688   2HB   SER  87          HB1       SER  87 -33.829  -3.757   2.146
  689    HG   SER  87           HG       SER  87 -33.832  -4.169   0.002
  690    H    LYS  88           HN       LYS  88 -36.738  -1.419   2.040
  691    HA   LYS  88           HA       LYS  88 -35.920  -0.680   4.754
  692   1HB   LYS  88          HB2       LYS  88 -36.458   1.379   3.393
  693   2HB   LYS  88          HB1       LYS  88 -38.072   0.729   3.132
  694   1HG   LYS  88          HG2       LYS  88 -38.452   0.773   5.562
  695   2HG   LYS  88          HG1       LYS  88 -36.857   1.484   5.782
  696   1HD   LYS  88          HD2       LYS  88 -38.527   3.230   5.862
  697   2HD   LYS  88          HD1       LYS  88 -37.578   3.409   4.390
  698   1HE   LYS  88          HE2       LYS  88 -39.345   2.360   3.093
  699   2HE   LYS  88          HE1       LYS  88 -40.273   2.066   4.560
  700   1HZ   LYS  88          HZ1       LYS  88 -41.047   4.003   3.329
  701   2HZ   LYS  88          HZ2       LYS  88 -39.540   4.746   3.513
  702   3HZ   LYS  88          HZ3       LYS  88 -40.500   4.425   4.874
  703    H    ASN  89           HN       ASN  89 -38.793  -1.149   2.694
  704    HA   ASN  89           HA       ASN  89 -39.505  -3.616   3.590
  705   1HB   ASN  89          HB2       ASN  89 -41.613  -3.154   4.766
  706   2HB   ASN  89          HB1       ASN  89 -40.307  -2.416   5.677
  707   1HD2  ASN  89          HD21      ASN  89 -40.342  -0.269   6.001
  708   2HD2  ASN  89          HD22      ASN  89 -41.612   0.783   5.460
  Start of MODEL   16
    1   1H    GLY   1          HT1       GLY   1 -12.826   6.959  14.880
    2   2H    GLY   1          HT2       GLY   1 -11.886   6.020  15.935
    3   3H    GLY   1          HT3       GLY   1 -12.814   5.248  14.744
    4   1HA   GLY   1          HA1       GLY   1 -10.512   5.290  14.142
    5   2HA   GLY   1          HA2       GLY   1 -11.437   6.338  13.066
    6    H    ASP   2           HN       ASP   2  -8.902   6.871  13.108
    7    HA   ASP   2           HA       ASP   2  -8.408   9.005  15.055
    8   1HB   ASP   2          HB2       ASP   2  -6.621   7.358  14.774
    9   2HB   ASP   2          HB1       ASP   2  -6.603   7.648  13.037
   10    H    GLY   3           HN       GLY   3  -8.474   8.257  11.637
   11   1HA   GLY   3          HA2       GLY   3  -9.761  10.496  10.733
   12   2HA   GLY   3          HA1       GLY   3  -8.042  10.901  10.710
   13    H    GLU   4           HN       GLU   4  -6.715   8.917   9.968
   14    HA   GLU   4           HA       GLU   4  -7.915   7.934   7.502
   15   1HB   GLU   4          HB2       GLU   4  -5.069   8.539   8.233
   16   2HB   GLU   4          HB1       GLU   4  -5.476   7.525   6.856
   17   1HG   GLU   4          HG2       GLU   4  -6.513  10.318   7.224
   18   2HG   GLU   4          HG1       GLU   4  -5.045   9.929   6.332
   19    H    ALA   5           HN       ALA   5  -8.401   5.986   7.360
   20    HA   ALA   5           HA       ALA   5  -8.460   4.089   9.330
   21   1HB   ALA   5          HB1       ALA   5  -9.135   2.522   7.625
   22   2HB   ALA   5          HB2       ALA   5  -8.472   3.567   6.368
   23   3HB   ALA   5          HB3       ALA   5  -9.850   4.107   7.328
   24    H    GLN   6           HN       GLN   6  -5.873   4.617   7.093
   25    HA   GLN   6           HA       GLN   6  -3.986   3.100   8.558
   26   1HB   GLN   6          HB2       GLN   6  -3.432   1.508   6.643
   27   2HB   GLN   6          HB1       GLN   6  -4.917   1.142   7.509
   28   1HG   GLN   6          HG2       GLN   6  -6.162   2.313   5.747
   29   2HG   GLN   6          HG1       GLN   6  -4.662   2.495   4.843
   30   1HE2  GLN   6          HE21      GLN   6  -3.698  -0.191   5.683
   31   2HE2  GLN   6          HE22      GLN   6  -4.610  -1.267   4.685
   32    H    ARG   7           HN       ARG   7  -4.329   5.627   7.834
   33    HA   ARG   7           HA       ARG   7  -3.845   7.432   6.643
   34   1HB   ARG   7          HB2       ARG   7  -1.619   6.993   7.698
   35   2HB   ARG   7          HB1       ARG   7  -1.141   6.075   6.275
   36   1HG   ARG   7          HG2       ARG   7  -1.421   8.115   4.904
   37   2HG   ARG   7          HG1       ARG   7  -1.812   9.015   6.364
   38   1HD   ARG   7          HD2       ARG   7   0.793   7.574   5.861
   39   2HD   ARG   7          HD1       ARG   7   0.532   9.292   5.590
   40    HE   ARG   7           HE       ARG   7   0.485   7.955   8.220
   41   1HH1  ARG   7          HH11      ARG   7   0.760  10.951   6.322
   42   2HH1  ARG   7          HH12      ARG   7   1.627  11.809   7.509
   43   1HH2  ARG   7          HH21      ARG   7   1.659   9.171   9.895
   44   2HH2  ARG   7          HH22      ARG   7   2.148  10.778   9.597
   45    H    ASP   8           HN       ASP   8  -1.793   5.481   4.619
   46    HA   ASP   8           HA       ASP   8  -3.466   4.999   2.484
   47   1HB   ASP   8          HB2       ASP   8  -3.617   7.420   2.169
   48   2HB   ASP   8          HB1       ASP   8  -1.871   7.569   2.265
   49    H    LEU   9           HN       LEU   9  -2.297   3.820   0.972
   50    HA   LEU   9           HA       LEU   9   0.037   2.674   1.999
   51   1HB   LEU   9          HB2       LEU   9  -1.589   2.351  -0.447
   52   2HB   LEU   9          HB1       LEU   9   0.039   1.716  -0.475
   53    HG   LEU   9           HG       LEU   9  -1.723   0.055   0.102
   54   1HD1  LEU   9          HD11      LEU   9   0.385   0.583   2.183
   55   2HD1  LEU   9          HD12      LEU   9   0.576  -0.314   0.670
   56   3HD1  LEU   9          HD13      LEU   9  -0.467  -0.945   1.937
   57   1HD2  LEU   9          HD21      LEU   9  -1.884   1.630   2.669
   58   2HD2  LEU   9          HD22      LEU   9  -2.638   0.059   2.384
   59   3HD2  LEU   9          HD23      LEU   9  -3.170   1.476   1.471
   60    H    VAL  10           HN       VAL  10  -0.423   5.042  -0.567
   61    HA   VAL  10           HA       VAL  10   2.394   4.843  -1.115
   62    HB   VAL  10           HB       VAL  10   0.287   6.604  -2.417
   63   1HG1  VAL  10          HG11      VAL  10   2.473   7.732  -2.493
   64   2HG1  VAL  10          HG12      VAL  10   1.988   7.169  -4.092
   65   3HG1  VAL  10          HG13      VAL  10   3.199   6.275  -3.172
   66   1HG2  VAL  10          HG21      VAL  10   1.799   4.193  -3.390
   67   2HG2  VAL  10          HG22      VAL  10   0.632   5.125  -4.328
   68   3HG2  VAL  10          HG23      VAL  10   0.106   4.229  -2.905
   69    H    LYS  11           HN       LYS  11   0.205   6.970   0.587
   70    HA   LYS  11           HA       LYS  11   2.115   9.070   0.920
   71   1HB   LYS  11          HB2       LYS  11  -0.086   8.452   2.908
   72   2HB   LYS  11          HB1       LYS  11   0.812   9.936   2.689
   73   1HG   LYS  11          HG2       LYS  11  -1.279   8.816   0.823
   74   2HG   LYS  11          HG1       LYS  11  -1.485  10.164   1.925
   75   1HD   LYS  11          HD2       LYS  11  -1.157  11.271  -0.054
   76   2HD   LYS  11          HD1       LYS  11   0.508  11.165   0.510
   77   1HE   LYS  11          HE2       LYS  11   0.319  10.571  -1.856
   78   2HE   LYS  11          HE1       LYS  11   0.873   9.204  -0.890
   79   1HZ   LYS  11          HZ1       LYS  11  -0.879   8.630  -2.564
   80   2HZ   LYS  11          HZ2       LYS  11  -1.976   9.570  -1.704
   81   3HZ   LYS  11          HZ3       LYS  11  -1.287   8.222  -0.992
   82    H    ALA  12           HN       ALA  12   1.705   5.998   2.390
   83    HA   ALA  12           HA       ALA  12   3.529   6.698   4.554
   84   1HB   ALA  12          HB1       ALA  12   1.490   5.500   5.156
   85   2HB   ALA  12          HB2       ALA  12   2.934   4.555   5.536
   86   3HB   ALA  12          HB3       ALA  12   1.968   4.163   4.111
   87    H    VAL  13           HN       VAL  13   3.227   3.987   2.175
   88    HA   VAL  13           HA       VAL  13   5.775   2.946   2.732
   89    HB   VAL  13           HB       VAL  13   4.085   2.568   0.242
   90   1HG1  VAL  13          HG11      VAL  13   6.439   2.101  -0.271
   91   2HG1  VAL  13          HG12      VAL  13   5.500   0.610  -0.243
   92   3HG1  VAL  13          HG13      VAL  13   6.542   1.026   1.123
   93   1HG2  VAL  13          HG21      VAL  13   4.519   0.824   2.663
   94   2HG2  VAL  13          HG22      VAL  13   3.558   0.391   1.248
   95   3HG2  VAL  13          HG23      VAL  13   3.056   1.729   2.280
   96    H    ALA  14           HN       ALA  14   4.746   5.032   0.042
   97    HA   ALA  14           HA       ALA  14   7.324   5.122  -1.098
   98   1HB   ALA  14          HB1       ALA  14   5.297   5.743  -2.398
   99   2HB   ALA  14          HB2       ALA  14   6.502   7.029  -2.452
  100   3HB   ALA  14          HB3       ALA  14   5.095   7.167  -1.387
  101    H    HIS  15           HN       HIS  15   5.802   6.868   1.453
  102    HA   HIS  15           HA       HIS  15   7.644   9.016   1.648
  103   1HB   HIS  15          HB2       HIS  15   5.387   9.062   2.667
  104   2HB   HIS  15          HB1       HIS  15   5.888   7.822   3.805
  105    HD1  HIS  15           HD1      HIS  15   6.321  11.462   3.018
  106    HD2  HIS  15           HD2      HIS  15   7.377   8.748   5.975
  107    HE1  HIS  15           HE1      HIS  15   7.201  12.837   4.913
  108    HE2  HIS  15           HE2      HIS  15   7.483  11.188   6.777
  109    H    ILE  16           HN       ILE  16   7.614   5.755   2.851
  110    HA   ILE  16           HA       ILE  16   9.726   5.956   4.715
  111    HB   ILE  16           HB       ILE  16   8.774   3.590   3.077
  112   1HG1  ILE  16          HG12      ILE  16   7.052   4.387   4.573
  113   2HG1  ILE  16          HG11      ILE  16   7.680   2.862   5.185
  114   1HG2  ILE  16          HG21      ILE  16   9.943   2.134   4.673
  115   2HG2  ILE  16          HG22      ILE  16  10.686   3.563   5.398
  116   3HG2  ILE  16          HG23      ILE  16  11.026   3.142   3.715
  117   1HD1  ILE  16          HD11      ILE  16   9.020   4.090   6.831
  118   2HD1  ILE  16          HD12      ILE  16   7.296   4.435   6.993
  119   3HD1  ILE  16          HD13      ILE  16   8.363   5.608   6.216
  120    H    LEU  17           HN       LEU  17   9.639   5.127   1.253
  121    HA   LEU  17           HA       LEU  17  12.402   4.820   0.927
  122   1HB   LEU  17          HB2       LEU  17  10.106   5.407  -0.926
  123   2HB   LEU  17          HB1       LEU  17  11.747   5.278  -1.502
  124    HG   LEU  17           HG       LEU  17  10.398   3.303  -1.891
  125   1HD1  LEU  17          HD11      LEU  17  12.701   2.856   0.011
  126   2HD1  LEU  17          HD12      LEU  17  12.809   3.063  -1.737
  127   3HD1  LEU  17          HD13      LEU  17  12.032   1.628  -1.064
  128   1HD2  LEU  17          HD21      LEU  17   9.852   1.730  -0.075
  129   2HD2  LEU  17          HD22      LEU  17   8.968   3.252   0.041
  130   3HD2  LEU  17          HD23      LEU  17  10.349   2.952   1.096
  131    H    GLY  18           HN       GLY  18  10.193   7.505   0.455
  132   1HA   GLY  18          HA2       GLY  18  11.092   9.740   1.157
  133   2HA   GLY  18          HA1       GLY  18  12.523   9.319   0.217
  134    H    ILE  19           HN       ILE  19   9.241   8.607  -0.739
  135    HA   ILE  19           HA       ILE  19   9.288  10.656  -2.795
  136    HB   ILE  19           HB       ILE  19   8.186   8.758  -4.198
  137   1HG1  ILE  19          HG12      ILE  19  10.117   7.174  -2.492
  138   2HG1  ILE  19          HG11      ILE  19   8.369   7.002  -2.537
  139   1HG2  ILE  19          HG21      ILE  19  11.179   9.100  -3.945
  140   2HG2  ILE  19          HG22      ILE  19  10.082  10.068  -4.948
  141   3HG2  ILE  19          HG23      ILE  19  10.360   8.382  -5.332
  142   1HD1  ILE  19          HD11      ILE  19   9.482   5.222  -3.757
  143   2HD1  ILE  19          HD12      ILE  19  10.261   6.412  -4.800
  144   3HD1  ILE  19          HD13      ILE  19   8.508   6.217  -4.839
  145    H    ARG  20           HN       ARG  20   7.196  10.777  -3.836
  146    HA   ARG  20           HA       ARG  20   4.935   9.370  -2.811
  147   1HB   ARG  20          HB2       ARG  20   5.337  11.237  -1.091
  148   2HB   ARG  20          HB1       ARG  20   5.001  12.349  -2.411
  149   1HG   ARG  20          HG2       ARG  20   3.013  10.260  -1.593
  150   2HG   ARG  20          HG1       ARG  20   3.088  11.813  -0.756
  151   1HD   ARG  20          HD2       ARG  20   2.568  11.358  -3.701
  152   2HD   ARG  20          HD1       ARG  20   1.356  11.772  -2.491
  153    HE   ARG  20           HE       ARG  20   3.319  13.716  -2.392
  154   1HH1  ARG  20          HH11      ARG  20   0.842  12.605  -4.704
  155   2HH1  ARG  20          HH12      ARG  20   0.724  14.175  -5.408
  156   1HH2  ARG  20          HH21      ARG  20   3.134  15.757  -3.498
  157   2HH2  ARG  20          HH22      ARG  20   1.985  15.914  -4.762
  158    H    ASP  21           HN       ASP  21   6.228  12.136  -4.525
  159    HA   ASP  21           HA       ASP  21   4.123  12.437  -6.393
  160   1HB   ASP  21          HB2       ASP  21   7.054  13.185  -6.659
  161   2HB   ASP  21          HB1       ASP  21   5.755  13.771  -7.683
  162    H    LEU  22           HN       LEU  22   7.158  10.697  -6.389
  163    HA   LEU  22           HA       LEU  22   7.907   8.905  -7.507
  164   1HB   LEU  22          HB2       LEU  22   5.010   8.742  -8.193
  165   2HB   LEU  22          HB1       LEU  22   6.125   7.811  -9.171
  166    HG   LEU  22           HG       LEU  22   5.072   6.529  -7.382
  167   1HD1  LEU  22          HD11      LEU  22   8.058   6.926  -7.106
  168   2HD1  LEU  22          HD12      LEU  22   7.264   5.927  -8.301
  169   3HD1  LEU  22          HD13      LEU  22   7.180   5.480  -6.589
  170   1HD2  LEU  22          HD21      LEU  22   4.898   8.245  -5.639
  171   2HD2  LEU  22          HD22      LEU  22   6.645   8.321  -5.513
  172   3HD2  LEU  22          HD23      LEU  22   5.792   6.852  -5.037
  173    H    ALA  23           HN       ALA  23   7.875  11.592  -8.360
  174    HA   ALA  23           HA       ALA  23   7.550  11.749 -11.169
  175   1HB   ALA  23          HB1       ALA  23   7.223  13.678  -9.706
  176   2HB   ALA  23          HB2       ALA  23   8.445  13.996 -10.940
  177   3HB   ALA  23          HB3       ALA  23   8.936  13.645  -9.283
  178    H    GLY  24           HN       GLY  24   8.756  10.118 -11.895
  179   1HA   GLY  24          HA2       GLY  24  10.542   9.558 -13.220
  180   2HA   GLY  24          HA1       GLY  24  11.550  10.802 -12.440
  181    H    ILE  25           HN       ILE  25   9.608   8.504 -10.780
  182    HA   ILE  25           HA       ILE  25  12.009   7.034  -9.940
  183    HB   ILE  25           HB       ILE  25   9.282   7.147  -8.599
  184   1HG1  ILE  25          HG12      ILE  25  10.433   9.355  -8.517
  185   2HG1  ILE  25          HG11      ILE  25  10.206   8.630  -6.933
  186   1HG2  ILE  25          HG21      ILE  25  11.927   6.064  -7.621
  187   2HG2  ILE  25          HG22      ILE  25  10.532   5.108  -8.124
  188   3HG2  ILE  25          HG23      ILE  25  10.432   6.120  -6.685
  189   1HD1  ILE  25          HD11      ILE  25  12.526   7.936  -6.920
  190   2HD1  ILE  25          HD12      ILE  25  12.362   9.679  -7.105
  191   3HD1  ILE  25          HD13      ILE  25  12.776   8.673  -8.508
  192    H    ASN  26           HN       ASN  26  11.997   4.876 -10.420
  193    HA   ASN  26           HA       ASN  26  10.301   3.968 -12.473
  194   1HB   ASN  26          HB2       ASN  26  12.583   3.102 -12.174
  195   2HB   ASN  26          HB1       ASN  26  12.091   2.332 -10.667
  196   1HD2  ASN  26          HD21      ASN  26  12.562   0.267 -11.406
  197   2HD2  ASN  26          HD22      ASN  26  11.592  -0.527 -12.600
  198    H    LEU  27           HN       LEU  27   8.386   3.194 -12.432
  199    HA   LEU  27           HA       LEU  27   6.993   2.580  -9.917
  200   1HB   LEU  27          HB2       LEU  27   5.950   2.630 -12.745
  201   2HB   LEU  27          HB1       LEU  27   4.997   2.578 -11.280
  202    HG   LEU  27           HG       LEU  27   6.706   4.895 -12.187
  203   1HD1  LEU  27          HD11      LEU  27   4.581   6.035 -12.536
  204   2HD1  LEU  27          HD12      LEU  27   3.714   4.556 -12.118
  205   3HD1  LEU  27          HD13      LEU  27   4.728   4.611 -13.561
  206   1HD2  LEU  27          HD21      LEU  27   6.595   4.734  -9.757
  207   2HD2  LEU  27          HD22      LEU  27   4.835   4.648  -9.838
  208   3HD2  LEU  27          HD23      LEU  27   5.670   6.113 -10.345
  209    H    ASP  28           HN       ASP  28   8.837   0.766 -11.962
  210    HA   ASP  28           HA       ASP  28   7.219  -1.550 -11.209
  211   1HB   ASP  28          HB2       ASP  28   8.225  -2.904 -12.993
  212   2HB   ASP  28          HB1       ASP  28   7.459  -1.479 -13.658
  213    H    SER  29           HN       SER  29   9.322   0.020  -9.746
  214    HA   SER  29           HA       SER  29  11.402  -1.864  -9.325
  215   1HB   SER  29          HB2       SER  29  10.519   0.501  -7.660
  216   2HB   SER  29          HB1       SER  29  12.004  -0.413  -7.442
  217    HG   SER  29           HG       SER  29  12.749   0.263  -9.346
  218    H    SER  30           HN       SER  30  10.629  -3.769  -8.702
  219    HA   SER  30           HA       SER  30   8.620  -4.327  -6.866
  220   1HB   SER  30          HB2       SER  30  11.187  -5.858  -7.272
  221   2HB   SER  30          HB1       SER  30   9.591  -6.506  -6.888
  222    HG   SER  30           HG       SER  30   8.893  -5.980  -8.947
  223    H    LEU  31           HN       LEU  31   8.782  -4.514  -4.562
  224    HA   LEU  31           HA       LEU  31  10.658  -2.862  -3.297
  225   1HB   LEU  31          HB2       LEU  31   9.008  -5.054  -1.998
  226   2HB   LEU  31          HB1       LEU  31   9.806  -3.736  -1.168
  227    HG   LEU  31           HG       LEU  31   7.458  -3.508  -3.042
  228   1HD1  LEU  31          HD11      LEU  31   7.706  -3.038  -0.086
  229   2HD1  LEU  31          HD12      LEU  31   6.873  -4.382  -0.873
  230   3HD1  LEU  31          HD13      LEU  31   6.271  -2.736  -1.063
  231   1HD2  LEU  31          HD21      LEU  31   8.920  -1.598  -3.290
  232   2HD2  LEU  31          HD22      LEU  31   8.927  -1.365  -1.539
  233   3HD2  LEU  31          HD23      LEU  31   7.427  -1.151  -2.458
  234    H    ALA  32           HN       ALA  32  10.902  -6.115  -4.276
  235    HA   ALA  32           HA       ALA  32  13.074  -6.873  -2.571
  236   1HB   ALA  32          HB1       ALA  32  11.762  -8.583  -3.540
  237   2HB   ALA  32          HB2       ALA  32  13.390  -8.729  -4.205
  238   3HB   ALA  32          HB3       ALA  32  12.093  -8.017  -5.174
  239    H    ASP  33           HN       ASP  33  12.780  -4.986  -5.385
  240    HA   ASP  33           HA       ASP  33  15.472  -5.392  -6.334
  241   1HB   ASP  33          HB2       ASP  33  13.565  -4.706  -7.872
  242   2HB   ASP  33          HB1       ASP  33  13.515  -3.182  -7.019
  243    H    LEU  34           HN       LEU  34  13.712  -3.504  -4.195
  244    HA   LEU  34           HA       LEU  34  15.666  -1.426  -3.757
  245   1HB   LEU  34          HB2       LEU  34  13.317  -2.150  -2.024
  246   2HB   LEU  34          HB1       LEU  34  14.095  -0.588  -2.191
  247    HG   LEU  34           HG       LEU  34  12.434  -1.943  -4.311
  248   1HD1  LEU  34          HD11      LEU  34  11.765   0.357  -2.510
  249   2HD1  LEU  34          HD12      LEU  34  11.093  -1.287  -2.486
  250   3HD1  LEU  34          HD13      LEU  34  10.801  -0.237  -3.876
  251   1HD2  LEU  34          HD21      LEU  34  12.492   0.160  -5.451
  252   2HD2  LEU  34          HD22      LEU  34  14.118  -0.518  -5.280
  253   3HD2  LEU  34          HD23      LEU  34  13.596   0.828  -4.240
  254    H    GLY  35           HN       GLY  35  14.305  -4.215  -2.013
  255   1HA   GLY  35          HA2       GLY  35  15.657  -5.779  -0.838
  256   2HA   GLY  35          HA1       GLY  35  16.860  -4.514  -0.612
  257    H    LEU  36           HN       LEU  36  13.863  -5.829   0.486
  258    HA   LEU  36           HA       LEU  36  13.864  -3.865   2.628
  259   1HB   LEU  36          HB2       LEU  36  11.552  -4.432   3.065
  260   2HB   LEU  36          HB1       LEU  36  11.755  -4.047   1.379
  261    HG   LEU  36           HG       LEU  36  11.881  -6.720   1.208
  262   1HD1  LEU  36          HD11      LEU  36  11.667  -7.102   3.581
  263   2HD1  LEU  36          HD12      LEU  36  10.240  -7.714   2.732
  264   3HD1  LEU  36          HD13      LEU  36  10.169  -6.177   3.603
  265   1HD2  LEU  36          HD21      LEU  36   9.354  -5.098   1.428
  266   2HD2  LEU  36          HD22      LEU  36   9.494  -6.689   0.677
  267   3HD2  LEU  36          HD23      LEU  36  10.348  -5.311  -0.015
  268    H    ASP  37           HN       ASP  37  14.828  -4.359   4.371
  269    HA   ASP  37           HA       ASP  37  14.388  -6.879   5.730
  270   1HB   ASP  37          HB2       ASP  37  16.694  -7.576   5.848
  271   2HB   ASP  37          HB1       ASP  37  16.289  -7.377   4.150
  272    H    SER  38           HN       SER  38  14.059  -3.961   5.990
  273    HA   SER  38           HA       SER  38  15.573  -3.557   8.441
  274   1HB   SER  38          HB2       SER  38  15.732  -1.128   7.647
  275   2HB   SER  38          HB1       SER  38  16.774  -2.313   6.848
  276    HG   SER  38           HG       SER  38  15.818  -1.852   5.056
  277    H    LEU  39           HN       LEU  39  13.285  -1.568   6.642
  278    HA   LEU  39           HA       LEU  39  11.544  -1.485   9.030
  279   1HB   LEU  39          HB2       LEU  39  12.830   0.556   8.554
  280   2HB   LEU  39          HB1       LEU  39  12.058   0.662   6.990
  281    HG   LEU  39           HG       LEU  39   9.856   0.793   8.250
  282   1HD1  LEU  39          HD11      LEU  39   9.973   1.643  10.535
  283   2HD1  LEU  39          HD12      LEU  39  11.719   1.387  10.532
  284   3HD1  LEU  39          HD13      LEU  39  10.624   0.010  10.397
  285   1HD2  LEU  39          HD21      LEU  39  10.117   3.201   8.635
  286   2HD2  LEU  39          HD22      LEU  39  10.838   2.666   7.114
  287   3HD2  LEU  39          HD23      LEU  39  11.872   3.017   8.502
  288    H    MET  40           HN       MET  40  11.636  -1.026   5.514
  289    HA   MET  40           HA       MET  40   9.027  -0.784   4.821
  290   1HB   MET  40          HB2       MET  40  11.152  -2.304   3.339
  291   2HB   MET  40          HB1       MET  40   9.545  -2.008   2.693
  292   1HG   MET  40          HG2       MET  40   9.891   0.368   2.888
  293   2HG   MET  40          HG1       MET  40  11.512   0.105   3.523
  294   1HE   MET  40          HE1       MET  40  12.523  -2.336   1.658
  295   2HE   MET  40          HE2       MET  40  13.522  -0.929   2.019
  296   3HE   MET  40          HE3       MET  40  13.309  -1.451   0.350
  297    H    GLY  41           HN       GLY  41  10.460  -4.003   5.380
  298   1HA   GLY  41          HA2       GLY  41   8.126  -5.392   4.519
  299   2HA   GLY  41          HA1       GLY  41   9.421  -6.059   5.503
  300    H    VAL  42           HN       VAL  42   9.001  -3.888   7.456
  301    HA   VAL  42           HA       VAL  42   6.982  -5.239   9.054
  302    HB   VAL  42           HB       VAL  42   8.712  -2.870   9.756
  303   1HG1  VAL  42          HG11      VAL  42   7.229  -4.795  11.520
  304   2HG1  VAL  42          HG12      VAL  42   6.860  -3.095  11.201
  305   3HG1  VAL  42          HG13      VAL  42   8.330  -3.523  12.072
  306   1HG2  VAL  42          HG21      VAL  42   9.355  -5.797  10.150
  307   2HG2  VAL  42          HG22      VAL  42  10.233  -4.459  10.893
  308   3HG2  VAL  42          HG23      VAL  42  10.224  -4.629   9.144
  309    H    GLU  43           HN       GLU  43   7.694  -2.068   7.722
  310    HA   GLU  43           HA       GLU  43   5.462  -0.819   8.873
  311   1HB   GLU  43          HB2       GLU  43   7.576   0.249   7.924
  312   2HB   GLU  43          HB1       GLU  43   6.795   0.105   6.355
  313   1HG   GLU  43          HG2       GLU  43   6.537   2.289   7.376
  314   2HG   GLU  43          HG1       GLU  43   4.967   1.511   7.079
  315    H    VAL  44           HN       VAL  44   5.905  -2.530   5.834
  316    HA   VAL  44           HA       VAL  44   3.448  -1.858   4.598
  317    HB   VAL  44           HB       VAL  44   4.980  -4.496   4.478
  318   1HG1  VAL  44          HG11      VAL  44   3.749  -4.958   2.436
  319   2HG1  VAL  44          HG12      VAL  44   2.787  -3.492   2.677
  320   3HG1  VAL  44          HG13      VAL  44   2.667  -4.835   3.827
  321   1HG2  VAL  44          HG21      VAL  44   6.241  -2.609   3.641
  322   2HG2  VAL  44          HG22      VAL  44   4.914  -2.189   2.543
  323   3HG2  VAL  44          HG23      VAL  44   5.788  -3.718   2.352
  324    H    ARG  45           HN       ARG  45   4.346  -4.307   6.891
  325    HA   ARG  45           HA       ARG  45   1.796  -5.478   7.127
  326   1HB   ARG  45          HB2       ARG  45   4.247  -5.565   8.853
  327   2HB   ARG  45          HB1       ARG  45   2.815  -6.487   9.249
  328   1HG   ARG  45          HG2       ARG  45   3.010  -7.635   7.055
  329   2HG   ARG  45          HG1       ARG  45   4.505  -6.739   6.762
  330   1HD   ARG  45          HD2       ARG  45   5.507  -7.722   8.720
  331   2HD   ARG  45          HD1       ARG  45   4.004  -8.553   9.107
  332    HE   ARG  45           HE       ARG  45   5.640  -9.079   6.736
  333   1HH1  ARG  45          HH11      ARG  45   3.377 -10.189   9.252
  334   2HH1  ARG  45          HH12      ARG  45   3.648 -11.851   9.009
  335   1HH2  ARG  45          HH21      ARG  45   6.062 -11.530   6.431
  336   2HH2  ARG  45          HH22      ARG  45   5.171 -12.606   7.372
  337    H    GLN  46           HN       GLN  46   3.284  -2.720   8.665
  338    HA   GLN  46           HA       GLN  46   1.221  -2.686  10.653
  339   1HB   GLN  46          HB2       GLN  46   3.345  -0.648  10.031
  340   2HB   GLN  46          HB1       GLN  46   2.208  -0.523  11.372
  341   1HG   GLN  46          HG2       GLN  46   3.033  -2.653  12.250
  342   2HG   GLN  46          HG1       GLN  46   4.207  -2.722  10.943
  343   1HE2  GLN  46          HE21      GLN  46   4.713   0.197  11.071
  344   2HE2  GLN  46          HE22      GLN  46   5.662   0.367  12.499
  345    H    ILE  47           HN       ILE  47   1.428  -1.633   7.510
  346    HA   ILE  47           HA       ILE  47  -0.750   0.253   7.847
  347    HB   ILE  47           HB       ILE  47   0.469  -0.801   5.266
  348   1HG1  ILE  47          HG12      ILE  47   0.963   1.826   6.666
  349   2HG1  ILE  47          HG11      ILE  47   2.065   0.453   6.722
  350   1HG2  ILE  47          HG21      ILE  47  -1.799   0.081   4.990
  351   2HG2  ILE  47          HG22      ILE  47  -0.612   1.147   4.241
  352   3HG2  ILE  47          HG23      ILE  47  -1.321   1.575   5.796
  353   1HD1  ILE  47          HD11      ILE  47   2.790   2.111   5.110
  354   2HD1  ILE  47          HD12      ILE  47   1.252   1.977   4.260
  355   3HD1  ILE  47          HD13      ILE  47   2.357   0.606   4.301
  356    H    LEU  48           HN       LEU  48  -0.166  -2.820   6.184
  357    HA   LEU  48           HA       LEU  48  -2.965  -3.184   5.681
  358   1HB   LEU  48          HB2       LEU  48  -0.564  -4.887   5.104
  359   2HB   LEU  48          HB1       LEU  48  -2.175  -5.466   4.790
  360    HG   LEU  48           HG       LEU  48  -1.355  -4.747   2.742
  361   1HD1  LEU  48          HD11      LEU  48  -2.733  -2.854   2.083
  362   2HD1  LEU  48          HD12      LEU  48  -3.049  -2.513   3.786
  363   3HD1  LEU  48          HD13      LEU  48  -3.604  -4.028   3.071
  364   1HD2  LEU  48          HD21      LEU  48   0.587  -3.496   3.487
  365   2HD2  LEU  48          HD22      LEU  48  -0.455  -2.178   4.028
  366   3HD2  LEU  48          HD23      LEU  48  -0.341  -2.562   2.311
  367    H    GLU  49           HN       GLU  49  -0.620  -5.182   7.455
  368    HA   GLU  49           HA       GLU  49  -2.509  -6.936   8.563
  369   1HB   GLU  49          HB2       GLU  49  -0.219  -7.641   8.374
  370   2HB   GLU  49          HB1       GLU  49   0.345  -6.284   9.329
  371   1HG   GLU  49          HG2       GLU  49  -0.846  -7.290  11.290
  372   2HG   GLU  49          HG1       GLU  49  -1.172  -8.698  10.283
  373    H    ARG  50           HN       ARG  50  -0.940  -4.100   9.934
  374    HA   ARG  50           HA       ARG  50  -1.995  -4.453  12.518
  375   1HB   ARG  50          HB2       ARG  50  -0.014  -3.028  11.850
  376   2HB   ARG  50          HB1       ARG  50  -1.173  -1.788  11.400
  377   1HG   ARG  50          HG2       ARG  50  -0.271  -1.381  13.629
  378   2HG   ARG  50          HG1       ARG  50  -2.000  -1.738  13.722
  379   1HD   ARG  50          HD2       ARG  50  -0.656  -2.904  15.461
  380   2HD   ARG  50          HD1       ARG  50  -1.541  -4.016  14.418
  381    HE   ARG  50           HE       ARG  50   1.328  -3.419  14.287
  382   1HH1  ARG  50          HH11      ARG  50  -1.374  -5.690  13.794
  383   2HH1  ARG  50          HH12      ARG  50  -0.443  -6.899  13.066
  384   1HH2  ARG  50          HH21      ARG  50   2.621  -5.114  13.216
  385   2HH2  ARG  50          HH22      ARG  50   1.835  -6.513  12.599
  386    H    GLU  51           HN       GLU  51  -3.101  -2.327   9.905
  387    HA   GLU  51           HA       GLU  51  -5.268  -1.442  11.587
  388   1HB   GLU  51          HB2       GLU  51  -4.459  -0.650   8.806
  389   2HB   GLU  51          HB1       GLU  51  -5.864   0.001   9.639
  390   1HG   GLU  51          HG2       GLU  51  -3.006   0.229  10.563
  391   2HG   GLU  51          HG1       GLU  51  -3.948   1.497   9.776
  392    H    HIS  52           HN       HIS  52  -4.943  -3.450   8.668
  393    HA   HIS  52           HA       HIS  52  -7.850  -3.856   8.850
  394   1HB   HIS  52          HB2       HIS  52  -6.161  -3.448   6.404
  395   2HB   HIS  52          HB1       HIS  52  -7.673  -4.336   6.295
  396    HD1  HIS  52           HD1      HIS  52  -9.251  -2.779   5.214
  397    HD2  HIS  52           HD2      HIS  52  -7.014  -0.884   8.140
  398    HE1  HIS  52           HE1      HIS  52 -10.199  -0.462   5.392
  399    HE2  HIS  52           HE2      HIS  52  -9.158   0.334   7.539
  400    H    ASP  53           HN       ASP  53  -5.190  -5.443   9.573
  401    HA   ASP  53           HA       ASP  53  -4.641  -7.569   9.959
  402   1HB   ASP  53          HB2       ASP  53  -6.967  -7.733  10.847
  403   2HB   ASP  53          HB1       ASP  53  -7.524  -8.234   9.258
  404    H    LEU  54           HN       LEU  54  -4.579  -6.447   7.166
  405    HA   LEU  54           HA       LEU  54  -4.570  -8.907   5.636
  406   1HB   LEU  54          HB2       LEU  54  -4.047  -6.064   4.875
  407   2HB   LEU  54          HB1       LEU  54  -3.412  -7.333   3.847
  408    HG   LEU  54           HG       LEU  54  -5.779  -8.147   3.604
  409   1HD1  LEU  54          HD11      LEU  54  -6.419  -5.509   4.902
  410   2HD1  LEU  54          HD12      LEU  54  -6.755  -7.109   5.562
  411   3HD1  LEU  54          HD13      LEU  54  -7.576  -6.570   4.095
  412   1HD2  LEU  54          HD21      LEU  54  -6.377  -6.425   1.978
  413   2HD2  LEU  54          HD22      LEU  54  -4.671  -6.866   1.878
  414   3HD2  LEU  54          HD23      LEU  54  -5.149  -5.360   2.662
  415    H    VAL  55           HN       VAL  55  -3.139 -10.112   6.700
  416    HA   VAL  55           HA       VAL  55  -0.444  -9.240   7.109
  417    HB   VAL  55           HB       VAL  55  -1.469 -12.087   7.132
  418   1HG1  VAL  55          HG11      VAL  55   0.949 -11.906   7.031
  419   2HG1  VAL  55          HG12      VAL  55   0.445 -12.506   8.608
  420   3HG1  VAL  55          HG13      VAL  55   0.945 -10.823   8.424
  421   1HG2  VAL  55          HG21      VAL  55  -1.720 -11.837   9.564
  422   2HG2  VAL  55          HG22      VAL  55  -2.795 -10.756   8.676
  423   3HG2  VAL  55          HG23      VAL  55  -1.326 -10.125   9.418
  424    H    LEU  56           HN       LEU  56   0.316  -8.605   5.178
  425    HA   LEU  56           HA       LEU  56   0.464 -10.572   3.046
  426   1HB   LEU  56          HB2       LEU  56   1.437  -7.713   3.105
  427   2HB   LEU  56          HB1       LEU  56   1.387  -8.753   1.702
  428    HG   LEU  56           HG       LEU  56  -0.997  -7.643   3.181
  429   1HD1  LEU  56          HD11      LEU  56  -1.396  -6.415   1.103
  430   2HD1  LEU  56          HD12      LEU  56   0.106  -7.065   0.442
  431   3HD1  LEU  56          HD13      LEU  56   0.149  -5.991   1.840
  432   1HD2  LEU  56          HD21      LEU  56  -1.469  -9.893   2.322
  433   2HD2  LEU  56          HD22      LEU  56  -0.922  -9.399   0.719
  434   3HD2  LEU  56          HD23      LEU  56  -2.360  -8.663   1.429
  435    HA   PRO  57           HA       PRO  57   4.450 -11.514   4.878
  436   1HB   PRO  57          HB2       PRO  57   4.429 -13.665   2.873
  437   2HB   PRO  57          HB1       PRO  57   4.493 -13.790   4.636
  438   1HG   PRO  57          HG2       PRO  57   2.294 -14.505   3.288
  439   2HG   PRO  57          HG1       PRO  57   2.182 -13.671   4.856
  440   1HD   PRO  57          HD2       PRO  57   1.950 -12.525   2.096
  441   2HD   PRO  57          HD1       PRO  57   0.883 -12.291   3.505
  442    H    ILE  58           HN       ILE  58   6.634 -11.757   3.957
  443    HA   ILE  58           HA       ILE  58   7.073  -9.632   2.209
  444    HB   ILE  58           HB       ILE  58   8.913 -11.655   3.440
  445   1HG1  ILE  58          HG12      ILE  58   9.941  -9.547   4.396
  446   2HG1  ILE  58          HG11      ILE  58   8.668  -8.679   3.544
  447   1HG2  ILE  58          HG21      ILE  58   9.824  -9.596   1.440
  448   2HG2  ILE  58          HG22      ILE  58   9.794 -11.327   1.193
  449   3HG2  ILE  58          HG23      ILE  58  10.879 -10.636   2.410
  450   1HD1  ILE  58          HD11      ILE  58   8.219 -10.676   5.748
  451   2HD1  ILE  58          HD12      ILE  58   6.984  -9.717   4.930
  452   3HD1  ILE  58          HD13      ILE  58   8.196  -8.922   5.935
  453    H    ARG  59           HN       ARG  59   7.245 -13.063   1.551
  454    HA   ARG  59           HA       ARG  59   8.056 -12.963  -1.085
  455   1HB   ARG  59          HB2       ARG  59   6.886 -15.099  -1.515
  456   2HB   ARG  59          HB1       ARG  59   7.775 -15.133  -0.004
  457   1HG   ARG  59          HG2       ARG  59   4.875 -14.443   0.026
  458   2HG   ARG  59          HG1       ARG  59   5.356 -16.122  -0.188
  459   1HD   ARG  59          HD2       ARG  59   6.435 -14.449   2.064
  460   2HD   ARG  59          HD1       ARG  59   4.879 -15.254   2.196
  461    HE   ARG  59           HE       ARG  59   6.565 -17.240   1.399
  462   1HH1  ARG  59          HH11      ARG  59   6.959 -14.897   3.986
  463   2HH1  ARG  59          HH12      ARG  59   7.505 -15.984   5.152
  464   1HH2  ARG  59          HH21      ARG  59   7.312 -18.831   2.976
  465   2HH2  ARG  59          HH22      ARG  59   7.716 -18.305   4.541
  466    H    GLU  60           HN       GLU  60   5.039 -11.823   0.137
  467    HA   GLU  60           HA       GLU  60   3.833 -11.631  -2.545
  468   1HB   GLU  60          HB2       GLU  60   2.730 -10.730   0.126
  469   2HB   GLU  60          HB1       GLU  60   1.846 -10.894  -1.382
  470   1HG   GLU  60          HG2       GLU  60   3.031 -13.129   0.234
  471   2HG   GLU  60          HG1       GLU  60   1.327 -12.692   0.150
  472    H    VAL  61           HN       VAL  61   5.042  -9.755   0.121
  473    HA   VAL  61           HA       VAL  61   4.388  -7.170  -0.769
  474    HB   VAL  61           HB       VAL  61   6.526  -8.113   1.170
  475   1HG1  VAL  61          HG11      VAL  61   5.430  -5.334   0.783
  476   2HG1  VAL  61          HG12      VAL  61   7.066  -5.868   0.395
  477   3HG1  VAL  61          HG13      VAL  61   6.516  -5.848   2.073
  478   1HG2  VAL  61          HG21      VAL  61   4.922  -7.446   2.883
  479   2HG2  VAL  61          HG22      VAL  61   4.286  -8.711   1.831
  480   3HG2  VAL  61          HG23      VAL  61   3.753  -7.043   1.625
  481    H    ARG  62           HN       ARG  62   7.167  -9.193  -1.357
  482    HA   ARG  62           HA       ARG  62   8.880  -7.200  -2.272
  483   1HB   ARG  62          HB2       ARG  62   8.866 -10.133  -2.604
  484   2HB   ARG  62          HB1       ARG  62  10.061  -9.194  -3.462
  485   1HG   ARG  62          HG2       ARG  62  10.609  -8.176  -1.173
  486   2HG   ARG  62          HG1       ARG  62   9.609  -9.454  -0.494
  487   1HD   ARG  62          HD2       ARG  62  12.121  -9.852  -2.148
  488   2HD   ARG  62          HD1       ARG  62  11.964 -10.073  -0.415
  489    HE   ARG  62           HE       ARG  62  10.204 -11.729  -1.996
  490   1HH1  ARG  62          HH11      ARG  62  13.447 -11.469  -0.540
  491   2HH1  ARG  62          HH12      ARG  62  13.718 -13.151  -0.537
  492   1HH2  ARG  62          HH21      ARG  62  10.664 -14.100  -2.007
  493   2HH2  ARG  62          HH22      ARG  62  12.130 -14.633  -1.346
  494    H    GLN  63           HN       GLN  63   6.205  -8.459  -3.971
  495    HA   GLN  63           HA       GLN  63   7.353  -7.819  -6.609
  496   1HB   GLN  63          HB2       GLN  63   4.598  -8.803  -5.887
  497   2HB   GLN  63          HB1       GLN  63   5.107  -8.446  -7.513
  498   1HG   GLN  63          HG2       GLN  63   5.079 -10.787  -7.199
  499   2HG   GLN  63          HG1       GLN  63   6.761 -10.276  -7.308
  500   1HE2  GLN  63          HE21      GLN  63   4.237 -10.914  -5.065
  501   2HE2  GLN  63          HE22      GLN  63   5.267 -11.637  -3.843
  502    H    LEU  64           HN       LEU  64   5.932  -6.237  -4.130
  503    HA   LEU  64           HA       LEU  64   4.057  -4.798  -5.571
  504   1HB   LEU  64          HB2       LEU  64   5.337  -4.114  -2.923
  505   2HB   LEU  64          HB1       LEU  64   3.952  -3.273  -3.586
  506    HG   LEU  64           HG       LEU  64   4.032  -6.187  -2.825
  507   1HD1  LEU  64          HD11      LEU  64   2.525  -5.542  -1.008
  508   2HD1  LEU  64          HD12      LEU  64   2.717  -3.849  -1.464
  509   3HD1  LEU  64          HD13      LEU  64   4.101  -4.768  -0.874
  510   1HD2  LEU  64          HD21      LEU  64   2.495  -5.778  -4.668
  511   2HD2  LEU  64          HD22      LEU  64   1.727  -4.479  -3.756
  512   3HD2  LEU  64          HD23      LEU  64   1.610  -6.144  -3.188
  513    H    THR  65           HN       THR  65   4.450  -3.042  -6.939
  514    HA   THR  65           HA       THR  65   7.177  -2.171  -7.366
  515    HB   THR  65           HB       THR  65   6.043  -1.314  -9.458
  516    HG1  THR  65           HG1      THR  65   3.905  -1.636  -9.630
  517   1HG2  THR  65          HG21      THR  65   5.820  -3.564 -10.395
  518   2HG2  THR  65          HG22      THR  65   5.695  -4.209  -8.753
  519   3HG2  THR  65          HG23      THR  65   7.215  -3.492  -9.299
  520    H    LEU  66           HN       LEU  66   6.082  -1.073  -5.123
  521    HA   LEU  66           HA       LEU  66   5.651   0.833  -3.947
  522   1HB   LEU  66          HB2       LEU  66   7.712   1.520  -5.303
  523   2HB   LEU  66          HB1       LEU  66   6.618   2.341  -6.390
  524    HG   LEU  66           HG       LEU  66   7.743   3.885  -4.825
  525   1HD1  LEU  66          HD11      LEU  66   5.785   5.087  -4.017
  526   2HD1  LEU  66          HD12      LEU  66   4.814   3.637  -4.349
  527   3HD1  LEU  66          HD13      LEU  66   5.580   4.502  -5.681
  528   1HD2  LEU  66          HD21      LEU  66   7.168   3.867  -2.452
  529   2HD2  LEU  66          HD22      LEU  66   8.002   2.385  -2.925
  530   3HD2  LEU  66          HD23      LEU  66   6.250   2.385  -2.686
  531    H    ARG  67           HN       ARG  67   4.618   1.581  -7.261
  532    HA   ARG  67           HA       ARG  67   2.319   2.891  -6.158
  533   1HB   ARG  67          HB2       ARG  67   3.345   2.606  -8.942
  534   2HB   ARG  67          HB1       ARG  67   1.663   3.065  -8.696
  535   1HG   ARG  67          HG2       ARG  67   4.039   4.519  -7.539
  536   2HG   ARG  67          HG1       ARG  67   3.129   5.020  -8.971
  537   1HD   ARG  67          HD2       ARG  67   1.084   5.172  -7.593
  538   2HD   ARG  67          HD1       ARG  67   1.998   4.653  -6.208
  539    HE   ARG  67           HE       ARG  67   3.343   6.723  -6.473
  540   1HH1  ARG  67          HH11      ARG  67   0.108   6.775  -7.958
  541   2HH1  ARG  67          HH12      ARG  67  -0.270   8.329  -7.440
  542   1HH2  ARG  67          HH21      ARG  67   2.794   8.989  -5.786
  543   2HH2  ARG  67          HH22      ARG  67   1.277   9.587  -6.155
  544    H    LYS  68           HN       LYS  68   3.019  -0.232  -6.876
  545    HA   LYS  68           HA       LYS  68   0.317  -1.067  -7.387
  546   1HB   LYS  68          HB2       LYS  68   2.312  -2.430  -7.991
  547   2HB   LYS  68          HB1       LYS  68   2.613  -2.680  -6.279
  548   1HG   LYS  68          HG2       LYS  68   0.484  -3.868  -6.067
  549   2HG   LYS  68          HG1       LYS  68   0.168  -3.606  -7.784
  550   1HD   LYS  68          HD2       LYS  68   2.539  -5.085  -6.680
  551   2HD   LYS  68          HD1       LYS  68   1.064  -5.873  -7.253
  552   1HE   LYS  68          HE2       LYS  68   2.913  -4.140  -8.911
  553   2HE   LYS  68          HE1       LYS  68   2.870  -5.897  -8.934
  554   1HZ   LYS  68          HZ1       LYS  68   1.655  -4.986 -10.780
  555   2HZ   LYS  68          HZ2       LYS  68   0.653  -4.089  -9.792
  556   3HZ   LYS  68          HZ3       LYS  68   0.576  -5.786  -9.761
  557    H    LEU  69           HN       LEU  69   2.085  -0.056  -4.691
  558    HA   LEU  69           HA       LEU  69   0.769  -1.421  -2.597
  559   1HB   LEU  69          HB2       LEU  69   2.182   1.221  -2.675
  560   2HB   LEU  69          HB1       LEU  69   1.231   0.812  -1.270
  561    HG   LEU  69           HG       LEU  69   3.578   0.362  -0.885
  562   1HD1  LEU  69          HD11      LEU  69   3.444  -1.961  -0.169
  563   2HD1  LEU  69          HD12      LEU  69   1.963  -2.153  -1.106
  564   3HD1  LEU  69          HD13      LEU  69   2.007  -1.031   0.254
  565   1HD2  LEU  69          HD21      LEU  69   4.784  -1.392  -2.096
  566   2HD2  LEU  69          HD22      LEU  69   4.313  -0.075  -3.172
  567   3HD2  LEU  69          HD23      LEU  69   3.406  -1.588  -3.179
  568    H    GLN  70           HN       GLN  70  -0.107   1.598  -4.210
  569    HA   GLN  70           HA       GLN  70  -2.428   1.970  -2.620
  570   1HB   GLN  70          HB2       GLN  70  -3.139   3.596  -4.470
  571   2HB   GLN  70          HB1       GLN  70  -1.670   3.967  -3.581
  572   1HG   GLN  70          HG2       GLN  70  -0.309   3.368  -5.341
  573   2HG   GLN  70          HG1       GLN  70  -1.613   2.557  -6.242
  574   1HE2  GLN  70          HE21      GLN  70  -1.362   3.802  -8.089
  575   2HE2  GLN  70          HE22      GLN  70  -1.675   5.479  -8.149
  576    H    GLU  71           HN       GLU  71  -1.813  -0.098  -5.218
  577    HA   GLU  71           HA       GLU  71  -4.570  -0.411  -6.015
  578   1HB   GLU  71          HB2       GLU  71  -2.165  -2.167  -6.559
  579   2HB   GLU  71          HB1       GLU  71  -3.722  -2.276  -7.367
  580   1HG   GLU  71          HG2       GLU  71  -1.870   0.093  -7.489
  581   2HG   GLU  71          HG1       GLU  71  -1.992  -1.165  -8.714
  582    H    MET  72           HN       MET  72  -2.273  -1.867  -3.850
  583    HA   MET  72           HA       MET  72  -4.132  -4.008  -3.063
  584   1HB   MET  72          HB2       MET  72  -1.261  -3.531  -2.242
  585   2HB   MET  72          HB1       MET  72  -2.225  -4.951  -1.876
  586   1HG   MET  72          HG2       MET  72  -1.297  -4.052  -4.575
  587   2HG   MET  72          HG1       MET  72  -0.644  -5.388  -3.633
  588   1HE   MET  72          HE1       MET  72  -0.923  -7.045  -5.697
  589   2HE   MET  72          HE2       MET  72  -1.553  -5.713  -6.666
  590   3HE   MET  72          HE3       MET  72  -2.425  -7.246  -6.599
  591    H    SER  73           HN       SER  73  -4.291  -1.076  -2.384
  592    HA   SER  73           HA       SER  73  -3.444  -0.713   0.251
  593   1HB   SER  73          HB2       SER  73  -4.846   1.369   0.144
  594   2HB   SER  73          HB1       SER  73  -3.712   1.176  -1.180
  595    HG   SER  73           HG       SER  73  -5.307   1.000  -2.564
  596    H    SER  74           HN       SER  74  -6.551  -1.559  -1.160
  597    HA   SER  74           HA       SER  74  -8.360  -2.625  -0.442
  598   1HB   SER  74          HB2       SER  74  -6.719  -4.144   0.756
  599   2HB   SER  74          HB1       SER  74  -6.954  -3.167   2.200
  600    HG   SER  74           HG       SER  74  -9.246  -4.091   0.950
  601    H    LYS  75           HN       LYS  75  -7.296   0.152   0.730
  602    HA   LYS  75           HA       LYS  75  -9.567   0.743   2.459
  603   1HB   LYS  75          HB2       LYS  75  -7.284   1.644   2.952
  604   2HB   LYS  75          HB1       LYS  75  -7.327   2.520   1.437
  605   1HG   LYS  75          HG2       LYS  75  -9.152   3.897   2.263
  606   2HG   LYS  75          HG1       LYS  75  -9.189   2.974   3.767
  607   1HD   LYS  75          HD2       LYS  75  -7.968   5.039   4.119
  608   2HD   LYS  75          HD1       LYS  75  -6.861   3.673   4.220
  609   1HE   LYS  75          HE2       LYS  75  -5.804   5.430   2.961
  610   2HE   LYS  75          HE1       LYS  75  -6.192   4.111   1.860
  611   1HZ   LYS  75          HZ1       LYS  75  -8.135   5.377   1.089
  612   2HZ   LYS  75          HZ2       LYS  75  -6.748   6.310   0.937
  613   3HZ   LYS  75          HZ3       LYS  75  -7.799   6.573   2.222
  614    H    ALA  76           HN       ALA  76  -8.624   0.734  -0.761
  615    HA   ALA  76           HA       ALA  76 -11.080   1.593  -1.798
  616   1HB   ALA  76          HB1       ALA  76 -10.138   3.823  -1.402
  617   2HB   ALA  76          HB2       ALA  76 -10.181   3.468  -3.128
  618   3HB   ALA  76          HB3       ALA  76  -8.658   3.358  -2.244
  619    H    GLY  77           HN       GLY  77 -10.657   1.677  -4.332
  620   1HA   GLY  77          HA2       GLY  77  -8.356   0.112  -5.113
  621   2HA   GLY  77          HA1       GLY  77  -9.928  -0.664  -5.321
  622    H    SER  78           HN       SER  78 -10.608  -0.505  -7.299
  623    HA   SER  78           HA       SER  78  -9.846   1.745  -8.961
  624   1HB   SER  78          HB2       SER  78 -11.699  -0.574  -9.567
  625   2HB   SER  78          HB1       SER  78 -10.925   0.501 -10.731
  626    HG   SER  78           HG       SER  78  -9.004  -0.570  -9.222
  627    H    ASP  79           HN       ASP  79 -12.604   0.222  -7.422
  628    HA   ASP  79           HA       ASP  79 -14.626   0.863  -6.738
  629   1HB   ASP  79          HB2       ASP  79 -13.409   3.625  -6.903
  630   2HB   ASP  79          HB1       ASP  79 -15.035   3.340  -6.301
  631    H    THR  80           HN       THR  80 -13.858   0.858  -9.682
  632    HA   THR  80           HA       THR  80 -15.527   2.602 -11.085
  633    HB   THR  80           HB       THR  80 -15.106   0.732 -12.858
  634    HG1  THR  80           HG1      THR  80 -13.405  -0.688 -12.223
  635   1HG2  THR  80          HG21      THR  80 -13.903   2.895 -12.770
  636   2HG2  THR  80          HG22      THR  80 -12.813   1.577 -13.202
  637   3HG2  THR  80          HG23      THR  80 -12.804   2.229 -11.562
  638    H    GLU  81           HN       GLU  81 -15.804  -0.867 -10.465
  639    HA   GLU  81           HA       GLU  81 -18.673  -0.657 -10.192
  640   1HB   GLU  81          HB2       GLU  81 -19.044  -2.521 -11.782
  641   2HB   GLU  81          HB1       GLU  81 -18.390  -1.100 -12.581
  642   1HG   GLU  81          HG2       GLU  81 -16.154  -2.150 -12.533
  643   2HG   GLU  81          HG1       GLU  81 -16.881  -3.593 -11.823
  644    H    LEU  82           HN       LEU  82 -19.336  -3.227  -9.817
  645    HA   LEU  82           HA       LEU  82 -17.652  -3.929  -7.553
  646   1HB   LEU  82          HB2       LEU  82 -20.428  -4.825  -8.338
  647   2HB   LEU  82          HB1       LEU  82 -19.531  -5.558  -7.030
  648    HG   LEU  82           HG       LEU  82 -21.086  -4.072  -6.071
  649   1HD1  LEU  82          HD11      LEU  82 -19.691  -2.482  -4.872
  650   2HD1  LEU  82          HD12      LEU  82 -18.380  -2.785  -6.015
  651   3HD1  LEU  82          HD13      LEU  82 -18.966  -4.086  -4.978
  652   1HD2  LEU  82          HD21      LEU  82 -21.612  -2.665  -7.986
  653   2HD2  LEU  82          HD22      LEU  82 -20.026  -1.901  -7.886
  654   3HD2  LEU  82          HD23      LEU  82 -21.201  -1.664  -6.593
  655    H    ALA  83           HN       ALA  83 -18.468  -4.917 -10.695
  656    HA   ALA  83           HA       ALA  83 -17.677  -6.448 -12.101
  657   1HB   ALA  83          HB1       ALA  83 -15.428  -5.912 -11.221
  658   2HB   ALA  83          HB2       ALA  83 -15.563  -7.603 -11.697
  659   3HB   ALA  83          HB3       ALA  83 -15.626  -7.159  -9.990
  660    H    ALA  84           HN       ALA  84 -19.316  -7.707 -12.333
  661    HA   ALA  84           HA       ALA  84 -19.561 -10.020 -10.547
  662   1HB   ALA  84          HB1       ALA  84 -21.793  -8.409 -11.802
  663   2HB   ALA  84          HB2       ALA  84 -21.351  -8.410 -10.094
  664   3HB   ALA  84          HB3       ALA  84 -21.994  -9.873 -10.839
  665    HA   PRO  85           HA       PRO  85 -19.343 -12.614 -14.150
  666   1HB   PRO  85          HB2       PRO  85 -21.649 -14.160 -13.652
  667   2HB   PRO  85          HB1       PRO  85 -20.006 -14.544 -13.142
  668   1HG   PRO  85          HG2       PRO  85 -22.225 -13.303 -11.609
  669   2HG   PRO  85          HG1       PRO  85 -20.923 -14.371 -11.054
  670   1HD   PRO  85          HD2       PRO  85 -20.913 -11.743 -10.535
  671   2HD   PRO  85          HD1       PRO  85 -19.413 -12.635 -10.866
  672    H    LYS  86           HN       LYS  86 -19.976 -12.267 -16.165
  673    HA   LYS  86           HA       LYS  86 -22.115 -10.471 -16.750
  674   1HB   LYS  86          HB2       LYS  86 -20.369 -12.102 -18.602
  675   2HB   LYS  86          HB1       LYS  86 -21.484 -10.846 -19.126
  676   1HG   LYS  86          HG2       LYS  86 -20.225  -9.189 -17.842
  677   2HG   LYS  86          HG1       LYS  86 -19.111 -10.448 -17.315
  678   1HD   LYS  86          HD2       LYS  86 -18.130  -9.209 -19.139
  679   2HD   LYS  86          HD1       LYS  86 -18.501 -10.843 -19.677
  680   1HE   LYS  86          HE2       LYS  86 -19.109  -9.219 -21.380
  681   2HE   LYS  86          HE1       LYS  86 -20.541 -10.032 -20.754
  682   1HZ   LYS  86          HZ1       LYS  86 -21.029  -8.082 -19.414
  683   2HZ   LYS  86          HZ2       LYS  86 -20.889  -7.670 -21.029
  684   3HZ   LYS  86          HZ3       LYS  86 -19.636  -7.300 -19.967
  685    H    SER  87           HN       SER  87 -21.899 -13.858 -16.515
  686    HA   SER  87           HA       SER  87 -24.583 -14.066 -17.655
  687   1HB   SER  87          HB2       SER  87 -22.755 -15.340 -18.875
  688   2HB   SER  87          HB1       SER  87 -22.505 -16.268 -17.399
  689    HG   SER  87           HG       SER  87 -23.988 -17.513 -18.205
  690    H    LYS  88           HN       LYS  88 -26.048 -15.333 -16.385
  691    HA   LYS  88           HA       LYS  88 -25.672 -15.298 -13.538
  692   1HB   LYS  88          HB2       LYS  88 -27.546 -17.107 -15.086
  693   2HB   LYS  88          HB1       LYS  88 -27.697 -16.622 -13.413
  694   1HG   LYS  88          HG2       LYS  88 -28.244 -14.351 -14.112
  695   2HG   LYS  88          HG1       LYS  88 -28.037 -14.818 -15.805
  696   1HD   LYS  88          HD2       LYS  88 -30.070 -15.949 -13.868
  697   2HD   LYS  88          HD1       LYS  88 -30.405 -14.855 -15.214
  698   1HE   LYS  88          HE2       LYS  88 -29.719 -16.532 -16.810
  699   2HE   LYS  88          HE1       LYS  88 -29.196 -17.608 -15.519
  700   1HZ   LYS  88          HZ1       LYS  88 -31.526 -17.725 -14.781
  701   2HZ   LYS  88          HZ2       LYS  88 -31.294 -18.311 -16.341
  702   3HZ   LYS  88          HZ3       LYS  88 -31.997 -16.801 -16.135
  703    H    ASN  89           HN       ASN  89 -25.586 -17.608 -16.088
  704    HA   ASN  89           HA       ASN  89 -23.385 -19.059 -15.237
  705   1HB   ASN  89          HB2       ASN  89 -24.942 -20.098 -13.624
  706   2HB   ASN  89          HB1       ASN  89 -26.087 -20.423 -14.921
  707   1HD2  ASN  89          HD21      ASN  89 -26.062 -22.594 -14.516
  708   2HD2  ASN  89          HD22      ASN  89 -24.728 -23.618 -14.940
  Start of MODEL   17
    1   1H    GLY   1          HT1       GLY   1 -14.708  13.418  -1.910
    2   2H    GLY   1          HT2       GLY   1 -14.507  14.598  -0.722
    3   3H    GLY   1          HT3       GLY   1 -15.621  13.368  -0.478
    4   1HA   GLY   1          HA1       GLY   1 -13.728  11.774  -0.521
    5   2HA   GLY   1          HA2       GLY   1 -12.675  13.188  -0.536
    6    H    ASP   2           HN       ASP   2 -14.241  11.004   1.318
    7    HA   ASP   2           HA       ASP   2 -14.114  12.660   3.743
    8   1HB   ASP   2          HB2       ASP   2 -16.464  12.428   3.201
    9   2HB   ASP   2          HB1       ASP   2 -16.276  10.703   2.918
   10    H    GLY   3           HN       GLY   3 -13.339  11.579   5.541
   11   1HA   GLY   3          HA2       GLY   3 -13.005   9.587   6.778
   12   2HA   GLY   3          HA1       GLY   3 -12.922   8.702   5.268
   13    H    GLU   4           HN       GLU   4 -11.083   7.745   5.443
   14    HA   GLU   4           HA       GLU   4  -8.902   7.295   5.443
   15   1HB   GLU   4          HB2       GLU   4  -8.553   8.978   3.721
   16   2HB   GLU   4          HB1       GLU   4  -8.512  10.258   4.925
   17   1HG   GLU   4          HG2       GLU   4  -6.272   9.751   4.157
   18   2HG   GLU   4          HG1       GLU   4  -6.453   9.320   5.855
   19    H    ALA   5           HN       ALA   5  -8.583   6.513   7.347
   20    HA   ALA   5           HA       ALA   5  -7.622   8.325   9.450
   21   1HB   ALA   5          HB1       ALA   5  -9.320   5.846   9.814
   22   2HB   ALA   5          HB2       ALA   5  -9.867   7.510  10.018
   23   3HB   ALA   5          HB3       ALA   5  -8.655   6.840  11.112
   24    H    GLN   6           HN       GLN   6  -6.476   6.505   7.260
   25    HA   GLN   6           HA       GLN   6  -4.750   4.928   9.019
   26   1HB   GLN   6          HB2       GLN   6  -6.260   3.509   7.651
   27   2HB   GLN   6          HB1       GLN   6  -5.689   4.306   6.198
   28   1HG   GLN   6          HG2       GLN   6  -3.415   3.379   6.688
   29   2HG   GLN   6          HG1       GLN   6  -4.147   2.447   7.995
   30   1HE2  GLN   6          HE21      GLN   6  -3.673   0.468   7.003
   31   2HE2  GLN   6          HE22      GLN   6  -4.509  -0.072   5.589
   32    H    ARG   7           HN       ARG   7  -4.556   5.446   5.634
   33    HA   ARG   7           HA       ARG   7  -3.246   7.475   4.809
   34   1HB   ARG   7          HB2       ARG   7  -0.818   7.254   4.948
   35   2HB   ARG   7          HB1       ARG   7  -1.390   7.161   6.601
   36   1HG   ARG   7          HG2       ARG   7  -1.033   4.587   5.174
   37   2HG   ARG   7          HG1       ARG   7   0.430   5.493   5.545
   38   1HD   ARG   7          HD2       ARG   7  -1.670   4.832   7.594
   39   2HD   ARG   7          HD1       ARG   7  -0.297   3.778   7.249
   40    HE   ARG   7           HE       ARG   7   0.995   5.985   7.742
   41   1HH1  ARG   7          HH11      ARG   7  -1.919   5.005   9.441
   42   2HH1  ARG   7          HH12      ARG   7  -1.385   5.411  11.000
   43   1HH2  ARG   7          HH21      ARG   7   1.815   6.554   9.908
   44   2HH2  ARG   7          HH22      ARG   7   0.818   6.293  11.265
   45    H    ASP   8           HN       ASP   8  -2.494   7.021   2.671
   46    HA   ASP   8           HA       ASP   8  -3.002   4.291   1.878
   47   1HB   ASP   8          HB2       ASP   8  -2.320   6.730   0.259
   48   2HB   ASP   8          HB1       ASP   8  -2.230   5.118  -0.453
   49    H    LEU   9           HN       LEU   9  -1.401   3.154   0.444
   50    HA   LEU   9           HA       LEU   9   0.854   2.973   2.153
   51   1HB   LEU   9          HB2       LEU   9   0.155   1.374  -0.280
   52   2HB   LEU   9          HB1       LEU   9   1.525   1.046   0.767
   53    HG   LEU   9           HG       LEU   9  -1.380   0.955   1.575
   54   1HD1  LEU   9          HD11      LEU   9   0.667  -1.229   1.221
   55   2HD1  LEU   9          HD12      LEU   9  -0.713  -0.915   0.167
   56   3HD1  LEU   9          HD13      LEU   9  -0.974  -1.444   1.829
   57   1HD2  LEU   9          HD21      LEU   9  -0.541   0.095   3.714
   58   2HD2  LEU   9          HD22      LEU   9   0.034   1.734   3.408
   59   3HD2  LEU   9          HD23      LEU   9   1.116   0.360   3.171
   60    H    VAL  10           HN       VAL  10   0.331   4.568  -0.813
   61    HA   VAL  10           HA       VAL  10   3.156   4.866  -1.297
   62    HB   VAL  10           HB       VAL  10   0.737   6.259  -2.531
   63   1HG1  VAL  10          HG11      VAL  10   2.700   7.755  -2.668
   64   2HG1  VAL  10          HG12      VAL  10   2.263   7.124  -4.259
   65   3HG1  VAL  10          HG13      VAL  10   3.639   6.448  -3.389
   66   1HG2  VAL  10          HG21      VAL  10   2.610   4.152  -3.573
   67   2HG2  VAL  10          HG22      VAL  10   1.300   4.901  -4.486
   68   3HG2  VAL  10          HG23      VAL  10   0.935   3.916  -3.067
   69    H    LYS  11           HN       LYS  11   0.889   6.140   0.769
   70    HA   LYS  11           HA       LYS  11   2.419   8.575   1.322
   71   1HB   LYS  11          HB2       LYS  11  -0.191   7.571   2.427
   72   2HB   LYS  11          HB1       LYS  11   0.494   9.163   2.743
   73   1HG   LYS  11          HG2       LYS  11  -0.496   8.122   0.089
   74   2HG   LYS  11          HG1       LYS  11  -1.340   9.257   1.135
   75   1HD   LYS  11          HD2       LYS  11   0.549  10.843   0.863
   76   2HD   LYS  11          HD1       LYS  11   1.293   9.707  -0.269
   77   1HE   LYS  11          HE2       LYS  11   0.065  11.483  -1.437
   78   2HE   LYS  11          HE1       LYS  11  -0.636   9.895  -1.747
   79   1HZ   LYS  11          HZ1       LYS  11  -2.403  10.344  -0.239
   80   2HZ   LYS  11          HZ2       LYS  11  -2.314  11.708  -1.216
   81   3HZ   LYS  11          HZ3       LYS  11  -1.661  11.726   0.345
   82    H    ALA  12           HN       ALA  12   2.782   5.540   1.906
   83    HA   ALA  12           HA       ALA  12   3.556   5.869   4.717
   84   1HB   ALA  12          HB1       ALA  12   2.917   3.556   5.170
   85   2HB   ALA  12          HB2       ALA  12   2.346   3.378   3.512
   86   3HB   ALA  12          HB3       ALA  12   1.530   4.490   4.613
   87    H    VAL  13           HN       VAL  13   3.886   3.310   2.271
   88    HA   VAL  13           HA       VAL  13   6.514   2.608   2.988
   89    HB   VAL  13           HB       VAL  13   5.054   2.137   0.371
   90   1HG1  VAL  13          HG11      VAL  13   7.432   1.812   0.107
   91   2HG1  VAL  13          HG12      VAL  13   6.599   0.257   0.045
   92   3HG1  VAL  13          HG13      VAL  13   7.475   0.737   1.504
   93   1HG2  VAL  13          HG21      VAL  13   5.263   0.391   2.826
   94   2HG2  VAL  13          HG22      VAL  13   4.505  -0.067   1.301
   95   3HG2  VAL  13          HG23      VAL  13   3.824   1.241   2.266
   96    H    ALA  14           HN       ALA  14   5.251   4.398   0.215
   97    HA   ALA  14           HA       ALA  14   7.760   5.086  -0.834
   98   1HB   ALA  14          HB1       ALA  14   6.547   6.668  -2.256
   99   2HB   ALA  14          HB2       ALA  14   5.118   6.507  -1.222
  100   3HB   ALA  14          HB3       ALA  14   5.680   5.135  -2.158
  101    H    HIS  15           HN       HIS  15   5.733   6.512   1.553
  102    HA   HIS  15           HA       HIS  15   6.959   9.065   1.735
  103   1HB   HIS  15          HB2       HIS  15   4.674   8.532   2.554
  104   2HB   HIS  15          HB1       HIS  15   5.368   7.523   3.803
  105    HD1  HIS  15           HD1      HIS  15   4.732  11.094   2.881
  106    HD2  HIS  15           HD2      HIS  15   6.347   8.917   6.026
  107    HE1  HIS  15           HE1      HIS  15   4.885  12.687   4.798
  108    HE2  HIS  15           HE2      HIS  15   5.452  11.219   6.737
  109    H    ILE  16           HN       ILE  16   7.714   5.933   3.034
  110    HA   ILE  16           HA       ILE  16   9.674   6.869   4.932
  111    HB   ILE  16           HB       ILE  16   9.152   4.097   3.799
  112   1HG1  ILE  16          HG12      ILE  16   7.324   4.896   5.215
  113   2HG1  ILE  16          HG11      ILE  16   8.172   3.567   5.988
  114   1HG2  ILE  16          HG21      ILE  16  11.010   4.830   6.053
  115   2HG2  ILE  16          HG22      ILE  16  11.468   4.206   4.470
  116   3HG2  ILE  16          HG23      ILE  16  10.560   3.188   5.589
  117   1HD1  ILE  16          HD11      ILE  16   9.335   5.161   7.434
  118   2HD1  ILE  16          HD12      ILE  16   7.584   5.301   7.586
  119   3HD1  ILE  16          HD13      ILE  16   8.488   6.490   6.648
  120    H    LEU  17           HN       LEU  17   9.613   5.642   1.644
  121    HA   LEU  17           HA       LEU  17  12.442   5.366   1.338
  122   1HB   LEU  17          HB2       LEU  17  10.372   5.618  -0.834
  123   2HB   LEU  17          HB1       LEU  17  11.978   4.945  -0.981
  124    HG   LEU  17           HG       LEU  17   9.639   3.767   0.493
  125   1HD1  LEU  17          HD11      LEU  17   9.525   3.493  -1.891
  126   2HD1  LEU  17          HD12      LEU  17   9.863   1.949  -1.110
  127   3HD1  LEU  17          HD13      LEU  17  11.160   2.830  -1.917
  128   1HD2  LEU  17          HD21      LEU  17  11.084   1.860   0.995
  129   2HD2  LEU  17          HD22      LEU  17  11.669   3.339   1.759
  130   3HD2  LEU  17          HD23      LEU  17  12.459   2.721   0.307
  131    H    GLY  18           HN       GLY  18  10.125   7.867   0.588
  132   1HA   GLY  18          HA2       GLY  18  10.913  10.177   0.663
  133   2HA   GLY  18          HA1       GLY  18  12.383   9.623  -0.135
  134    H    ILE  19           HN       ILE  19   9.079   8.691  -0.890
  135    HA   ILE  19           HA       ILE  19   9.122  10.246  -3.316
  136    HB   ILE  19           HB       ILE  19   8.026   8.063  -4.315
  137   1HG1  ILE  19          HG12      ILE  19  10.048   6.937  -2.368
  138   2HG1  ILE  19          HG11      ILE  19   8.316   6.642  -2.375
  139   1HG2  ILE  19          HG21      ILE  19  10.986   8.594  -4.278
  140   2HG2  ILE  19          HG22      ILE  19   9.758   9.235  -5.403
  141   3HG2  ILE  19          HG23      ILE  19  10.159   7.531  -5.428
  142   1HD1  ILE  19          HD11      ILE  19  10.268   5.770  -4.496
  143   2HD1  ILE  19          HD12      ILE  19   8.530   5.456  -4.495
  144   3HD1  ILE  19          HD13      ILE  19   9.555   4.747  -3.246
  145    H    ARG  20           HN       ARG  20   7.001  10.065  -4.395
  146    HA   ARG  20           HA       ARG  20   4.663   9.185  -3.057
  147   1HB   ARG  20          HB2       ARG  20   4.928  11.116  -1.611
  148   2HB   ARG  20          HB1       ARG  20   5.223  12.155  -3.008
  149   1HG   ARG  20          HG2       ARG  20   2.933  11.707  -3.796
  150   2HG   ARG  20          HG1       ARG  20   2.638  10.760  -2.340
  151   1HD   ARG  20          HD2       ARG  20   2.825  12.684  -0.965
  152   2HD   ARG  20          HD1       ARG  20   3.459  13.655  -2.299
  153    HE   ARG  20           HE       ARG  20   1.057  12.784  -3.205
  154   1HH1  ARG  20          HH11      ARG  20   1.908  14.446  -0.184
  155   2HH1  ARG  20          HH12      ARG  20   0.575  15.494  -0.213
  156   1HH2  ARG  20          HH21      ARG  20  -0.835  14.189  -3.203
  157   2HH2  ARG  20          HH22      ARG  20  -1.044  15.316  -1.956
  158    H    ASP  21           HN       ASP  21   5.965  11.603  -5.265
  159    HA   ASP  21           HA       ASP  21   3.685  11.443  -7.014
  160   1HB   ASP  21          HB2       ASP  21   6.366  12.764  -7.513
  161   2HB   ASP  21          HB1       ASP  21   4.932  12.941  -8.518
  162    H    LEU  22           HN       LEU  22   6.869  10.132  -6.958
  163    HA   LEU  22           HA       LEU  22   7.853   8.471  -8.082
  164   1HB   LEU  22          HB2       LEU  22   4.990   7.727  -8.638
  165   2HB   LEU  22          HB1       LEU  22   6.302   6.829  -9.360
  166    HG   LEU  22           HG       LEU  22   5.456   5.684  -7.443
  167   1HD1  LEU  22          HD11      LEU  22   7.555   5.443  -6.162
  168   2HD1  LEU  22          HD12      LEU  22   8.162   6.890  -6.981
  169   3HD1  LEU  22          HD13      LEU  22   7.790   5.452  -7.911
  170   1HD2  LEU  22          HD21      LEU  22   6.190   8.131  -5.839
  171   2HD2  LEU  22          HD22      LEU  22   5.670   6.585  -5.168
  172   3HD2  LEU  22          HD23      LEU  22   4.563   7.536  -6.154
  173    H    ALA  23           HN       ALA  23   7.002  11.050  -9.352
  174    HA   ALA  23           HA       ALA  23   6.807  10.388 -12.097
  175   1HB   ALA  23          HB1       ALA  23   5.657  12.362 -11.257
  176   2HB   ALA  23          HB2       ALA  23   6.834  12.818 -12.492
  177   3HB   ALA  23          HB3       ALA  23   7.197  13.078 -10.786
  178    H    GLY  24           HN       GLY  24   8.695   9.164 -12.193
  179   1HA   GLY  24          HA2       GLY  24  10.886   9.944 -13.459
  180   2HA   GLY  24          HA1       GLY  24  11.217  10.525 -11.818
  181    H    ILE  25           HN       ILE  25   9.697   8.289 -10.708
  182    HA   ILE  25           HA       ILE  25  11.955   6.489 -10.426
  183    HB   ILE  25           HB       ILE  25   9.180   6.315  -9.208
  184   1HG1  ILE  25          HG12      ILE  25  10.271   8.448  -8.623
  185   2HG1  ILE  25          HG11      ILE  25  10.063   7.403  -7.227
  186   1HG2  ILE  25          HG21      ILE  25  11.774   5.035  -8.336
  187   2HG2  ILE  25          HG22      ILE  25  10.408   4.208  -9.083
  188   3HG2  ILE  25          HG23      ILE  25  10.234   4.923  -7.479
  189   1HD1  ILE  25          HD11      ILE  25  12.628   7.848  -8.744
  190   2HD1  ILE  25          HD12      ILE  25  12.410   6.787  -7.345
  191   3HD1  ILE  25          HD13      ILE  25  12.190   8.527  -7.169
  192    H    ASN  26           HN       ASN  26  11.832   4.254 -10.952
  193    HA   ASN  26           HA       ASN  26  10.034   3.724 -13.175
  194   1HB   ASN  26          HB2       ASN  26  12.285   2.055 -12.015
  195   2HB   ASN  26          HB1       ASN  26  11.245   1.501 -13.314
  196   1HD2  ASN  26          HD21      ASN  26  11.541   2.372 -15.414
  197   2HD2  ASN  26          HD22      ASN  26  12.940   3.307 -15.782
  198    H    LEU  27           HN       LEU  27   8.260   2.638 -13.002
  199    HA   LEU  27           HA       LEU  27   7.569   1.543 -10.383
  200   1HB   LEU  27          HB2       LEU  27   5.848   2.033 -12.824
  201   2HB   LEU  27          HB1       LEU  27   5.254   1.425 -11.291
  202    HG   LEU  27           HG       LEU  27   6.437   4.158 -11.793
  203   1HD1  LEU  27          HD11      LEU  27   4.171   3.936 -12.641
  204   2HD1  LEU  27          HD12      LEU  27   4.231   4.983 -11.221
  205   3HD1  LEU  27          HD13      LEU  27   3.631   3.336 -11.067
  206   1HD2  LEU  27          HD21      LEU  27   5.869   4.638  -9.452
  207   2HD2  LEU  27          HD22      LEU  27   7.076   3.363  -9.583
  208   3HD2  LEU  27          HD23      LEU  27   5.396   2.955  -9.229
  209    H    ASP  28           HN       ASP  28   9.253   0.506 -12.647
  210    HA   ASP  28           HA       ASP  28   8.183  -2.214 -12.905
  211   1HB   ASP  28          HB2       ASP  28  10.589  -0.870 -14.174
  212   2HB   ASP  28          HB1       ASP  28  10.129  -2.544 -14.438
  213    H    SER  29           HN       SER  29   9.809  -0.405 -10.778
  214    HA   SER  29           HA       SER  29  11.837  -2.350 -10.120
  215   1HB   SER  29          HB2       SER  29  11.262   0.408  -9.012
  216   2HB   SER  29          HB1       SER  29  12.670  -0.587  -8.649
  217    HG   SER  29           HG       SER  29  13.403  -0.333 -10.706
  218    H    SER  30           HN       SER  30  11.100  -3.928  -8.885
  219    HA   SER  30           HA       SER  30   8.832  -3.829  -7.192
  220   1HB   SER  30          HB2       SER  30  11.183  -5.722  -7.248
  221   2HB   SER  30          HB1       SER  30   9.642  -6.057  -6.473
  222    HG   SER  30           HG       SER  30  10.219  -5.711  -9.229
  223    H    LEU  31           HN       LEU  31   8.844  -3.885  -4.850
  224    HA   LEU  31           HA       LEU  31  10.539  -2.057  -3.605
  225   1HB   LEU  31          HB2       LEU  31   9.027  -4.246  -2.166
  226   2HB   LEU  31          HB1       LEU  31   9.671  -2.776  -1.475
  227    HG   LEU  31           HG       LEU  31   7.344  -3.016  -3.360
  228   1HD1  LEU  31          HD11      LEU  31   6.096  -2.060  -1.492
  229   2HD1  LEU  31          HD12      LEU  31   7.560  -2.087  -0.508
  230   3HD1  LEU  31          HD13      LEU  31   6.848  -3.598  -1.068
  231   1HD2  LEU  31          HD21      LEU  31   8.612  -0.522  -2.237
  232   2HD2  LEU  31          HD22      LEU  31   7.095  -0.616  -3.146
  233   3HD2  LEU  31          HD23      LEU  31   8.620  -1.031  -3.932
  234    H    ALA  32           HN       ALA  32  11.040  -5.408  -4.185
  235    HA   ALA  32           HA       ALA  32  13.124  -5.693  -2.245
  236   1HB   ALA  32          HB1       ALA  32  13.661  -7.828  -3.405
  237   2HB   ALA  32          HB2       ALA  32  12.397  -7.448  -4.586
  238   3HB   ALA  32          HB3       ALA  32  12.000  -7.658  -2.873
  239    H    ASP  33           HN       ASP  33  12.868  -4.788  -5.536
  240    HA   ASP  33           HA       ASP  33  15.600  -5.053  -6.289
  241   1HB   ASP  33          HB2       ASP  33  13.785  -4.883  -7.985
  242   2HB   ASP  33          HB1       ASP  33  13.462  -3.234  -7.461
  243    H    LEU  34           HN       LEU  34  13.520  -2.553  -5.113
  244    HA   LEU  34           HA       LEU  34  15.322  -0.414  -4.803
  245   1HB   LEU  34          HB2       LEU  34  12.810  -1.259  -3.392
  246   2HB   LEU  34          HB1       LEU  34  13.726   0.106  -2.812
  247    HG   LEU  34           HG       LEU  34  13.096   1.455  -4.637
  248   1HD1  LEU  34          HD11      LEU  34  12.165  -1.026  -6.089
  249   2HD1  LEU  34          HD12      LEU  34  13.648  -0.140  -6.450
  250   3HD1  LEU  34          HD13      LEU  34  12.082   0.629  -6.688
  251   1HD2  LEU  34          HD21      LEU  34  10.888  -0.451  -4.044
  252   2HD2  LEU  34          HD22      LEU  34  10.663   1.122  -4.815
  253   3HD2  LEU  34          HD23      LEU  34  11.268   1.017  -3.148
  254    H    GLY  35           HN       GLY  35  14.225  -2.887  -2.494
  255   1HA   GLY  35          HA2       GLY  35  15.900  -4.121  -1.274
  256   2HA   GLY  35          HA1       GLY  35  16.815  -2.624  -1.151
  257    H    LEU  36           HN       LEU  36  14.515  -4.595   0.284
  258    HA   LEU  36           HA       LEU  36  14.321  -2.594   2.393
  259   1HB   LEU  36          HB2       LEU  36  12.032  -3.201   2.930
  260   2HB   LEU  36          HB1       LEU  36  12.127  -2.717   1.262
  261    HG   LEU  36           HG       LEU  36  12.187  -5.345   0.868
  262   1HD1  LEU  36          HD11      LEU  36  10.714  -5.115   3.489
  263   2HD1  LEU  36          HD12      LEU  36  12.242  -5.959   3.233
  264   3HD1  LEU  36          HD13      LEU  36  10.772  -6.543   2.455
  265   1HD2  LEU  36          HD21      LEU  36  10.538  -3.830  -0.008
  266   2HD2  LEU  36          HD22      LEU  36   9.707  -3.780   1.548
  267   3HD2  LEU  36          HD23      LEU  36   9.756  -5.280   0.617
  268    H    ASP  37           HN       ASP  37  15.455  -3.249   4.022
  269    HA   ASP  37           HA       ASP  37  15.320  -6.115   4.724
  270   1HB   ASP  37          HB2       ASP  37  17.679  -6.154   5.310
  271   2HB   ASP  37          HB1       ASP  37  17.499  -5.637   3.640
  272    H    SER  38           HN       SER  38  14.788  -2.971   5.740
  273    HA   SER  38           HA       SER  38  14.656  -3.754   8.450
  274   1HB   SER  38          HB2       SER  38  16.362  -1.442   7.492
  275   2HB   SER  38          HB1       SER  38  15.935  -1.768   9.169
  276    HG   SER  38           HG       SER  38  17.562  -3.331   7.431
  277    H    LEU  39           HN       LEU  39  12.803  -3.211   8.829
  278    HA   LEU  39           HA       LEU  39  11.005  -1.896   9.517
  279   1HB   LEU  39          HB2       LEU  39  12.485   0.000   9.753
  280   2HB   LEU  39          HB1       LEU  39  12.398   0.305   8.032
  281    HG   LEU  39           HG       LEU  39   9.903   0.645   8.386
  282   1HD1  LEU  39          HD11      LEU  39   9.210   1.337  10.609
  283   2HD1  LEU  39          HD12      LEU  39  10.783   0.851  11.242
  284   3HD1  LEU  39          HD13      LEU  39   9.699  -0.356  10.551
  285   1HD2  LEU  39          HD21      LEU  39  11.845   2.580   9.619
  286   2HD2  LEU  39          HD22      LEU  39  10.202   2.957   9.073
  287   3HD2  LEU  39          HD23      LEU  39  11.428   2.441   7.907
  288    H    MET  40           HN       MET  40  12.004  -1.484   6.242
  289    HA   MET  40           HA       MET  40   9.575  -0.544   5.183
  290   1HB   MET  40          HB2       MET  40  11.853  -1.866   3.723
  291   2HB   MET  40          HB1       MET  40  10.595  -0.876   2.998
  292   1HG   MET  40          HG2       MET  40  11.370   1.072   4.167
  293   2HG   MET  40          HG1       MET  40  12.526   0.107   5.083
  294   1HE   MET  40          HE1       MET  40  13.413   2.740   3.655
  295   2HE   MET  40          HE2       MET  40  14.904   2.230   2.861
  296   3HE   MET  40          HE3       MET  40  14.537   1.672   4.492
  297    H    GLY  41           HN       GLY  41  10.152  -3.672   6.222
  298   1HA   GLY  41          HA2       GLY  41   8.019  -4.667   4.446
  299   2HA   GLY  41          HA1       GLY  41   9.193  -5.691   5.274
  300    H    VAL  42           HN       VAL  42   9.081  -4.195   7.733
  301    HA   VAL  42           HA       VAL  42   6.868  -5.610   8.944
  302    HB   VAL  42           HB       VAL  42   8.847  -3.679  10.199
  303   1HG1  VAL  42          HG11      VAL  42   8.225  -4.729  12.327
  304   2HG1  VAL  42          HG12      VAL  42   7.011  -5.694  11.482
  305   3HG1  VAL  42          HG13      VAL  42   6.857  -3.937  11.539
  306   1HG2  VAL  42          HG21      VAL  42  10.038  -5.679  10.978
  307   2HG2  VAL  42          HG22      VAL  42  10.005  -5.561   9.221
  308   3HG2  VAL  42          HG23      VAL  42   8.931  -6.693  10.047
  309    H    GLU  43           HN       GLU  43   7.750  -2.249   8.361
  310    HA   GLU  43           HA       GLU  43   5.710  -0.995   9.774
  311   1HB   GLU  43          HB2       GLU  43   7.696   0.106   8.700
  312   2HB   GLU  43          HB1       GLU  43   6.899  -0.088   7.147
  313   1HG   GLU  43          HG2       GLU  43   6.501   2.168   7.885
  314   2HG   GLU  43          HG1       GLU  43   5.026   1.224   8.003
  315    H    VAL  44           HN       VAL  44   5.861  -2.222   6.514
  316    HA   VAL  44           HA       VAL  44   3.379  -1.394   5.510
  317    HB   VAL  44           HB       VAL  44   4.785  -3.992   4.858
  318   1HG1  VAL  44          HG11      VAL  44   3.817  -3.705   2.643
  319   2HG1  VAL  44          HG12      VAL  44   3.005  -2.237   3.199
  320   3HG1  VAL  44          HG13      VAL  44   2.577  -3.805   3.900
  321   1HG2  VAL  44          HG21      VAL  44   5.988  -2.772   3.121
  322   2HG2  VAL  44          HG22      VAL  44   6.397  -2.233   4.745
  323   3HG2  VAL  44          HG23      VAL  44   5.322  -1.252   3.735
  324    H    ARG  45           HN       ARG  45   4.371  -4.443   7.000
  325    HA   ARG  45           HA       ARG  45   1.813  -5.566   6.961
  326   1HB   ARG  45          HB2       ARG  45   4.261  -6.268   8.520
  327   2HB   ARG  45          HB1       ARG  45   2.804  -7.212   8.695
  328   1HG   ARG  45          HG2       ARG  45   2.916  -7.424   6.119
  329   2HG   ARG  45          HG1       ARG  45   4.582  -6.874   6.309
  330   1HD   ARG  45          HD2       ARG  45   3.343  -9.284   7.628
  331   2HD   ARG  45          HD1       ARG  45   4.445  -9.312   6.257
  332    HE   ARG  45           HE       ARG  45   6.107  -8.319   7.763
  333   1HH1  ARG  45          HH11      ARG  45   3.391 -10.167   9.193
  334   2HH1  ARG  45          HH12      ARG  45   4.242 -10.618  10.574
  335   1HH2  ARG  45          HH21      ARG  45   7.267  -9.009   9.664
  336   2HH2  ARG  45          HH22      ARG  45   6.508  -9.975  10.842
  337    H    GLN  46           HN       GLN  46   3.369  -3.577   9.383
  338    HA   GLN  46           HA       GLN  46   1.307  -4.007  11.314
  339   1HB   GLN  46          HB2       GLN  46   3.329  -1.776  11.094
  340   2HB   GLN  46          HB1       GLN  46   2.222  -1.975  12.439
  341   1HG   GLN  46          HG2       GLN  46   3.250  -4.103  12.982
  342   2HG   GLN  46          HG1       GLN  46   4.340  -3.931  11.608
  343   1HE2  GLN  46          HE21      GLN  46   4.818  -4.095  14.506
  344   2HE2  GLN  46          HE22      GLN  46   5.806  -2.727  14.887
  345    H    ILE  47           HN       ILE  47   1.344  -2.258   8.478
  346    HA   ILE  47           HA       ILE  47  -0.742  -0.440   9.374
  347    HB   ILE  47           HB       ILE  47   0.493  -0.766   6.607
  348   1HG1  ILE  47          HG12      ILE  47   0.894   1.433   8.648
  349   2HG1  ILE  47          HG11      ILE  47   2.010   0.099   8.392
  350   1HG2  ILE  47          HG21      ILE  47  -1.786   0.098   6.495
  351   2HG2  ILE  47          HG22      ILE  47  -0.623   1.360   6.079
  352   3HG2  ILE  47          HG23      ILE  47  -1.385   1.347   7.671
  353   1HD1  ILE  47          HD11      ILE  47   2.365   0.871   6.088
  354   2HD1  ILE  47          HD12      ILE  47   2.817   2.070   7.287
  355   3HD1  ILE  47          HD13      ILE  47   1.299   2.243   6.398
  356    H    LEU  48           HN       LEU  48  -0.312  -2.963   6.916
  357    HA   LEU  48           HA       LEU  48  -3.081  -2.983   6.271
  358   1HB   LEU  48          HB2       LEU  48  -0.881  -4.863   5.487
  359   2HB   LEU  48          HB1       LEU  48  -2.533  -5.082   4.966
  360    HG   LEU  48           HG       LEU  48  -1.450  -4.095   3.177
  361   1HD1  LEU  48          HD11      LEU  48  -3.584  -3.094   3.562
  362   2HD1  LEU  48          HD12      LEU  48  -2.467  -1.900   2.900
  363   3HD1  LEU  48          HD13      LEU  48  -2.862  -1.880   4.619
  364   1HD2  LEU  48          HD21      LEU  48  -0.275  -2.065   5.057
  365   2HD2  LEU  48          HD22      LEU  48  -0.088  -2.065   3.303
  366   3HD2  LEU  48          HD23      LEU  48   0.587  -3.384   4.264
  367    H    GLU  49           HN       GLU  49  -1.115  -5.153   8.254
  368    HA   GLU  49           HA       GLU  49  -3.176  -7.070   8.599
  369   1HB   GLU  49          HB2       GLU  49  -0.802  -7.611   8.799
  370   2HB   GLU  49          HB1       GLU  49  -0.674  -6.560  10.199
  371   1HG   GLU  49          HG2       GLU  49  -2.282  -8.045  11.365
  372   2HG   GLU  49          HG1       GLU  49  -2.195  -9.131   9.979
  373    H    ARG  50           HN       ARG  50  -2.303  -4.182  10.167
  374    HA   ARG  50           HA       ARG  50  -3.742  -4.662  12.605
  375   1HB   ARG  50          HB2       ARG  50  -1.730  -3.296  12.491
  376   2HB   ARG  50          HB1       ARG  50  -2.549  -2.172  11.429
  377   1HG   ARG  50          HG2       ARG  50  -4.054  -1.553  13.233
  378   2HG   ARG  50          HG1       ARG  50  -3.256  -2.720  14.301
  379   1HD   ARG  50          HD2       ARG  50  -1.124  -1.562  13.942
  380   2HD   ARG  50          HD1       ARG  50  -1.942  -0.384  12.934
  381    HE   ARG  50           HE       ARG  50  -3.004  -0.633  15.590
  382   1HH1  ARG  50          HH11      ARG  50  -0.833   1.115  13.411
  383   2HH1  ARG  50          HH12      ARG  50  -0.469   2.380  14.494
  384   1HH2  ARG  50          HH21      ARG  50  -2.505   1.142  17.144
  385   2HH2  ARG  50          HH22      ARG  50  -1.416   2.354  16.688
  386    H    GLU  51           HN       GLU  51  -4.194  -2.680   9.704
  387    HA   GLU  51           HA       GLU  51  -6.724  -1.703  10.607
  388   1HB   GLU  51          HB2       GLU  51  -5.331  -1.430   7.954
  389   2HB   GLU  51          HB1       GLU  51  -6.847  -0.653   8.364
  390   1HG   GLU  51          HG2       GLU  51  -4.205  -0.202   9.732
  391   2HG   GLU  51          HG1       GLU  51  -4.977   0.877   8.573
  392    H    HIS  52           HN       HIS  52  -5.870  -3.555   7.669
  393    HA   HIS  52           HA       HIS  52  -8.722  -4.268   7.452
  394   1HB   HIS  52          HB2       HIS  52  -7.250  -3.130   5.587
  395   2HB   HIS  52          HB1       HIS  52  -6.657  -4.753   5.326
  396    HD1  HIS  52           HD1      HIS  52  -9.601  -2.553   4.739
  397    HD2  HIS  52           HD2      HIS  52  -8.590  -6.553   4.181
  398    HE1  HIS  52           HE1      HIS  52 -11.296  -3.461   3.153
  399    HE2  HIS  52           HE2      HIS  52 -10.795  -5.904   2.976
  400    H    ASP  53           HN       ASP  53  -6.191  -5.520   8.893
  401    HA   ASP  53           HA       ASP  53  -5.329  -7.514   9.488
  402   1HB   ASP  53          HB2       ASP  53  -7.768  -7.870  10.164
  403   2HB   ASP  53          HB1       ASP  53  -7.987  -8.738   8.648
  404    H    LEU  54           HN       LEU  54  -4.837  -6.623   6.894
  405    HA   LEU  54           HA       LEU  54  -4.802  -9.032   5.290
  406   1HB   LEU  54          HB2       LEU  54  -4.130  -6.195   4.709
  407   2HB   LEU  54          HB1       LEU  54  -3.548  -7.464   3.649
  408    HG   LEU  54           HG       LEU  54  -6.378  -6.688   4.238
  409   1HD1  LEU  54          HD11      LEU  54  -6.436  -6.206   1.853
  410   2HD1  LEU  54          HD12      LEU  54  -4.727  -6.648   1.748
  411   3HD1  LEU  54          HD13      LEU  54  -5.219  -5.247   2.706
  412   1HD2  LEU  54          HD21      LEU  54  -7.047  -8.429   2.660
  413   2HD2  LEU  54          HD22      LEU  54  -6.248  -9.116   4.072
  414   3HD2  LEU  54          HD23      LEU  54  -5.373  -8.970   2.547
  415    H    VAL  55           HN       VAL  55  -3.364 -10.394   5.913
  416    HA   VAL  55           HA       VAL  55  -0.794  -9.492   6.842
  417    HB   VAL  55           HB       VAL  55  -1.655 -12.342   6.310
  418   1HG1  VAL  55          HG11      VAL  55   0.474 -11.208   8.113
  419   2HG1  VAL  55          HG12      VAL  55   0.728 -12.040   6.579
  420   3HG1  VAL  55          HG13      VAL  55   0.062 -12.916   7.956
  421   1HG2  VAL  55          HG21      VAL  55  -2.258 -12.504   8.683
  422   2HG2  VAL  55          HG22      VAL  55  -3.274 -11.347   7.823
  423   3HG2  VAL  55          HG23      VAL  55  -1.972 -10.774   8.868
  424    H    LEU  56           HN       LEU  56  -0.342  -8.431   4.878
  425    HA   LEU  56           HA       LEU  56   0.145 -10.053   2.525
  426   1HB   LEU  56          HB2       LEU  56   0.974  -7.175   2.906
  427   2HB   LEU  56          HB1       LEU  56   0.663  -8.011   1.406
  428    HG   LEU  56           HG       LEU  56  -1.393  -7.043   3.396
  429   1HD1  LEU  56          HD11      LEU  56  -0.482  -5.302   2.024
  430   2HD1  LEU  56          HD12      LEU  56  -2.152  -5.636   1.563
  431   3HD1  LEU  56          HD13      LEU  56  -0.826  -6.232   0.565
  432   1HD2  LEU  56          HD21      LEU  56  -3.130  -7.881   1.964
  433   2HD2  LEU  56          HD22      LEU  56  -2.083  -9.229   2.403
  434   3HD2  LEU  56          HD23      LEU  56  -1.954  -8.497   0.797
  435    HA   PRO  57           HA       PRO  57   4.109 -10.685   4.454
  436   1HB   PRO  57          HB2       PRO  57   4.534 -12.947   2.844
  437   2HB   PRO  57          HB1       PRO  57   3.897 -12.919   4.485
  438   1HG   PRO  57          HG2       PRO  57   2.488 -13.685   2.197
  439   2HG   PRO  57          HG1       PRO  57   1.754 -13.225   3.744
  440   1HD   PRO  57          HD2       PRO  57   2.147 -11.607   1.269
  441   2HD   PRO  57          HD1       PRO  57   0.786 -11.612   2.417
  442    H    ILE  58           HN       ILE  58   6.332 -11.398   3.598
  443    HA   ILE  58           HA       ILE  58   7.242  -9.420   1.827
  444    HB   ILE  58           HB       ILE  58   8.600 -11.815   3.102
  445   1HG1  ILE  58          HG12      ILE  58   9.976  -9.956   4.209
  446   2HG1  ILE  58          HG11      ILE  58   8.820  -8.846   3.488
  447   1HG2  ILE  58          HG21      ILE  58   9.958  -9.839   1.289
  448   2HG2  ILE  58          HG22      ILE  58   9.693 -11.550   0.974
  449   3HG2  ILE  58          HG23      ILE  58  10.765 -11.053   2.285
  450   1HD1  ILE  58          HD11      ILE  58   8.166 -10.985   5.502
  451   2HD1  ILE  58          HD12      ILE  58   7.031  -9.833   4.799
  452   3HD1  ILE  58          HD13      ILE  58   8.339  -9.260   5.837
  453    H    ARG  59           HN       ARG  59   6.192 -12.623   1.366
  454    HA   ARG  59           HA       ARG  59   7.359 -13.237  -1.147
  455   1HB   ARG  59          HB2       ARG  59   4.605 -14.226  -0.354
  456   2HB   ARG  59          HB1       ARG  59   5.733 -14.982  -1.457
  457   1HG   ARG  59          HG2       ARG  59   6.014 -16.340   0.341
  458   2HG   ARG  59          HG1       ARG  59   7.207 -15.104   0.762
  459   1HD   ARG  59          HD2       ARG  59   5.459 -13.937   2.070
  460   2HD   ARG  59          HD1       ARG  59   4.359 -15.261   1.719
  461    HE   ARG  59           HE       ARG  59   6.871 -15.762   3.106
  462   1HH1  ARG  59          HH11      ARG  59   3.320 -15.952   3.046
  463   2HH1  ARG  59          HH12      ARG  59   3.155 -16.358   4.681
  464   1HH2  ARG  59          HH21      ARG  59   6.634 -16.393   5.408
  465   2HH2  ARG  59          HH22      ARG  59   5.065 -16.646   6.039
  466    H    GLU  60           HN       GLU  60   4.934 -10.999  -0.332
  467    HA   GLU  60           HA       GLU  60   4.401 -10.608  -3.174
  468   1HB   GLU  60          HB2       GLU  60   2.520 -10.211  -0.874
  469   2HB   GLU  60          HB1       GLU  60   2.224  -9.542  -2.473
  470   1HG   GLU  60          HG2       GLU  60   2.402 -11.853  -3.379
  471   2HG   GLU  60          HG1       GLU  60   2.471 -12.433  -1.715
  472    H    VAL  61           HN       VAL  61   4.686  -8.956  -0.037
  473    HA   VAL  61           HA       VAL  61   4.526  -6.344  -0.891
  474    HB   VAL  61           HB       VAL  61   6.224  -7.436   1.382
  475   1HG1  VAL  61          HG11      VAL  61   5.389  -4.578   0.854
  476   2HG1  VAL  61          HG12      VAL  61   7.031  -5.210   0.742
  477   3HG1  VAL  61          HG13      VAL  61   6.211  -5.156   2.305
  478   1HG2  VAL  61          HG21      VAL  61   4.364  -6.687   2.785
  479   2HG2  VAL  61          HG22      VAL  61   3.846  -7.882   1.599
  480   3HG2  VAL  61          HG23      VAL  61   3.483  -6.173   1.346
  481    H    ARG  62           HN       ARG  62   7.443  -8.325  -0.806
  482    HA   ARG  62           HA       ARG  62   9.151  -6.259  -1.700
  483   1HB   ARG  62          HB2       ARG  62   9.353  -9.121  -1.243
  484   2HB   ARG  62          HB1       ARG  62  10.466  -8.547  -2.454
  485   1HG   ARG  62          HG2       ARG  62  11.183  -6.807  -0.745
  486   2HG   ARG  62          HG1       ARG  62  10.195  -7.684   0.421
  487   1HD   ARG  62          HD2       ARG  62  11.522  -9.684   0.092
  488   2HD   ARG  62          HD1       ARG  62  12.456  -8.880  -1.166
  489    HE   ARG  62           HE       ARG  62  12.827  -7.277   0.957
  490   1HH1  ARG  62          HH11      ARG  62  13.274 -10.777   0.538
  491   2HH1  ARG  62          HH12      ARG  62  14.565 -10.846   1.662
  492   1HH2  ARG  62          HH21      ARG  62  14.552  -7.435   2.475
  493   2HH2  ARG  62          HH22      ARG  62  15.311  -8.933   2.782
  494    H    GLN  63           HN       GLN  63   6.756  -7.821  -3.427
  495    HA   GLN  63           HA       GLN  63   8.213  -7.537  -5.944
  496   1HB   GLN  63          HB2       GLN  63   5.918  -9.400  -5.249
  497   2HB   GLN  63          HB1       GLN  63   6.417  -9.088  -6.896
  498   1HG   GLN  63          HG2       GLN  63   7.481 -11.081  -6.474
  499   2HG   GLN  63          HG1       GLN  63   8.744  -9.934  -6.080
  500   1HE2  GLN  63          HE21      GLN  63   7.428  -9.350  -3.535
  501   2HE2  GLN  63          HE22      GLN  63   7.778 -10.656  -2.445
  502    H    LEU  64           HN       LEU  64   6.370  -5.840  -4.060
  503    HA   LEU  64           HA       LEU  64   4.379  -5.028  -5.977
  504   1HB   LEU  64          HB2       LEU  64   5.102  -3.813  -3.307
  505   2HB   LEU  64          HB1       LEU  64   3.700  -3.405  -4.277
  506    HG   LEU  64           HG       LEU  64   4.236  -6.027  -2.917
  507   1HD1  LEU  64          HD11      LEU  64   3.606  -4.293  -1.359
  508   2HD1  LEU  64          HD12      LEU  64   2.292  -5.456  -1.536
  509   3HD1  LEU  64          HD13      LEU  64   2.197  -3.890  -2.342
  510   1HD2  LEU  64          HD21      LEU  64   3.036  -6.399  -4.997
  511   2HD2  LEU  64          HD22      LEU  64   1.843  -5.178  -4.552
  512   3HD2  LEU  64          HD23      LEU  64   1.969  -6.670  -3.619
  513    H    THR  65           HN       THR  65   4.389  -3.039  -7.036
  514    HA   THR  65           HA       THR  65   7.067  -2.097  -7.613
  515    HB   THR  65           HB       THR  65   5.833  -1.317  -9.655
  516    HG1  THR  65           HG1      THR  65   3.679  -1.807  -9.758
  517   1HG2  THR  65          HG21      THR  65   7.089  -3.432  -9.463
  518   2HG2  THR  65          HG22      THR  65   5.654  -3.632 -10.499
  519   3HG2  THR  65          HG23      THR  65   5.644  -4.194  -8.819
  520    H    LEU  66           HN       LEU  66   5.803  -1.135  -5.299
  521    HA   LEU  66           HA       LEU  66   5.531   0.722  -4.094
  522   1HB   LEU  66          HB2       LEU  66   7.562   1.416  -5.502
  523   2HB   LEU  66          HB1       LEU  66   6.445   2.356  -6.465
  524    HG   LEU  66           HG       LEU  66   7.688   3.713  -4.815
  525   1HD1  LEU  66          HD11      LEU  66   4.752   3.542  -4.254
  526   2HD1  LEU  66          HD12      LEU  66   5.511   4.474  -5.546
  527   3HD1  LEU  66          HD13      LEU  66   5.797   4.913  -3.855
  528   1HD2  LEU  66          HD21      LEU  66   7.948   2.055  -3.070
  529   2HD2  LEU  66          HD22      LEU  66   6.209   2.066  -2.775
  530   3HD2  LEU  66          HD23      LEU  66   7.170   3.506  -2.435
  531    H    ARG  67           HN       ARG  67   4.354   1.569  -7.353
  532    HA   ARG  67           HA       ARG  67   2.217   3.013  -6.134
  533   1HB   ARG  67          HB2       ARG  67   2.903   2.469  -8.978
  534   2HB   ARG  67          HB1       ARG  67   1.267   2.987  -8.594
  535   1HG   ARG  67          HG2       ARG  67   3.786   4.473  -7.852
  536   2HG   ARG  67          HG1       ARG  67   2.693   4.886  -9.181
  537   1HD   ARG  67          HD2       ARG  67   0.851   5.109  -7.523
  538   2HD   ARG  67          HD1       ARG  67   2.003   4.785  -6.256
  539    HE   ARG  67           HE       ARG  67   3.082   6.844  -6.679
  540   1HH1  ARG  67          HH11      ARG  67   0.073   6.522  -8.569
  541   2HH1  ARG  67          HH12      ARG  67  -0.246   8.180  -8.541
  542   1HH2  ARG  67          HH21      ARG  67   2.548   9.181  -6.672
  543   2HH2  ARG  67          HH22      ARG  67   1.155   9.677  -7.537
  544    H    LYS  68           HN       LYS  68   2.589  -0.216  -7.169
  545    HA   LYS  68           HA       LYS  68  -0.138  -0.935  -7.191
  546   1HB   LYS  68          HB2       LYS  68   1.750  -2.355  -8.054
  547   2HB   LYS  68          HB1       LYS  68   2.205  -2.658  -6.382
  548   1HG   LYS  68          HG2       LYS  68   0.133  -3.794  -5.967
  549   2HG   LYS  68          HG1       LYS  68  -0.437  -3.405  -7.593
  550   1HD   LYS  68          HD2       LYS  68   1.375  -4.727  -8.549
  551   2HD   LYS  68          HD1       LYS  68   1.966  -5.088  -6.920
  552   1HE   LYS  68          HE2       LYS  68  -0.102  -6.185  -6.391
  553   2HE   LYS  68          HE1       LYS  68  -0.755  -5.797  -7.982
  554   1HZ   LYS  68          HZ1       LYS  68   0.974  -7.180  -8.984
  555   2HZ   LYS  68          HZ2       LYS  68   0.065  -8.096  -7.882
  556   3HZ   LYS  68          HZ3       LYS  68   1.608  -7.542  -7.467
  557    H    LEU  69           HN       LEU  69   1.988  -0.140  -4.721
  558    HA   LEU  69           HA       LEU  69   0.855  -1.382  -2.449
  559   1HB   LEU  69          HB2       LEU  69   2.388   1.170  -2.757
  560   2HB   LEU  69          HB1       LEU  69   1.588   0.845  -1.240
  561    HG   LEU  69           HG       LEU  69   3.952   0.299  -1.153
  562   1HD1  LEU  69          HD11      LEU  69   3.792  -1.973  -0.288
  563   2HD1  LEU  69          HD12      LEU  69   2.197  -2.132  -1.025
  564   3HD1  LEU  69          HD13      LEU  69   2.466  -0.949   0.256
  565   1HD2  LEU  69          HD21      LEU  69   4.875  -1.564  -2.417
  566   2HD2  LEU  69          HD22      LEU  69   4.317  -0.277  -3.488
  567   3HD2  LEU  69          HD23      LEU  69   3.351  -1.737  -3.284
  568    H    GLN  70           HN       GLN  70  -0.114   1.620  -4.080
  569    HA   GLN  70           HA       GLN  70  -2.154   2.013  -2.082
  570   1HB   GLN  70          HB2       GLN  70  -2.830   4.024  -3.387
  571   2HB   GLN  70          HB1       GLN  70  -1.161   4.040  -2.842
  572   1HG   GLN  70          HG2       GLN  70  -0.367   3.539  -4.990
  573   2HG   GLN  70          HG1       GLN  70  -2.010   3.272  -5.627
  574   1HE2  GLN  70          HE21      GLN  70  -1.770   4.844  -7.173
  575   2HE2  GLN  70          HE22      GLN  70  -1.753   6.536  -6.780
  576    H    GLU  71           HN       GLU  71  -1.921   0.030  -4.589
  577    HA   GLU  71           HA       GLU  71  -4.741   0.077  -5.339
  578   1HB   GLU  71          HB2       GLU  71  -2.929  -0.411  -7.004
  579   2HB   GLU  71          HB1       GLU  71  -2.476  -1.816  -6.062
  580   1HG   GLU  71          HG2       GLU  71  -4.700  -2.787  -6.522
  581   2HG   GLU  71          HG1       GLU  71  -5.059  -1.393  -7.544
  582    H    MET  72           HN       MET  72  -2.535  -1.259  -3.149
  583    HA   MET  72           HA       MET  72  -4.424  -3.299  -2.177
  584   1HB   MET  72          HB2       MET  72  -1.438  -3.068  -1.727
  585   2HB   MET  72          HB1       MET  72  -2.473  -4.330  -1.090
  586   1HG   MET  72          HG2       MET  72  -1.808  -3.835  -3.984
  587   2HG   MET  72          HG1       MET  72  -1.212  -5.137  -2.963
  588   1HE   MET  72          HE1       MET  72  -2.443  -5.655  -5.774
  589   2HE   MET  72          HE2       MET  72  -3.504  -7.027  -5.462
  590   3HE   MET  72          HE3       MET  72  -1.909  -6.961  -4.714
  591    H    SER  73           HN       SER  73  -4.190  -0.274  -1.676
  592    HA   SER  73           HA       SER  73  -3.085  -0.091   0.921
  593   1HB   SER  73          HB2       SER  73  -3.854   2.279   0.866
  594   2HB   SER  73          HB1       SER  73  -2.852   1.815  -0.505
  595    HG   SER  73           HG       SER  73  -4.945   3.057  -0.766
  596    H    SER  74           HN       SER  74  -5.893  -1.267  -0.178
  597    HA   SER  74           HA       SER  74  -7.570  -2.335   0.876
  598   1HB   SER  74          HB2       SER  74  -6.335  -1.239   3.393
  599   2HB   SER  74          HB1       SER  74  -7.592  -2.476   3.322
  600    HG   SER  74           HG       SER  74  -5.081  -2.692   2.024
  601    H    LYS  75           HN       LYS  75  -7.952   0.267  -0.202
  602    HA   LYS  75           HA       LYS  75 -10.181   1.096   1.512
  603   1HB   LYS  75          HB2       LYS  75  -8.458   2.965  -0.110
  604   2HB   LYS  75          HB1       LYS  75  -9.841   3.415   0.878
  605   1HG   LYS  75          HG2       LYS  75  -8.641   2.640   2.867
  606   2HG   LYS  75          HG1       LYS  75  -7.248   2.265   1.851
  607   1HD   LYS  75          HD2       LYS  75  -7.303   4.675   1.118
  608   2HD   LYS  75          HD1       LYS  75  -8.463   4.948   2.422
  609   1HE   LYS  75          HE2       LYS  75  -6.203   5.463   3.158
  610   2HE   LYS  75          HE1       LYS  75  -6.845   4.067   4.031
  611   1HZ   LYS  75          HZ1       LYS  75  -5.614   2.614   2.593
  612   2HZ   LYS  75          HZ2       LYS  75  -4.565   3.769   3.273
  613   3HZ   LYS  75          HZ3       LYS  75  -5.116   3.954   1.666
  614    H    ALA  76           HN       ALA  76 -11.799   2.308   0.305
  615    HA   ALA  76           HA       ALA  76 -12.034   1.311  -2.451
  616   1HB   ALA  76          HB1       ALA  76 -14.216   1.866  -0.438
  617   2HB   ALA  76          HB2       ALA  76 -13.647   0.272  -0.937
  618   3HB   ALA  76          HB3       ALA  76 -14.461   1.320  -2.099
  619    H    GLY  77           HN       GLY  77 -12.648   3.908  -0.174
  620   1HA   GLY  77          HA2       GLY  77 -12.434   6.195  -0.631
  621   2HA   GLY  77          HA1       GLY  77 -12.533   5.842  -2.356
  622    H    SER  78           HN       SER  78 -14.412   6.005   0.614
  623    HA   SER  78           HA       SER  78 -16.883   5.886  -0.896
  624   1HB   SER  78          HB2       SER  78 -16.444   6.247   2.072
  625   2HB   SER  78          HB1       SER  78 -17.936   5.743   1.265
  626    HG   SER  78           HG       SER  78 -15.888   4.230   0.479
  627    H    ASP  79           HN       ASP  79 -17.201   7.736  -1.974
  628    HA   ASP  79           HA       ASP  79 -16.434  10.291  -0.815
  629   1HB   ASP  79          HB2       ASP  79 -16.079   9.535  -3.270
  630   2HB   ASP  79          HB1       ASP  79 -17.797   9.836  -3.475
  631    H    THR  80           HN       THR  80 -17.833  11.067   0.614
  632    HA   THR  80           HA       THR  80 -20.547  10.095   0.605
  633    HB   THR  80           HB       THR  80 -19.087  11.762   2.652
  634    HG1  THR  80           HG1      THR  80 -18.748   9.297   1.807
  635   1HG2  THR  80          HG21      THR  80 -21.560  11.771   2.898
  636   2HG2  THR  80          HG22      THR  80 -20.784  10.866   4.200
  637   3HG2  THR  80          HG23      THR  80 -21.556  10.008   2.868
  638    H    GLU  81           HN       GLU  81 -18.889  13.181   0.204
  639    HA   GLU  81           HA       GLU  81 -21.370  14.587   0.350
  640   1HB   GLU  81          HB2       GLU  81 -19.987  16.623  -0.273
  641   2HB   GLU  81          HB1       GLU  81 -19.578  15.845   1.239
  642   1HG   GLU  81          HG2       GLU  81 -18.058  15.391  -1.325
  643   2HG   GLU  81          HG1       GLU  81 -17.651  16.652  -0.167
  644    H    LEU  82           HN       LEU  82 -22.712  14.119  -1.158
  645    HA   LEU  82           HA       LEU  82 -21.777  14.237  -3.906
  646   1HB   LEU  82          HB2       LEU  82 -23.965  13.161  -4.533
  647   2HB   LEU  82          HB1       LEU  82 -22.887  12.180  -3.580
  648    HG   LEU  82           HG       LEU  82 -24.345  12.785  -1.571
  649   1HD1  LEU  82          HD11      LEU  82 -25.523  14.692  -2.509
  650   2HD1  LEU  82          HD12      LEU  82 -26.648  13.425  -2.023
  651   3HD1  LEU  82          HD13      LEU  82 -26.256  13.650  -3.729
  652   1HD2  LEU  82          HD21      LEU  82 -25.996  11.071  -2.125
  653   2HD2  LEU  82          HD22      LEU  82 -24.369  10.605  -2.623
  654   3HD2  LEU  82          HD23      LEU  82 -25.528  11.176  -3.824
  655    H    ALA  83           HN       ALA  83 -23.700  15.898  -1.649
  656    HA   ALA  83           HA       ALA  83 -24.829  17.674  -3.644
  657   1HB   ALA  83          HB1       ALA  83 -24.776  17.824  -0.615
  658   2HB   ALA  83          HB2       ALA  83 -26.110  17.217  -1.596
  659   3HB   ALA  83          HB3       ALA  83 -25.668  18.922  -1.671
  660    H    ALA  84           HN       ALA  84 -23.519  19.156  -4.540
  661    HA   ALA  84           HA       ALA  84 -21.317  20.135  -2.872
  662   1HB   ALA  84          HB1       ALA  84 -20.477  18.386  -4.352
  663   2HB   ALA  84          HB2       ALA  84 -19.777  19.961  -4.725
  664   3HB   ALA  84          HB3       ALA  84 -21.052  19.299  -5.747
  665    HA   PRO  85           HA       PRO  85 -22.769  24.002  -4.636
  666   1HB   PRO  85          HB2       PRO  85 -21.301  25.272  -2.474
  667   2HB   PRO  85          HB1       PRO  85 -23.050  25.220  -2.699
  668   1HG   PRO  85          HG2       PRO  85 -21.729  23.929  -0.672
  669   2HG   PRO  85          HG1       PRO  85 -23.298  23.417  -1.319
  670   1HD   PRO  85          HD2       PRO  85 -20.564  22.336  -1.884
  671   2HD   PRO  85          HD1       PRO  85 -22.101  21.467  -1.683
  672    H    LYS  86           HN       LYS  86 -21.302  23.513  -6.332
  673    HA   LYS  86           HA       LYS  86 -18.464  23.869  -5.834
  674   1HB   LYS  86          HB2       LYS  86 -19.536  21.952  -7.188
  675   2HB   LYS  86          HB1       LYS  86 -19.693  23.134  -8.479
  676   1HG   LYS  86          HG2       LYS  86 -17.689  21.861  -8.822
  677   2HG   LYS  86          HG1       LYS  86 -17.241  23.509  -8.364
  678   1HD   LYS  86          HD2       LYS  86 -16.956  22.752  -6.029
  679   2HD   LYS  86          HD1       LYS  86 -17.323  21.106  -6.539
  680   1HE   LYS  86          HE2       LYS  86 -15.371  21.177  -8.042
  681   2HE   LYS  86          HE1       LYS  86 -14.995  22.792  -7.444
  682   1HZ   LYS  86          HZ1       LYS  86 -13.671  21.188  -6.271
  683   2HZ   LYS  86          HZ2       LYS  86 -15.018  20.271  -5.871
  684   3HZ   LYS  86          HZ3       LYS  86 -14.808  21.775  -5.175
  685    H    SER  87           HN       SER  87 -21.069  25.705  -6.863
  686    HA   SER  87           HA       SER  87 -19.463  27.391  -8.598
  687   1HB   SER  87          HB2       SER  87 -21.813  26.740  -9.221
  688   2HB   SER  87          HB1       SER  87 -22.389  27.661  -7.839
  689    HG   SER  87           HG       SER  87 -20.925  29.370  -9.039
  690    H    LYS  88           HN       LYS  88 -19.236  27.065  -5.586
  691    HA   LYS  88           HA       LYS  88 -19.557  29.864  -4.805
  692   1HB   LYS  88          HB2       LYS  88 -19.151  27.390  -3.110
  693   2HB   LYS  88          HB1       LYS  88 -19.224  29.028  -2.481
  694   1HG   LYS  88          HG2       LYS  88 -21.434  27.561  -3.899
  695   2HG   LYS  88          HG1       LYS  88 -21.333  27.894  -2.168
  696   1HD   LYS  88          HD2       LYS  88 -21.416  30.290  -2.611
  697   2HD   LYS  88          HD1       LYS  88 -21.472  29.976  -4.348
  698   1HE   LYS  88          HE2       LYS  88 -23.582  28.749  -4.018
  699   2HE   LYS  88          HE1       LYS  88 -23.531  29.167  -2.306
  700   1HZ   LYS  88          HZ1       LYS  88 -23.664  31.499  -2.892
  701   2HZ   LYS  88          HZ2       LYS  88 -24.946  30.673  -3.635
  702   3HZ   LYS  88          HZ3       LYS  88 -23.613  31.125  -4.531
  703    H    ASN  89           HN       ASN  89 -17.774  30.340  -3.051
  704    HA   ASN  89           HA       ASN  89 -15.186  29.726  -4.280
  705   1HB   ASN  89          HB2       ASN  89 -14.360  31.873  -3.417
  706   2HB   ASN  89          HB1       ASN  89 -15.792  32.155  -4.392
  707   1HD2  ASN  89          HD21      ASN  89 -14.408  32.303  -1.244
  708   2HD2  ASN  89          HD22      ASN  89 -15.695  33.119  -0.447
  Start of MODEL   18
    1   1H    GLY   1          HT1       GLY   1 -10.111  17.326   2.244
    2   2H    GLY   1          HT2       GLY   1 -11.629  16.954   1.632
    3   3H    GLY   1          HT3       GLY   1 -10.253  16.664   0.686
    4   1HA   GLY   1          HA1       GLY   1 -11.055  14.606   1.632
    5   2HA   GLY   1          HA2       GLY   1  -9.505  15.038   2.349
    6    H    ASP   2           HN       ASP   2  -9.529  14.489   4.415
    7    HA   ASP   2           HA       ASP   2  -9.940  14.553   6.577
    8   1HB   ASP   2          HB2       ASP   2 -10.887  16.837   6.446
    9   2HB   ASP   2          HB1       ASP   2 -12.448  16.166   5.997
   10    H    GLY   3           HN       GLY   3 -11.010  13.261   8.066
   11   1HA   GLY   3          HA2       GLY   3 -12.432  11.481   8.606
   12   2HA   GLY   3          HA1       GLY   3 -13.032  11.472   6.935
   13    H    GLU   4           HN       GLU   4  -9.772  11.645   8.060
   14    HA   GLU   4           HA       GLU   4  -8.865   9.792   6.105
   15   1HB   GLU   4          HB2       GLU   4  -7.390  10.985   8.450
   16   2HB   GLU   4          HB1       GLU   4  -6.670  10.226   7.039
   17   1HG   GLU   4          HG2       GLU   4  -8.258  12.791   7.073
   18   2HG   GLU   4          HG1       GLU   4  -6.508  12.645   6.901
   19    H    ALA   5           HN       ALA   5  -8.707   7.685   6.305
   20    HA   ALA   5           HA       ALA   5  -8.980   6.475   8.958
   21   1HB   ALA   5          HB1       ALA   5  -9.549   5.338   6.224
   22   2HB   ALA   5          HB2       ALA   5 -10.754   5.916   7.376
   23   3HB   ALA   5          HB3       ALA   5  -9.776   4.498   7.757
   24    H    GLN   6           HN       GLN   6  -7.180   6.440   5.925
   25    HA   GLN   6           HA       GLN   6  -4.948   5.205   7.313
   26   1HB   GLN   6          HB2       GLN   6  -6.288   3.360   6.338
   27   2HB   GLN   6          HB1       GLN   6  -6.103   4.094   4.755
   28   1HG   GLN   6          HG2       GLN   6  -3.713   3.730   4.836
   29   2HG   GLN   6          HG1       GLN   6  -3.848   3.076   6.467
   30   1HE2  GLN   6          HE21      GLN   6  -6.280   1.644   5.963
   31   2HE2  GLN   6          HE22      GLN   6  -5.941   0.328   4.930
   32    H    ARG   7           HN       ARG   7  -3.008   5.742   6.429
   33    HA   ARG   7           HA       ARG   7  -2.963   8.193   4.926
   34   1HB   ARG   7          HB2       ARG   7  -0.515   8.082   5.221
   35   2HB   ARG   7          HB1       ARG   7  -1.416   7.956   6.728
   36   1HG   ARG   7          HG2       ARG   7  -1.009   5.622   6.871
   37   2HG   ARG   7          HG1       ARG   7  -0.364   5.571   5.232
   38   1HD   ARG   7          HD2       ARG   7   1.389   5.473   6.941
   39   2HD   ARG   7          HD1       ARG   7   1.537   6.879   5.899
   40    HE   ARG   7           HE       ARG   7   0.084   7.595   8.180
   41   1HH1  ARG   7          HH11      ARG   7   3.292   6.314   7.496
   42   2HH1  ARG   7          HH12      ARG   7   4.146   7.323   8.543
   43   1HH2  ARG   7          HH21      ARG   7   1.255   9.037   9.743
   44   2HH2  ARG   7          HH22      ARG   7   2.965   8.993   9.784
   45    H    ASP   8           HN       ASP   8  -3.419   5.280   3.672
   46    HA   ASP   8           HA       ASP   8  -3.210   4.366   1.583
   47   1HB   ASP   8          HB2       ASP   8  -3.209   6.734   0.650
   48   2HB   ASP   8          HB1       ASP   8  -1.475   6.793   0.881
   49    H    LEU   9           HN       LEU   9  -1.062   3.767   0.034
   50    HA   LEU   9           HA       LEU   9   0.788   2.776   2.067
   51   1HB   LEU   9          HB2       LEU   9  -0.108   1.372  -0.435
   52   2HB   LEU   9          HB1       LEU   9   1.198   0.815   0.590
   53    HG   LEU   9           HG       LEU   9  -1.705   1.047   1.370
   54   1HD1  LEU   9          HD11      LEU   9   0.076  -1.350   0.941
   55   2HD1  LEU   9          HD12      LEU   9  -1.230  -0.822  -0.119
   56   3HD1  LEU   9          HD13      LEU   9  -1.592  -1.394   1.512
   57   1HD2  LEU   9          HD21      LEU   9  -0.247   1.559   3.238
   58   2HD2  LEU   9          HD22      LEU   9   0.669   0.078   2.952
   59   3HD2  LEU   9          HD23      LEU   9  -1.019  -0.012   3.467
   60    H    VAL  10           HN       VAL  10   0.530   4.333  -1.042
   61    HA   VAL  10           HA       VAL  10   3.404   4.188  -1.448
   62    HB   VAL  10           HB       VAL  10   1.238   5.779  -2.894
   63   1HG1  VAL  10          HG11      VAL  10   3.360   7.053  -2.930
   64   2HG1  VAL  10          HG12      VAL  10   2.957   6.422  -4.528
   65   3HG1  VAL  10          HG13      VAL  10   4.194   5.628  -3.551
   66   1HG2  VAL  10          HG21      VAL  10   1.246   3.406  -3.315
   67   2HG2  VAL  10          HG22      VAL  10   2.964   3.472  -3.713
   68   3HG2  VAL  10          HG23      VAL  10   1.787   4.296  -4.737
   69    H    LYS  11           HN       LYS  11   1.001   6.229  -0.184
   70    HA   LYS  11           HA       LYS  11   2.801   8.398   0.383
   71   1HB   LYS  11          HB2       LYS  11  -0.037   7.817   1.182
   72   2HB   LYS  11          HB1       LYS  11   0.787   9.282   1.685
   73   1HG   LYS  11          HG2       LYS  11  -0.757   9.725  -0.181
   74   2HG   LYS  11          HG1       LYS  11   0.903  10.003  -0.686
   75   1HD   LYS  11          HD2       LYS  11   0.941   7.942  -1.918
   76   2HD   LYS  11          HD1       LYS  11  -0.591   7.434  -1.223
   77   1HE   LYS  11          HE2       LYS  11  -0.325   9.891  -2.940
   78   2HE   LYS  11          HE1       LYS  11  -0.609   8.293  -3.621
   79   1HZ   LYS  11          HZ1       LYS  11  -2.424   9.605  -1.632
   80   2HZ   LYS  11          HZ2       LYS  11  -2.706   8.161  -2.492
   81   3HZ   LYS  11          HZ3       LYS  11  -2.640   9.613  -3.297
   82    H    ALA  12           HN       ALA  12   2.888   5.499   1.485
   83    HA   ALA  12           HA       ALA  12   3.555   6.207   4.253
   84   1HB   ALA  12          HB1       ALA  12   1.519   4.843   4.224
   85   2HB   ALA  12          HB2       ALA  12   2.866   3.952   4.938
   86   3HB   ALA  12          HB3       ALA  12   2.356   3.606   3.286
   87    H    VAL  13           HN       VAL  13   3.969   3.423   2.037
   88    HA   VAL  13           HA       VAL  13   6.530   2.726   2.996
   89    HB   VAL  13           HB       VAL  13   5.169   1.978   0.387
   90   1HG1  VAL  13          HG11      VAL  13   7.565   0.720   1.724
   91   2HG1  VAL  13          HG12      VAL  13   7.562   1.649   0.219
   92   3HG1  VAL  13          HG13      VAL  13   6.737   0.090   0.295
   93   1HG2  VAL  13          HG21      VAL  13   5.353   0.498   3.014
   94   2HG2  VAL  13          HG22      VAL  13   4.615  -0.121   1.534
   95   3HG2  VAL  13          HG23      VAL  13   3.915   1.276   2.354
   96    H    ALA  14           HN       ALA  14   5.519   4.355  -0.016
   97    HA   ALA  14           HA       ALA  14   8.181   4.854  -0.808
   98   1HB   ALA  14          HB1       ALA  14   6.340   4.858  -2.470
   99   2HB   ALA  14          HB2       ALA  14   7.183   6.411  -2.514
  100   3HB   ALA  14          HB3       ALA  14   5.627   6.257  -1.694
  101    H    HIS  15           HN       HIS  15   5.950   6.424   1.285
  102    HA   HIS  15           HA       HIS  15   7.216   8.952   1.450
  103   1HB   HIS  15          HB2       HIS  15   4.898   8.497   2.264
  104   2HB   HIS  15          HB1       HIS  15   5.584   7.576   3.593
  105    HD1  HIS  15           HD1      HIS  15   6.159   8.882   5.686
  106    HD2  HIS  15           HD2      HIS  15   5.547  11.324   2.376
  107    HE1  HIS  15           HE1      HIS  15   6.144  11.210   6.564
  108    HE2  HIS  15           HE2      HIS  15   5.353  12.569   4.604
  109    H    ILE  16           HN       ILE  16   7.845   5.867   3.022
  110    HA   ILE  16           HA       ILE  16   9.665   6.730   4.997
  111    HB   ILE  16           HB       ILE  16   9.716   4.126   3.417
  112   1HG1  ILE  16          HG12      ILE  16   7.577   4.448   4.593
  113   2HG1  ILE  16          HG11      ILE  16   8.501   3.118   5.280
  114   1HG2  ILE  16          HG21      ILE  16  11.840   4.510   4.526
  115   2HG2  ILE  16          HG22      ILE  16  10.972   3.184   5.298
  116   3HG2  ILE  16          HG23      ILE  16  11.011   4.772   6.063
  117   1HD1  ILE  16          HD11      ILE  16   9.195   4.568   7.124
  118   2HD1  ILE  16          HD12      ILE  16   7.440   4.444   7.007
  119   3HD1  ILE  16          HD13      ILE  16   8.263   5.893   6.424
  120    H    LEU  17           HN       LEU  17  10.106   5.754   1.652
  121    HA   LEU  17           HA       LEU  17  12.911   6.251   1.576
  122   1HB   LEU  17          HB2       LEU  17  10.891   6.012  -0.654
  123   2HB   LEU  17          HB1       LEU  17  12.626   6.063  -0.885
  124    HG   LEU  17           HG       LEU  17  11.174   3.898   0.650
  125   1HD1  LEU  17          HD11      LEU  17  12.312   3.863  -2.141
  126   2HD1  LEU  17          HD12      LEU  17  10.599   3.843  -1.723
  127   3HD1  LEU  17          HD13      LEU  17  11.630   2.482  -1.279
  128   1HD2  LEU  17          HD21      LEU  17  14.023   4.117  -0.308
  129   2HD2  LEU  17          HD22      LEU  17  13.307   2.722   0.503
  130   3HD2  LEU  17          HD23      LEU  17  13.482   4.249   1.366
  131    H    GLY  18           HN       GLY  18  10.076   8.134   1.009
  132   1HA   GLY  18          HA2       GLY  18  10.134  10.524   1.385
  133   2HA   GLY  18          HA1       GLY  18  11.758  10.538   0.708
  134    H    ILE  19           HN       ILE  19   9.133   8.721  -0.689
  135    HA   ILE  19           HA       ILE  19   9.121  10.565  -2.929
  136    HB   ILE  19           HB       ILE  19   8.645   8.381  -4.251
  137   1HG1  ILE  19          HG12      ILE  19  10.354   7.337  -1.991
  138   2HG1  ILE  19          HG11      ILE  19   8.709   6.852  -2.369
  139   1HG2  ILE  19          HG21      ILE  19  10.468   9.929  -4.716
  140   2HG2  ILE  19          HG22      ILE  19  11.066   8.272  -4.820
  141   3HG2  ILE  19          HG23      ILE  19  11.417   9.248  -3.393
  142   1HD1  ILE  19          HD11      ILE  19  10.296   5.180  -3.102
  143   2HD1  ILE  19          HD12      ILE  19  11.149   6.380  -4.069
  144   3HD1  ILE  19          HD13      ILE  19   9.505   5.911  -4.499
  145    H    ARG  20           HN       ARG  20   7.377  10.633  -4.200
  146    HA   ARG  20           HA       ARG  20   4.972   9.180  -3.933
  147   1HB   ARG  20          HB2       ARG  20   4.557  10.471  -1.912
  148   2HB   ARG  20          HB1       ARG  20   5.017  11.946  -2.756
  149   1HG   ARG  20          HG2       ARG  20   2.723  10.460  -3.859
  150   2HG   ARG  20          HG1       ARG  20   2.426  11.270  -2.301
  151   1HD   ARG  20          HD2       ARG  20   3.325  13.383  -3.431
  152   2HD   ARG  20          HD1       ARG  20   3.303  12.487  -4.945
  153    HE   ARG  20           HE       ARG  20   0.774  12.294  -3.821
  154   1HH1  ARG  20          HH11      ARG  20   2.789  14.784  -5.440
  155   2HH1  ARG  20          HH12      ARG  20   1.470  15.839  -5.646
  156   1HH2  ARG  20          HH21      ARG  20  -0.978  13.794  -4.175
  157   2HH2  ARG  20          HH22      ARG  20  -0.711  15.299  -4.921
  158    H    ASP  21           HN       ASP  21   6.704  11.977  -5.049
  159    HA   ASP  21           HA       ASP  21   4.936  12.147  -7.379
  160   1HB   ASP  21          HB2       ASP  21   7.274  13.880  -6.558
  161   2HB   ASP  21          HB1       ASP  21   6.276  14.128  -7.989
  162    H    LEU  22           HN       LEU  22   8.007  11.098  -6.358
  163    HA   LEU  22           HA       LEU  22   9.587   9.827  -7.299
  164   1HB   LEU  22          HB2       LEU  22   7.447   9.114  -9.338
  165   2HB   LEU  22          HB1       LEU  22   8.989   8.313  -9.202
  166    HG   LEU  22           HG       LEU  22   7.389   6.871  -8.281
  167   1HD1  LEU  22          HD11      LEU  22   9.348   6.826  -7.048
  168   2HD1  LEU  22          HD12      LEU  22   7.992   6.667  -5.928
  169   3HD1  LEU  22          HD13      LEU  22   8.849   8.206  -6.077
  170   1HD2  LEU  22          HD21      LEU  22   5.544   8.395  -7.904
  171   2HD2  LEU  22          HD22      LEU  22   6.378   9.093  -6.513
  172   3HD2  LEU  22          HD23      LEU  22   5.850   7.418  -6.471
  173    H    ALA  23           HN       ALA  23  10.700  11.733  -7.719
  174    HA   ALA  23           HA       ALA  23  10.258  13.102 -10.148
  175   1HB   ALA  23          HB1       ALA  23  12.138  14.532  -9.459
  176   2HB   ALA  23          HB2       ALA  23  12.492  13.409  -8.147
  177   3HB   ALA  23          HB3       ALA  23  10.973  14.303  -8.157
  178    H    GLY  24           HN       GLY  24  12.190  10.640  -9.047
  179   1HA   GLY  24          HA2       GLY  24  13.095   9.959 -11.669
  180   2HA   GLY  24          HA1       GLY  24  14.424  10.506 -10.637
  181    H    ILE  25           HN       ILE  25  11.533   8.516 -10.191
  182    HA   ILE  25           HA       ILE  25  13.229   6.340  -9.246
  183    HB   ILE  25           HB       ILE  25  10.686   7.345  -7.920
  184   1HG1  ILE  25          HG12      ILE  25  12.682   8.728  -7.375
  185   2HG1  ILE  25          HG11      ILE  25  11.995   7.927  -5.970
  186   1HG2  ILE  25          HG21      ILE  25  11.052   5.612  -6.201
  187   2HG2  ILE  25          HG22      ILE  25  12.420   5.001  -7.131
  188   3HG2  ILE  25          HG23      ILE  25  10.794   4.921  -7.805
  189   1HD1  ILE  25          HD11      ILE  25  13.762   6.259  -6.060
  190   2HD1  ILE  25          HD12      ILE  25  14.414   7.890  -5.914
  191   3HD1  ILE  25          HD13      ILE  25  14.458   7.056  -7.476
  192    H    ASN  26           HN       ASN  26  12.264   4.298  -9.709
  193    HA   ASN  26           HA       ASN  26  10.507   4.288 -11.975
  194   1HB   ASN  26          HB2       ASN  26  11.790   2.115 -10.349
  195   2HB   ASN  26          HB1       ASN  26  10.620   1.767 -11.604
  196   1HD2  ASN  26          HD21      ASN  26  12.139   0.601 -12.650
  197   2HD2  ASN  26          HD22      ASN  26  13.427   1.279 -13.580
  198    H    LEU  27           HN       LEU  27   8.573   3.112 -12.089
  199    HA   LEU  27           HA       LEU  27   7.010   3.137  -9.588
  200   1HB   LEU  27          HB2       LEU  27   6.051   3.349 -12.439
  201   2HB   LEU  27          HB1       LEU  27   5.064   3.478 -10.998
  202    HG   LEU  27           HG       LEU  27   7.214   5.424 -11.823
  203   1HD1  LEU  27          HD11      LEU  27   4.218   5.672 -11.852
  204   2HD1  LEU  27          HD12      LEU  27   5.274   5.525 -13.265
  205   3HD1  LEU  27          HD13      LEU  27   5.386   6.941 -12.226
  206   1HD2  LEU  27          HD21      LEU  27   6.981   5.258  -9.414
  207   2HD2  LEU  27          HD22      LEU  27   5.241   5.506  -9.559
  208   3HD2  LEU  27          HD23      LEU  27   6.360   6.795 -10.009
  209    H    ASP  28           HN       ASP  28   7.903   1.431 -12.496
  210    HA   ASP  28           HA       ASP  28   6.189  -0.837 -11.914
  211   1HB   ASP  28          HB2       ASP  28   7.953  -0.156 -14.249
  212   2HB   ASP  28          HB1       ASP  28   7.237  -1.750 -14.058
  213    H    SER  29           HN       SER  29   8.823  -0.013 -10.515
  214    HA   SER  29           HA       SER  29  10.205  -2.548 -10.769
  215   1HB   SER  29          HB2       SER  29  10.805  -0.118  -9.083
  216   2HB   SER  29          HB1       SER  29  11.784  -1.586  -9.116
  217    HG   SER  29           HG       SER  29  12.735  -0.684 -10.698
  218    H    SER  30           HN       SER  30   9.996  -4.168  -9.456
  219    HA   SER  30           HA       SER  30   7.937  -4.180  -7.484
  220   1HB   SER  30          HB2       SER  30  10.107  -6.140  -8.219
  221   2HB   SER  30          HB1       SER  30   8.833  -6.510  -7.075
  222    HG   SER  30           HG       SER  30   8.288  -5.625  -9.728
  223    H    LEU  31           HN       LEU  31   8.248  -4.328  -5.238
  224    HA   LEU  31           HA       LEU  31  10.468  -2.861  -4.296
  225   1HB   LEU  31          HB2       LEU  31   8.236  -4.233  -2.746
  226   2HB   LEU  31          HB1       LEU  31   9.608  -3.485  -2.008
  227    HG   LEU  31           HG       LEU  31   9.011  -1.288  -2.708
  228   1HD1  LEU  31          HD11      LEU  31   7.088  -0.760  -4.091
  229   2HD1  LEU  31          HD12      LEU  31   6.793  -2.482  -4.339
  230   3HD1  LEU  31          HD13      LEU  31   8.263  -1.739  -4.969
  231   1HD2  LEU  31          HD21      LEU  31   6.529  -2.729  -1.820
  232   2HD2  LEU  31          HD22      LEU  31   6.793  -0.988  -1.735
  233   3HD2  LEU  31          HD23      LEU  31   7.798  -2.080  -0.781
  234    H    ALA  32           HN       ALA  32  10.214  -6.060  -5.035
  235    HA   ALA  32           HA       ALA  32  12.105  -7.115  -3.243
  236   1HB   ALA  32          HB1       ALA  32  12.181  -9.037  -4.690
  237   2HB   ALA  32          HB2       ALA  32  11.625  -8.070  -6.041
  238   3HB   ALA  32          HB3       ALA  32  10.503  -8.448  -4.756
  239    H    ASP  33           HN       ASP  33  12.205  -5.526  -6.308
  240    HA   ASP  33           HA       ASP  33  14.876  -6.045  -7.062
  241   1HB   ASP  33          HB2       ASP  33  13.053  -5.213  -8.584
  242   2HB   ASP  33          HB1       ASP  33  13.158  -3.654  -7.784
  243    H    LEU  34           HN       LEU  34  13.208  -3.626  -5.326
  244    HA   LEU  34           HA       LEU  34  15.337  -1.826  -4.769
  245   1HB   LEU  34          HB2       LEU  34  12.910  -2.299  -3.063
  246   2HB   LEU  34          HB1       LEU  34  13.809  -0.811  -3.282
  247    HG   LEU  34           HG       LEU  34  12.055  -2.120  -5.349
  248   1HD1  LEU  34          HD11      LEU  34  11.594   0.275  -3.611
  249   2HD1  LEU  34          HD12      LEU  34  10.804  -1.310  -3.541
  250   3HD1  LEU  34          HD13      LEU  34  10.542  -0.262  -4.938
  251   1HD2  LEU  34          HD21      LEU  34  12.318  -0.074  -6.629
  252   2HD2  LEU  34          HD22      LEU  34  13.883  -0.840  -6.366
  253   3HD2  LEU  34          HD23      LEU  34  13.421   0.579  -5.412
  254    H    GLY  35           HN       GLY  35  13.571  -4.165  -2.732
  255   1HA   GLY  35          HA2       GLY  35  14.699  -5.867  -1.494
  256   2HA   GLY  35          HA1       GLY  35  16.094  -4.804  -1.386
  257    H    LEU  36           HN       LEU  36  12.772  -5.216  -0.303
  258    HA   LEU  36           HA       LEU  36  13.490  -3.634   2.076
  259   1HB   LEU  36          HB2       LEU  36  11.092  -3.360   2.541
  260   2HB   LEU  36          HB1       LEU  36  11.482  -2.809   0.935
  261    HG   LEU  36           HG       LEU  36  10.611  -5.030   0.146
  262   1HD1  LEU  36          HD11      LEU  36   8.886  -6.124   1.539
  263   2HD1  LEU  36          HD12      LEU  36   9.365  -5.101   2.892
  264   3HD1  LEU  36          HD13      LEU  36  10.504  -6.273   2.231
  265   1HD2  LEU  36          HD21      LEU  36   8.680  -3.176   1.464
  266   2HD2  LEU  36          HD22      LEU  36   8.359  -4.233   0.078
  267   3HD2  LEU  36          HD23      LEU  36   9.487  -2.878  -0.067
  268    H    ASP  37           HN       ASP  37  12.731  -4.369   4.080
  269    HA   ASP  37           HA       ASP  37  11.562  -6.805   4.764
  270   1HB   ASP  37          HB2       ASP  37  13.596  -7.866   3.774
  271   2HB   ASP  37          HB1       ASP  37  14.599  -6.942   4.881
  272    H    SER  38           HN       SER  38  13.838  -4.335   5.367
  273    HA   SER  38           HA       SER  38  14.122  -4.881   8.158
  274   1HB   SER  38          HB2       SER  38  15.031  -2.452   6.623
  275   2HB   SER  38          HB1       SER  38  15.577  -2.928   8.238
  276    HG   SER  38           HG       SER  38  16.808  -3.646   6.174
  277    H    LEU  39           HN       LEU  39  13.053  -1.702   6.939
  278    HA   LEU  39           HA       LEU  39  11.184  -1.701   9.211
  279   1HB   LEU  39          HB2       LEU  39  12.693   0.247   9.124
  280   2HB   LEU  39          HB1       LEU  39  12.089   0.640   7.520
  281    HG   LEU  39           HG       LEU  39   9.801   0.832   8.546
  282   1HD1  LEU  39          HD11      LEU  39   9.647   1.256  10.943
  283   2HD1  LEU  39          HD12      LEU  39  11.334   0.776  11.122
  284   3HD1  LEU  39          HD13      LEU  39  10.141  -0.395  10.564
  285   1HD2  LEU  39          HD21      LEU  39  11.081   2.795   7.931
  286   2HD2  LEU  39          HD22      LEU  39  11.893   2.779   9.506
  287   3HD2  LEU  39          HD23      LEU  39  10.150   3.067   9.404
  288    H    MET  40           HN       MET  40  11.512  -1.135   5.781
  289    HA   MET  40           HA       MET  40   8.801  -0.504   5.287
  290   1HB   MET  40          HB2       MET  40  11.006  -1.465   3.485
  291   2HB   MET  40          HB1       MET  40   9.421  -1.026   2.886
  292   1HG   MET  40          HG2       MET  40   9.767   1.252   3.800
  293   2HG   MET  40          HG1       MET  40  11.386   0.766   4.300
  294   1HE   MET  40          HE1       MET  40  13.315   0.058   2.559
  295   2HE   MET  40          HE2       MET  40  13.084   0.042   0.811
  296   3HE   MET  40          HE3       MET  40  12.224  -1.118   1.826
  297    H    GLY  41           HN       GLY  41  10.384  -3.390   5.959
  298   1HA   GLY  41          HA2       GLY  41   8.368  -5.020   4.640
  299   2HA   GLY  41          HA1       GLY  41   9.777  -5.616   5.518
  300    H    VAL  42           HN       VAL  42   8.812  -3.485   7.645
  301    HA   VAL  42           HA       VAL  42   6.990  -5.412   8.931
  302    HB   VAL  42           HB       VAL  42   8.759  -3.357  10.267
  303   1HG1  VAL  42          HG11      VAL  42   6.820  -3.953  11.605
  304   2HG1  VAL  42          HG12      VAL  42   8.286  -4.605  12.339
  305   3HG1  VAL  42          HG13      VAL  42   7.205  -5.667  11.437
  306   1HG2  VAL  42          HG21      VAL  42  10.189  -5.240  10.973
  307   2HG2  VAL  42          HG22      VAL  42  10.183  -4.983   9.233
  308   3HG2  VAL  42          HG23      VAL  42   9.247  -6.312   9.930
  309    H    GLU  43           HN       GLU  43   7.617  -1.904   8.562
  310    HA   GLU  43           HA       GLU  43   5.293  -1.190   9.940
  311   1HB   GLU  43          HB2       GLU  43   7.159   0.397   9.470
  312   2HB   GLU  43          HB1       GLU  43   6.654   0.440   7.782
  313   1HG   GLU  43          HG2       GLU  43   4.518   1.377   8.400
  314   2HG   GLU  43          HG1       GLU  43   4.917   1.233  10.106
  315    H    VAL  44           HN       VAL  44   5.881  -2.133   6.648
  316    HA   VAL  44           HA       VAL  44   3.482  -1.345   5.444
  317    HB   VAL  44           HB       VAL  44   5.529  -2.350   4.267
  318   1HG1  VAL  44          HG11      VAL  44   5.957  -4.268   5.555
  319   2HG1  VAL  44          HG12      VAL  44   5.653  -4.721   3.877
  320   3HG1  VAL  44          HG13      VAL  44   4.405  -4.971   5.099
  321   1HG2  VAL  44          HG21      VAL  44   3.481  -1.908   3.060
  322   2HG2  VAL  44          HG22      VAL  44   2.855  -3.488   3.570
  323   3HG2  VAL  44          HG23      VAL  44   4.244  -3.401   2.483
  324    H    ARG  45           HN       ARG  45   4.319  -4.085   7.395
  325    HA   ARG  45           HA       ARG  45   1.862  -5.456   6.946
  326   1HB   ARG  45          HB2       ARG  45   4.281  -5.926   8.595
  327   2HB   ARG  45          HB1       ARG  45   2.906  -6.988   8.751
  328   1HG   ARG  45          HG2       ARG  45   3.058  -7.408   6.302
  329   2HG   ARG  45          HG1       ARG  45   4.541  -6.446   6.292
  330   1HD   ARG  45          HD2       ARG  45   4.057  -8.902   7.945
  331   2HD   ARG  45          HD1       ARG  45   4.972  -8.851   6.438
  332    HE   ARG  45           HE       ARG  45   6.556  -7.446   7.506
  333   1HH1  ARG  45          HH11      ARG  45   4.139  -8.737   9.787
  334   2HH1  ARG  45          HH12      ARG  45   5.253  -8.974  11.051
  335   1HH2  ARG  45          HH21      ARG  45   8.142  -7.878   9.349
  336   2HH2  ARG  45          HH22      ARG  45   7.469  -8.451  10.817
  337    H    GLN  46           HN       GLN  46   3.209  -3.315   9.287
  338    HA   GLN  46           HA       GLN  46   1.189  -3.834  11.232
  339   1HB   GLN  46          HB2       GLN  46   2.947  -1.376  10.916
  340   2HB   GLN  46          HB1       GLN  46   2.009  -1.784  12.345
  341   1HG   GLN  46          HG2       GLN  46   3.379  -3.752  12.705
  342   2HG   GLN  46          HG1       GLN  46   4.279  -3.411  11.231
  343   1HE2  GLN  46          HE21      GLN  46   4.238  -0.474  11.834
  344   2HE2  GLN  46          HE22      GLN  46   5.437  -0.268  13.040
  345    H    ILE  47           HN       ILE  47   1.234  -2.265   8.312
  346    HA   ILE  47           HA       ILE  47  -1.239  -0.824   8.882
  347    HB   ILE  47           HB       ILE  47   0.322  -1.001   6.272
  348   1HG1  ILE  47          HG12      ILE  47   0.187   1.263   8.266
  349   2HG1  ILE  47          HG11      ILE  47   1.555   0.161   8.102
  350   1HG2  ILE  47          HG21      ILE  47  -1.953   0.804   7.109
  351   2HG2  ILE  47          HG22      ILE  47  -2.054  -0.522   5.950
  352   3HG2  ILE  47          HG23      ILE  47  -1.078   0.901   5.579
  353   1HD1  ILE  47          HD11      ILE  47   1.912   0.972   5.820
  354   2HD1  ILE  47          HD12      ILE  47   1.997   2.280   7.000
  355   3HD1  ILE  47          HD13      ILE  47   0.554   2.084   6.004
  356    H    LEU  48           HN       LEU  48   0.072  -3.307   6.676
  357    HA   LEU  48           HA       LEU  48  -2.367  -4.044   5.532
  358   1HB   LEU  48          HB2       LEU  48   0.129  -5.693   5.847
  359   2HB   LEU  48          HB1       LEU  48  -1.231  -6.124   4.831
  360    HG   LEU  48           HG       LEU  48   0.568  -3.740   4.479
  361   1HD1  LEU  48          HD11      LEU  48   1.634  -5.826   3.881
  362   2HD1  LEU  48          HD12      LEU  48   1.280  -4.873   2.442
  363   3HD1  LEU  48          HD13      LEU  48   0.264  -6.254   2.859
  364   1HD2  LEU  48          HD21      LEU  48  -0.654  -3.366   2.390
  365   2HD2  LEU  48          HD22      LEU  48  -1.692  -3.204   3.804
  366   3HD2  LEU  48          HD23      LEU  48  -1.774  -4.665   2.814
  367    H    GLU  49           HN       GLU  49  -0.618  -5.762   8.141
  368    HA   GLU  49           HA       GLU  49  -2.599  -7.736   8.425
  369   1HB   GLU  49          HB2       GLU  49  -0.390  -6.926  10.322
  370   2HB   GLU  49          HB1       GLU  49  -1.383  -8.358  10.505
  371   1HG   GLU  49          HG2       GLU  49  -0.488  -9.212   8.358
  372   2HG   GLU  49          HG1       GLU  49   0.548  -7.790   8.255
  373    H    ARG  50           HN       ARG  50  -1.949  -4.765  10.027
  374    HA   ARG  50           HA       ARG  50  -3.786  -5.173  12.184
  375   1HB   ARG  50          HB2       ARG  50  -1.766  -3.852  12.413
  376   2HB   ARG  50          HB1       ARG  50  -2.367  -2.703  11.235
  377   1HG   ARG  50          HG2       ARG  50  -4.206  -2.139  12.759
  378   2HG   ARG  50          HG1       ARG  50  -3.527  -3.259  13.946
  379   1HD   ARG  50          HD2       ARG  50  -1.423  -1.971  13.907
  380   2HD   ARG  50          HD1       ARG  50  -2.174  -0.824  12.798
  381    HE   ARG  50           HE       ARG  50  -3.882  -0.839  14.822
  382   1HH1  ARG  50          HH11      ARG  50  -0.402  -0.194  14.582
  383   2HH1  ARG  50          HH12      ARG  50  -0.277   0.594  16.076
  384   1HH2  ARG  50          HH21      ARG  50  -3.716   0.222  16.920
  385   2HH2  ARG  50          HH22      ARG  50  -2.191   0.751  17.503
  386    H    GLU  51           HN       GLU  51  -3.792  -2.818   9.489
  387    HA   GLU  51           HA       GLU  51  -6.467  -1.941  10.122
  388   1HB   GLU  51          HB2       GLU  51  -4.704  -1.352   7.791
  389   2HB   GLU  51          HB1       GLU  51  -6.176  -0.497   8.182
  390   1HG   GLU  51          HG2       GLU  51  -3.795  -0.557  10.035
  391   2HG   GLU  51          HG1       GLU  51  -4.119   0.743   8.889
  392    H    HIS  52           HN       HIS  52  -4.906  -3.617   7.439
  393    HA   HIS  52           HA       HIS  52  -7.416  -3.747   5.963
  394   1HB   HIS  52          HB2       HIS  52  -4.800  -5.118   5.166
  395   2HB   HIS  52          HB1       HIS  52  -6.236  -4.810   4.201
  396    HD1  HIS  52           HD1      HIS  52  -5.557  -3.357   2.393
  397    HD2  HIS  52           HD2      HIS  52  -4.016  -2.109   6.050
  398    HE1  HIS  52           HE1      HIS  52  -4.227  -1.322   1.899
  399    HE2  HIS  52           HE2      HIS  52  -3.671  -0.395   4.132
  400    H    ASP  53           HN       ASP  53  -5.503  -5.729   8.011
  401    HA   ASP  53           HA       ASP  53  -5.723  -7.716   9.003
  402   1HB   ASP  53          HB2       ASP  53  -8.203  -7.294   9.134
  403   2HB   ASP  53          HB1       ASP  53  -8.389  -8.040   7.554
  404    H    LEU  54           HN       LEU  54  -4.553  -7.172   6.474
  405    HA   LEU  54           HA       LEU  54  -4.604  -9.784   5.125
  406   1HB   LEU  54          HB2       LEU  54  -3.810  -7.043   4.242
  407   2HB   LEU  54          HB1       LEU  54  -3.087  -8.417   3.452
  408    HG   LEU  54           HG       LEU  54  -5.320  -9.148   2.711
  409   1HD1  LEU  54          HD11      LEU  54  -7.191  -7.421   2.939
  410   2HD1  LEU  54          HD12      LEU  54  -6.214  -6.785   4.299
  411   3HD1  LEU  54          HD13      LEU  54  -6.792  -8.422   4.328
  412   1HD2  LEU  54          HD21      LEU  54  -4.004  -7.722   1.266
  413   2HD2  LEU  54          HD22      LEU  54  -4.669  -6.285   2.042
  414   3HD2  LEU  54          HD23      LEU  54  -5.721  -7.344   1.103
  415    H    VAL  55           HN       VAL  55  -3.198 -11.079   6.080
  416    HA   VAL  55           HA       VAL  55  -0.714 -10.052   7.093
  417    HB   VAL  55           HB       VAL  55  -1.573 -12.955   6.803
  418   1HG1  VAL  55          HG11      VAL  55   0.170 -13.431   8.460
  419   2HG1  VAL  55          HG12      VAL  55   0.643 -11.734   8.446
  420   3HG1  VAL  55          HG13      VAL  55   0.842 -12.717   6.994
  421   1HG2  VAL  55          HG21      VAL  55  -2.109 -12.855   9.197
  422   2HG2  VAL  55          HG22      VAL  55  -3.096 -11.727   8.264
  423   3HG2  VAL  55          HG23      VAL  55  -1.730 -11.133   9.206
  424    H    LEU  56           HN       LEU  56   0.132  -9.163   5.268
  425    HA   LEU  56           HA       LEU  56   1.091 -11.067   3.249
  426   1HB   LEU  56          HB2       LEU  56   0.855  -8.084   3.048
  427   2HB   LEU  56          HB1       LEU  56   1.389  -9.148   1.774
  428    HG   LEU  56           HG       LEU  56  -1.413  -9.081   2.911
  429   1HD1  LEU  56          HD11      LEU  56  -0.900  -7.122   1.572
  430   2HD1  LEU  56          HD12      LEU  56  -2.034  -8.182   0.737
  431   3HD1  LEU  56          HD13      LEU  56  -0.335  -8.154   0.259
  432   1HD2  LEU  56          HD21      LEU  56  -0.253 -10.671   0.624
  433   2HD2  LEU  56          HD22      LEU  56  -1.959 -10.606   1.077
  434   3HD2  LEU  56          HD23      LEU  56  -0.779 -11.319   2.179
  435    HA   PRO  57           HA       PRO  57   4.852 -10.027   5.523
  436   1HB   PRO  57          HB2       PRO  57   5.767 -12.551   4.372
  437   2HB   PRO  57          HB1       PRO  57   5.584 -12.123   6.080
  438   1HG   PRO  57          HG2       PRO  57   3.967 -13.909   4.890
  439   2HG   PRO  57          HG1       PRO  57   3.350 -12.781   6.116
  440   1HD   PRO  57          HD2       PRO  57   3.220 -12.598   3.130
  441   2HD   PRO  57          HD1       PRO  57   1.925 -12.364   4.331
  442    H    ILE  58           HN       ILE  58   7.290 -10.644   4.604
  443    HA   ILE  58           HA       ILE  58   7.731  -8.863   2.486
  444    HB   ILE  58           HB       ILE  58   9.465 -10.825   3.976
  445   1HG1  ILE  58          HG12      ILE  58  10.789  -8.761   4.498
  446   2HG1  ILE  58          HG11      ILE  58   9.586  -7.840   3.611
  447   1HG2  ILE  58          HG21      ILE  58  10.471  -9.319   1.585
  448   2HG2  ILE  58          HG22      ILE  58  10.331 -11.069   1.752
  449   3HG2  ILE  58          HG23      ILE  58  11.473 -10.174   2.757
  450   1HD1  ILE  58          HD11      ILE  58   9.101  -9.458   6.100
  451   2HD1  ILE  58          HD12      ILE  58   7.888  -8.527   5.220
  452   3HD1  ILE  58          HD13      ILE  58   9.235  -7.704   6.007
  453    H    ARG  59           HN       ARG  59   7.095 -12.181   2.576
  454    HA   ARG  59           HA       ARG  59   8.040 -12.964   0.023
  455   1HB   ARG  59          HB2       ARG  59   5.758 -14.220   1.574
  456   2HB   ARG  59          HB1       ARG  59   6.606 -14.949   0.227
  457   1HG   ARG  59          HG2       ARG  59   7.601 -16.025   1.994
  458   2HG   ARG  59          HG1       ARG  59   8.702 -14.663   1.796
  459   1HD   ARG  59          HD2       ARG  59   7.427 -13.461   3.580
  460   2HD   ARG  59          HD1       ARG  59   6.463 -14.917   3.807
  461    HE   ARG  59           HE       ARG  59   9.372 -14.934   4.156
  462   1HH1  ARG  59          HH11      ARG  59   6.123 -15.614   5.465
  463   2HH1  ARG  59          HH12      ARG  59   6.717 -16.185   6.956
  464   1HH2  ARG  59          HH21      ARG  59  10.147 -15.751   6.202
  465   2HH2  ARG  59          HH22      ARG  59   9.033 -16.198   7.395
  466    H    GLU  60           HN       GLU  60   5.270 -11.172   0.998
  467    HA   GLU  60           HA       GLU  60   4.019 -11.521  -1.635
  468   1HB   GLU  60          HB2       GLU  60   2.922 -10.364   0.928
  469   2HB   GLU  60          HB1       GLU  60   2.056 -10.406  -0.597
  470   1HG   GLU  60          HG2       GLU  60   2.980 -12.799   0.976
  471   2HG   GLU  60          HG1       GLU  60   1.332 -12.179   0.897
  472    H    VAL  61           HN       VAL  61   4.957  -9.059   0.727
  473    HA   VAL  61           HA       VAL  61   4.234  -6.820  -0.763
  474    HB   VAL  61           HB       VAL  61   6.376  -7.001   1.381
  475   1HG1  VAL  61          HG11      VAL  61   5.956  -4.610   1.749
  476   2HG1  VAL  61          HG12      VAL  61   4.839  -4.596   0.385
  477   3HG1  VAL  61          HG13      VAL  61   6.553  -4.914   0.119
  478   1HG2  VAL  61          HG21      VAL  61   3.439  -6.364   1.584
  479   2HG2  VAL  61          HG22      VAL  61   4.599  -6.268   2.907
  480   3HG2  VAL  61          HG23      VAL  61   4.239  -7.825   2.160
  481    H    ARG  62           HN       ARG  62   7.109  -8.752  -0.953
  482    HA   ARG  62           HA       ARG  62   8.635  -6.808  -2.242
  483   1HB   ARG  62          HB2       ARG  62   8.982  -9.719  -1.840
  484   2HB   ARG  62          HB1       ARG  62   9.988  -8.959  -3.050
  485   1HG   ARG  62          HG2       ARG  62  10.659  -7.294  -1.287
  486   2HG   ARG  62          HG1       ARG  62   9.829  -8.327  -0.120
  487   1HD   ARG  62          HD2       ARG  62  11.279 -10.169  -0.624
  488   2HD   ARG  62          HD1       ARG  62  12.016  -9.286  -1.959
  489    HE   ARG  62           HE       ARG  62  12.250  -8.123   0.710
  490   1HH1  ARG  62          HH11      ARG  62  13.847 -10.126  -1.747
  491   2HH1  ARG  62          HH12      ARG  62  15.414  -9.666  -1.298
  492   1HH2  ARG  62          HH21      ARG  62  14.371  -7.579   1.384
  493   2HH2  ARG  62          HH22      ARG  62  15.742  -8.198   0.569
  494    H    GLN  63           HN       GLN  63   6.123  -8.810  -3.588
  495    HA   GLN  63           HA       GLN  63   7.201  -8.326  -6.276
  496   1HB   GLN  63          HB2       GLN  63   4.710  -9.877  -5.539
  497   2HB   GLN  63          HB1       GLN  63   5.281  -9.614  -7.167
  498   1HG   GLN  63          HG2       GLN  63   5.973 -11.771  -6.682
  499   2HG   GLN  63          HG1       GLN  63   7.418 -10.793  -6.454
  500   1HE2  GLN  63          HE21      GLN  63   4.745 -10.962  -4.207
  501   2HE2  GLN  63          HE22      GLN  63   5.618 -11.795  -2.973
  502    H    LEU  64           HN       LEU  64   5.505  -6.713  -4.124
  503    HA   LEU  64           HA       LEU  64   3.527  -5.561  -5.864
  504   1HB   LEU  64          HB2       LEU  64   4.631  -4.392  -3.301
  505   2HB   LEU  64          HB1       LEU  64   3.150  -3.949  -4.105
  506    HG   LEU  64           HG       LEU  64   3.682  -6.566  -2.706
  507   1HD1  LEU  64          HD11      LEU  64   1.967  -5.815  -1.141
  508   2HD1  LEU  64          HD12      LEU  64   1.879  -4.268  -1.986
  509   3HD1  LEU  64          HD13      LEU  64   3.367  -4.743  -1.166
  510   1HD2  LEU  64          HD21      LEU  64   1.327  -7.078  -3.131
  511   2HD2  LEU  64          HD22      LEU  64   2.229  -6.901  -4.639
  512   3HD2  LEU  64          HD23      LEU  64   1.174  -5.601  -4.085
  513    H    THR  65           HN       THR  65   3.731  -3.585  -6.948
  514    HA   THR  65           HA       THR  65   6.460  -2.676  -7.229
  515    HB   THR  65           HB       THR  65   5.505  -1.615  -9.318
  516    HG1  THR  65           HG1      THR  65   3.426  -3.149  -9.669
  517   1HG2  THR  65          HG21      THR  65   6.719  -3.736  -9.363
  518   2HG2  THR  65          HG22      THR  65   5.386  -3.757 -10.529
  519   3HG2  THR  65          HG23      THR  65   5.228  -4.593  -8.979
  520    H    LEU  66           HN       LEU  66   6.632  -0.302  -7.523
  521    HA   LEU  66           HA       LEU  66   5.945   0.954  -5.201
  522   1HB   LEU  66          HB2       LEU  66   7.777   1.646  -6.745
  523   2HB   LEU  66          HB1       LEU  66   6.589   2.296  -7.840
  524    HG   LEU  66           HG       LEU  66   7.920   3.944  -6.438
  525   1HD1  LEU  66          HD11      LEU  66   6.039   5.421  -6.035
  526   2HD1  LEU  66          HD12      LEU  66   4.936   4.050  -6.216
  527   3HD1  LEU  66          HD13      LEU  66   5.907   4.588  -7.589
  528   1HD2  LEU  66          HD21      LEU  66   6.079   2.957  -4.290
  529   2HD2  LEU  66          HD22      LEU  66   7.150   4.350  -4.172
  530   3HD2  LEU  66          HD23      LEU  66   7.831   2.721  -4.324
  531    H    ARG  67           HN       ARG  67   4.217   1.371  -8.295
  532    HA   ARG  67           HA       ARG  67   2.268   2.933  -6.812
  533   1HB   ARG  67          HB2       ARG  67   2.525   2.474  -9.770
  534   2HB   ARG  67          HB1       ARG  67   1.138   3.274  -9.048
  535   1HG   ARG  67          HG2       ARG  67   4.006   4.197  -8.934
  536   2HG   ARG  67          HG1       ARG  67   2.711   4.898  -9.901
  537   1HD   ARG  67          HD2       ARG  67   1.509   5.295  -7.635
  538   2HD   ARG  67          HD1       ARG  67   3.076   4.927  -6.920
  539    HE   ARG  67           HE       ARG  67   3.827   6.795  -8.631
  540   1HH1  ARG  67          HH11      ARG  67   1.155   7.002  -6.256
  541   2HH1  ARG  67          HH12      ARG  67   1.125   8.680  -6.323
  542   1HH2  ARG  67          HH21      ARG  67   3.681   9.006  -8.757
  543   2HH2  ARG  67          HH22      ARG  67   2.609   9.885  -7.772
  544    H    LYS  68           HN       LYS  68   2.618  -0.219  -6.986
  545    HA   LYS  68           HA       LYS  68  -0.167  -0.837  -7.485
  546   1HB   LYS  68          HB2       LYS  68   1.594  -2.525  -8.038
  547   2HB   LYS  68          HB1       LYS  68   1.994  -2.609  -6.322
  548   1HG   LYS  68          HG2       LYS  68  -0.241  -3.427  -5.826
  549   2HG   LYS  68          HG1       LYS  68  -0.659  -3.342  -7.533
  550   1HD   LYS  68          HD2       LYS  68   1.040  -5.014  -8.039
  551   2HD   LYS  68          HD1       LYS  68   1.495  -5.073  -6.328
  552   1HE   LYS  68          HE2       LYS  68  -0.740  -5.811  -5.741
  553   2HE   LYS  68          HE1       LYS  68  -1.236  -5.717  -7.424
  554   1HZ   LYS  68          HZ1       LYS  68  -0.783  -7.937  -6.764
  555   2HZ   LYS  68          HZ2       LYS  68   0.786  -7.634  -6.313
  556   3HZ   LYS  68          HZ3       LYS  68   0.326  -7.522  -7.940
  557    H    LEU  69           HN       LEU  69   1.963  -0.078  -4.910
  558    HA   LEU  69           HA       LEU  69   0.586  -1.066  -2.693
  559   1HB   LEU  69          HB2       LEU  69   2.383   1.305  -3.022
  560   2HB   LEU  69          HB1       LEU  69   1.533   1.088  -1.515
  561    HG   LEU  69           HG       LEU  69   3.774   0.280  -1.294
  562   1HD1  LEU  69          HD11      LEU  69   1.852  -2.021  -1.417
  563   2HD1  LEU  69          HD12      LEU  69   2.112  -0.923  -0.061
  564   3HD1  LEU  69          HD13      LEU  69   3.401  -2.011  -0.573
  565   1HD2  LEU  69          HD21      LEU  69   4.652  -1.591  -2.600
  566   2HD2  LEU  69          HD22      LEU  69   4.291  -0.195  -3.615
  567   3HD2  LEU  69          HD23      LEU  69   3.193  -1.575  -3.593
  568    H    GLN  70           HN       GLN  70   0.009   1.862  -4.479
  569    HA   GLN  70           HA       GLN  70  -2.052   2.725  -2.634
  570   1HB   GLN  70          HB2       GLN  70  -2.277   4.665  -4.129
  571   2HB   GLN  70          HB1       GLN  70  -0.651   4.419  -3.501
  572   1HG   GLN  70          HG2       GLN  70   0.123   3.590  -5.522
  573   2HG   GLN  70          HG1       GLN  70  -1.509   3.528  -6.258
  574   1HE2  GLN  70          HE21      GLN  70  -1.035   4.887  -7.928
  575   2HE2  GLN  70          HE22      GLN  70  -0.646   6.541  -7.740
  576    H    GLU  71           HN       GLU  71  -2.089   0.411  -4.834
  577    HA   GLU  71           HA       GLU  71  -4.795   1.037  -5.816
  578   1HB   GLU  71          HB2       GLU  71  -2.926   0.371  -7.446
  579   2HB   GLU  71          HB1       GLU  71  -2.935  -1.204  -6.670
  580   1HG   GLU  71          HG2       GLU  71  -5.415  -1.276  -7.284
  581   2HG   GLU  71          HG1       GLU  71  -5.044   0.069  -8.362
  582    H    MET  72           HN       MET  72  -3.270  -0.223  -3.365
  583    HA   MET  72           HA       MET  72  -5.447  -1.959  -2.598
  584   1HB   MET  72          HB2       MET  72  -3.856  -3.711  -1.805
  585   2HB   MET  72          HB1       MET  72  -3.847  -3.539  -3.550
  586   1HG   MET  72          HG2       MET  72  -1.778  -2.198  -3.368
  587   2HG   MET  72          HG1       MET  72  -1.766  -2.488  -1.631
  588   1HE   MET  72          HE1       MET  72  -1.495  -4.919  -0.549
  589   2HE   MET  72          HE2       MET  72  -1.319  -6.395  -1.496
  590   3HE   MET  72          HE3       MET  72  -2.845  -5.506  -1.521
  591    H    SER  73           HN       SER  73  -4.642   0.706  -2.023
  592    HA   SER  73           HA       SER  73  -3.231   0.629   0.473
  593   1HB   SER  73          HB2       SER  73  -3.427   3.123   0.269
  594   2HB   SER  73          HB1       SER  73  -2.549   2.321  -1.034
  595    HG   SER  73           HG       SER  73  -4.089   3.937  -1.679
  596    H    SER  74           HN       SER  74  -6.265   0.174  -0.558
  597    HA   SER  74           HA       SER  74  -8.125  -0.374   0.640
  598   1HB   SER  74          HB2       SER  74  -6.760  -0.728   2.673
  599   2HB   SER  74          HB1       SER  74  -6.797   0.995   3.007
  600    HG   SER  74           HG       SER  74  -9.291   0.025   2.714
  601    H    LYS  75           HN       LYS  75  -7.201   2.446  -0.476
  602    HA   LYS  75           HA       LYS  75  -9.850   3.541  -0.180
  603   1HB   LYS  75          HB2       LYS  75  -9.157   5.699   0.627
  604   2HB   LYS  75          HB1       LYS  75  -8.611   4.476   1.762
  605   1HG   LYS  75          HG2       LYS  75  -6.348   4.660   0.955
  606   2HG   LYS  75          HG1       LYS  75  -6.859   5.756  -0.333
  607   1HD   LYS  75          HD2       LYS  75  -7.648   7.341   1.422
  608   2HD   LYS  75          HD1       LYS  75  -6.949   6.269   2.637
  609   1HE   LYS  75          HE2       LYS  75  -4.742   6.571   1.647
  610   2HE   LYS  75          HE1       LYS  75  -5.429   7.609   0.402
  611   1HZ   LYS  75          HZ1       LYS  75  -6.095   9.174   2.140
  612   2HZ   LYS  75          HZ2       LYS  75  -4.428   8.927   2.181
  613   3HZ   LYS  75          HZ3       LYS  75  -5.419   8.179   3.319
  614    H    ALA  76           HN       ALA  76 -10.042   5.481  -1.527
  615    HA   ALA  76           HA       ALA  76  -8.309   5.383  -3.877
  616   1HB   ALA  76          HB1       ALA  76 -10.035   6.840  -4.912
  617   2HB   ALA  76          HB2       ALA  76 -10.932   6.833  -3.393
  618   3HB   ALA  76          HB3       ALA  76 -10.735   5.337  -4.308
  619    H    GLY  77           HN       GLY  77  -9.487   7.341  -1.245
  620   1HA   GLY  77          HA2       GLY  77  -8.681   9.190  -0.200
  621   2HA   GLY  77          HA1       GLY  77  -7.115   8.754  -0.866
  622    H    SER  78           HN       SER  78  -6.446  10.717  -1.388
  623    HA   SER  78           HA       SER  78  -8.092  12.489  -2.955
  624   1HB   SER  78          HB2       SER  78  -5.242  12.757  -2.000
  625   2HB   SER  78          HB1       SER  78  -6.214  14.038  -2.731
  626    HG   SER  78           HG       SER  78  -7.678  13.040  -0.797
  627    H    ASP  79           HN       ASP  79  -6.926   9.821  -4.020
  628    HA   ASP  79           HA       ASP  79  -5.304  10.739  -6.236
  629   1HB   ASP  79          HB2       ASP  79  -4.959   8.462  -5.399
  630   2HB   ASP  79          HB1       ASP  79  -6.637   8.063  -5.764
  631    H    THR  80           HN       THR  80  -8.495   9.390  -5.792
  632    HA   THR  80           HA       THR  80  -9.347  10.800  -8.195
  633    HB   THR  80           HB       THR  80 -10.461   8.191  -7.095
  634    HG1  THR  80           HG1      THR  80  -8.252   8.315  -8.248
  635   1HG2  THR  80          HG21      THR  80 -11.036   9.677  -9.678
  636   2HG2  THR  80          HG22      THR  80 -12.131   9.550  -8.299
  637   3HG2  THR  80          HG23      THR  80 -11.708   8.109  -9.227
  638    H    GLU  81           HN       GLU  81 -10.107  12.574  -7.288
  639    HA   GLU  81           HA       GLU  81 -11.358  12.710  -4.736
  640   1HB   GLU  81          HB2       GLU  81 -11.001  14.711  -6.955
  641   2HB   GLU  81          HB1       GLU  81 -11.737  15.098  -5.406
  642   1HG   GLU  81          HG2       GLU  81  -8.977  13.951  -5.672
  643   2HG   GLU  81          HG1       GLU  81  -9.314  15.684  -5.655
  644    H    LEU  82           HN       LEU  82 -12.487  12.666  -8.035
  645    HA   LEU  82           HA       LEU  82 -15.185  13.294  -7.258
  646   1HB   LEU  82          HB2       LEU  82 -14.351  14.035  -9.433
  647   2HB   LEU  82          HB1       LEU  82 -14.081  12.370  -9.913
  648    HG   LEU  82           HG       LEU  82 -16.525  11.966  -9.789
  649   1HD1  LEU  82          HD11      LEU  82 -16.699  14.935  -9.302
  650   2HD1  LEU  82          HD12      LEU  82 -17.133  13.658  -8.165
  651   3HD1  LEU  82          HD13      LEU  82 -18.057  13.865  -9.654
  652   1HD2  LEU  82          HD21      LEU  82 -15.478  12.528 -11.916
  653   2HD2  LEU  82          HD22      LEU  82 -15.698  14.247 -11.582
  654   3HD2  LEU  82          HD23      LEU  82 -17.102  13.208 -11.820
  655    H    ALA  83           HN       ALA  83 -16.195  11.836  -6.125
  656    HA   ALA  83           HA       ALA  83 -15.869   9.003  -6.682
  657   1HB   ALA  83          HB1       ALA  83 -17.541  10.426  -4.598
  658   2HB   ALA  83          HB2       ALA  83 -15.942   9.732  -4.339
  659   3HB   ALA  83          HB3       ALA  83 -17.306   8.682  -4.709
  660    H    ALA  84           HN       ALA  84 -17.120   7.998  -8.050
  661    HA   ALA  84           HA       ALA  84 -18.786   7.332  -9.351
  662   1HB   ALA  84          HB1       ALA  84 -20.595   9.270  -7.905
  663   2HB   ALA  84          HB2       ALA  84 -20.294   7.605  -7.414
  664   3HB   ALA  84          HB3       ALA  84 -21.104   7.940  -8.946
  665    HA   PRO  85           HA       PRO  85 -18.139  10.227 -12.603
  666   1HB   PRO  85          HB2       PRO  85 -19.304   8.721 -14.571
  667   2HB   PRO  85          HB1       PRO  85 -17.665   8.441 -13.968
  668   1HG   PRO  85          HG2       PRO  85 -20.212   7.038 -13.264
  669   2HG   PRO  85          HG1       PRO  85 -18.602   6.355 -13.563
  670   1HD   PRO  85          HD2       PRO  85 -19.562   6.709 -11.071
  671   2HD   PRO  85          HD1       PRO  85 -17.839   6.901 -11.453
  672    H    LYS  86           HN       LYS  86 -19.327  11.695 -13.743
  673    HA   LYS  86           HA       LYS  86 -22.044  12.152 -12.892
  674   1HB   LYS  86          HB2       LYS  86 -20.238  13.601 -14.851
  675   2HB   LYS  86          HB1       LYS  86 -21.828  14.163 -14.357
  676   1HG   LYS  86          HG2       LYS  86 -21.092  14.535 -12.121
  677   2HG   LYS  86          HG1       LYS  86 -19.560  13.718 -12.427
  678   1HD   LYS  86          HD2       LYS  86 -20.436  16.224 -13.859
  679   2HD   LYS  86          HD1       LYS  86 -19.439  16.228 -12.401
  680   1HE   LYS  86          HE2       LYS  86 -17.728  14.935 -13.532
  681   2HE   LYS  86          HE1       LYS  86 -18.735  14.813 -14.971
  682   1HZ   LYS  86          HZ1       LYS  86 -17.770  17.414 -13.884
  683   2HZ   LYS  86          HZ2       LYS  86 -18.473  17.108 -15.395
  684   3HZ   LYS  86          HZ3       LYS  86 -16.937  16.501 -15.031
  685    H    SER  87           HN       SER  87 -20.261  11.206 -15.727
  686    HA   SER  87           HA       SER  87 -22.538   9.803 -16.772
  687   1HB   SER  87          HB2       SER  87 -20.998  11.852 -18.409
  688   2HB   SER  87          HB1       SER  87 -22.225  10.748 -19.042
  689    HG   SER  87           HG       SER  87 -23.235  11.959 -16.946
  690    H    LYS  88           HN       LYS  88 -21.834   7.868 -17.350
  691    HA   LYS  88           HA       LYS  88 -19.157   7.117 -16.941
  692   1HB   LYS  88          HB2       LYS  88 -21.356   5.599 -18.326
  693   2HB   LYS  88          HB1       LYS  88 -19.808   4.919 -17.856
  694   1HG   LYS  88          HG2       LYS  88 -20.325   5.430 -15.503
  695   2HG   LYS  88          HG1       LYS  88 -21.907   6.029 -16.007
  696   1HD   LYS  88          HD2       LYS  88 -22.094   3.744 -15.219
  697   2HD   LYS  88          HD1       LYS  88 -22.422   3.818 -16.951
  698   1HE   LYS  88          HE2       LYS  88 -20.119   3.093 -17.399
  699   2HE   LYS  88          HE1       LYS  88 -19.822   2.992 -15.665
  700   1HZ   LYS  88          HZ1       LYS  88 -21.796   1.349 -17.188
  701   2HZ   LYS  88          HZ2       LYS  88 -21.507   1.247 -15.519
  702   3HZ   LYS  88          HZ3       LYS  88 -20.294   0.852 -16.616
  703    H    ASN  89           HN       ASN  89 -20.857   7.965 -19.887
  704    HA   ASN  89           HA       ASN  89 -18.472   7.252 -21.400
  705   1HB   ASN  89          HB2       ASN  89 -20.599   6.528 -22.376
  706   2HB   ASN  89          HB1       ASN  89 -21.184   8.187 -22.364
  707   1HD2  ASN  89          HD21      ASN  89 -17.848   7.327 -23.260
  708   2HD2  ASN  89          HD22      ASN  89 -18.041   7.761 -24.908
  Start of MODEL   19
    1   1H    GLY   1          HT1       GLY   1  -7.963  16.392   2.800
    2   2H    GLY   1          HT2       GLY   1  -6.755  15.647   3.733
    3   3H    GLY   1          HT3       GLY   1  -7.384  17.137   4.208
    4   1HA   GLY   1          HA1       GLY   1  -9.484  16.181   4.706
    5   2HA   GLY   1          HA2       GLY   1  -8.906  14.619   4.117
    6    H    ASP   2           HN       ASP   2  -9.858  14.865   6.670
    7    HA   ASP   2           HA       ASP   2  -7.574  15.203   8.454
    8   1HB   ASP   2          HB2       ASP   2 -10.377  14.251   9.146
    9   2HB   ASP   2          HB1       ASP   2  -9.128  14.725  10.284
   10    H    GLY   3           HN       GLY   3 -10.038  12.666   8.413
   11   1HA   GLY   3          HA2       GLY   3  -7.874  10.689   8.512
   12   2HA   GLY   3          HA1       GLY   3  -9.467  10.485   9.243
   13    H    GLU   4           HN       GLU   4  -7.639   9.649   6.685
   14    HA   GLU   4           HA       GLU   4  -9.807   9.656   4.730
   15   1HB   GLU   4          HB2       GLU   4  -6.947   8.702   4.453
   16   2HB   GLU   4          HB1       GLU   4  -8.111   8.906   3.153
   17   1HG   GLU   4          HG2       GLU   4  -8.159  11.324   3.611
   18   2HG   GLU   4          HG1       GLU   4  -6.925  11.091   4.848
   19    H    ALA   5           HN       ALA   5  -9.881   7.472   3.439
   20    HA   ALA   5           HA       ALA   5 -10.435   5.395   5.334
   21   1HB   ALA   5          HB1       ALA   5 -11.003   4.053   3.334
   22   2HB   ALA   5          HB2       ALA   5 -10.376   5.337   2.303
   23   3HB   ALA   5          HB3       ALA   5 -11.802   5.625   3.302
   24    H    GLN   6           HN       GLN   6  -8.636   4.752   6.345
   25    HA   GLN   6           HA       GLN   6  -6.659   3.759   6.791
   26   1HB   GLN   6          HB2       GLN   6  -7.383   2.028   5.110
   27   2HB   GLN   6          HB1       GLN   6  -6.630   2.980   3.848
   28   1HG   GLN   6          HG2       GLN   6  -4.459   2.654   5.168
   29   2HG   GLN   6          HG1       GLN   6  -5.343   1.392   6.036
   30   1HE2  GLN   6          HE21      GLN   6  -4.140  -0.326   5.197
   31   2HE2  GLN   6          HE22      GLN   6  -4.285  -0.765   3.519
   32    H    ARG   7           HN       ARG   7  -5.726   4.344   3.525
   33    HA   ARG   7           HA       ARG   7  -4.967   6.798   3.061
   34   1HB   ARG   7          HB2       ARG   7  -2.652   7.126   3.736
   35   2HB   ARG   7          HB1       ARG   7  -3.532   6.733   5.200
   36   1HG   ARG   7          HG2       ARG   7  -2.668   4.449   5.113
   37   2HG   ARG   7          HG1       ARG   7  -1.813   4.825   3.614
   38   1HD   ARG   7          HD2       ARG   7  -0.241   4.988   5.414
   39   2HD   ARG   7          HD1       ARG   7  -0.592   6.621   4.852
   40    HE   ARG   7           HE       ARG   7  -1.887   5.421   7.192
   41   1HH1  ARG   7          HH11      ARG   7  -0.222   8.249   5.704
   42   2HH1  ARG   7          HH12      ARG   7  -0.267   9.150   7.126
   43   1HH2  ARG   7          HH21      ARG   7  -1.940   6.752   9.102
   44   2HH2  ARG   7          HH22      ARG   7  -1.342   8.360   9.048
   45    H    ASP   8           HN       ASP   8  -2.887   6.612   1.492
   46    HA   ASP   8           HA       ASP   8  -3.212   4.049   0.092
   47   1HB   ASP   8          HB2       ASP   8  -1.380   6.374  -0.581
   48   2HB   ASP   8          HB1       ASP   8  -1.582   4.924  -1.545
   49    H    LEU   9           HN       LEU   9  -1.697   2.425   0.214
   50    HA   LEU   9           HA       LEU   9   0.279   2.501   2.171
   51   1HB   LEU   9          HB2       LEU   9   0.194   0.790  -0.297
   52   2HB   LEU   9          HB1       LEU   9   1.346   0.570   1.005
   53    HG   LEU   9           HG       LEU   9  -1.636   0.235   1.149
   54   1HD1  LEU   9          HD11      LEU   9   0.653  -1.707   1.399
   55   2HD1  LEU   9          HD12      LEU   9  -0.459  -1.575   0.034
   56   3HD1  LEU   9          HD13      LEU   9  -1.054  -2.099   1.610
   57   1HD2  LEU   9          HD21      LEU   9   0.441  -0.047   3.318
   58   2HD2  LEU   9          HD22      LEU   9  -1.266  -0.473   3.464
   59   3HD2  LEU   9          HD23      LEU   9  -0.790   1.209   3.218
   60    H    VAL  10           HN       VAL  10   0.365   3.613  -1.078
   61    HA   VAL  10           HA       VAL  10   3.137   4.003  -1.365
   62    HB   VAL  10           HB       VAL  10   0.820   5.573  -2.562
   63   1HG1  VAL  10          HG11      VAL  10   3.740   5.641  -3.362
   64   2HG1  VAL  10          HG12      VAL  10   2.857   6.955  -2.589
   65   3HG1  VAL  10          HG13      VAL  10   2.414   6.431  -4.214
   66   1HG2  VAL  10          HG21      VAL  10   2.586   3.405  -3.656
   67   2HG2  VAL  10          HG22      VAL  10   1.369   4.290  -4.569
   68   3HG2  VAL  10          HG23      VAL  10   0.884   3.262  -3.210
   69    H    LYS  11           HN       LYS  11   0.683   5.821   0.339
   70    HA   LYS  11           HA       LYS  11   2.265   8.159   0.706
   71   1HB   LYS  11          HB2       LYS  11  -0.168   7.203   2.224
   72   2HB   LYS  11          HB1       LYS  11   0.584   8.780   2.369
   73   1HG   LYS  11          HG2       LYS  11  -0.777   7.679  -0.087
   74   2HG   LYS  11          HG1       LYS  11  -1.416   8.906   1.007
   75   1HD   LYS  11          HD2       LYS  11   0.642  10.270   0.440
   76   2HD   LYS  11          HD1       LYS  11   0.938   9.108  -0.850
   77   1HE   LYS  11          HE2       LYS  11  -1.484  10.893  -0.536
   78   2HE   LYS  11          HE1       LYS  11  -0.177  11.005  -1.720
   79   1HZ   LYS  11          HZ1       LYS  11  -0.895   8.993  -2.747
   80   2HZ   LYS  11          HZ2       LYS  11  -2.205  10.050  -2.622
   81   3HZ   LYS  11          HZ3       LYS  11  -2.130   8.735  -1.614
   82    H    ALA  12           HN       ALA  12   2.466   5.100   2.010
   83    HA   ALA  12           HA       ALA  12   3.858   6.127   4.386
   84   1HB   ALA  12          HB1       ALA  12   2.606   3.408   3.996
   85   2HB   ALA  12          HB2       ALA  12   1.923   4.729   4.945
   86   3HB   ALA  12          HB3       ALA  12   3.439   3.969   5.447
   87    H    VAL  13           HN       VAL  13   3.909   3.415   2.056
   88    HA   VAL  13           HA       VAL  13   6.507   2.545   2.696
   89    HB   VAL  13           HB       VAL  13   4.892   2.108   0.171
   90   1HG1  VAL  13          HG11      VAL  13   7.302   0.609   1.198
   91   2HG1  VAL  13          HG12      VAL  13   7.235   1.667  -0.216
   92   3HG1  VAL  13          HG13      VAL  13   6.322   0.158  -0.204
   93   1HG2  VAL  13          HG21      VAL  13   5.178   0.403   2.642
   94   2HG2  VAL  13          HG22      VAL  13   4.307  -0.051   1.175
   95   3HG2  VAL  13          HG23      VAL  13   3.741   1.304   2.151
   96    H    ALA  14           HN       ALA  14   5.267   4.571   0.057
   97    HA   ALA  14           HA       ALA  14   7.838   4.925  -1.083
   98   1HB   ALA  14          HB1       ALA  14   6.726   6.605  -2.534
   99   2HB   ALA  14          HB2       ALA  14   5.300   6.540  -1.492
  100   3HB   ALA  14          HB3       ALA  14   5.749   5.138  -2.424
  101    H    HIS  15           HN       HIS  15   5.979   6.461   1.359
  102    HA   HIS  15           HA       HIS  15   7.372   8.943   1.501
  103   1HB   HIS  15          HB2       HIS  15   5.065   8.363   2.483
  104   2HB   HIS  15          HB1       HIS  15   5.935   7.592   3.797
  105    HD1  HIS  15           HD1      HIS  15   4.279  10.639   3.054
  106    HD2  HIS  15           HD2      HIS  15   7.820   9.697   5.023
  107    HE1  HIS  15           HE1      HIS  15   4.792  12.603   4.489
  108    HE2  HIS  15           HE2      HIS  15   6.924  12.022   5.693
  109    H    ILE  16           HN       ILE  16   7.872   5.771   2.907
  110    HA   ILE  16           HA       ILE  16   9.880   6.334   4.787
  111    HB   ILE  16           HB       ILE  16   9.406   3.847   3.104
  112   1HG1  ILE  16          HG12      ILE  16   7.586   4.317   4.640
  113   2HG1  ILE  16          HG11      ILE  16   8.460   2.890   5.171
  114   1HG2  ILE  16          HG21      ILE  16  10.822   2.573   4.640
  115   2HG2  ILE  16          HG22      ILE  16  11.296   4.071   5.446
  116   3HG2  ILE  16          HG23      ILE  16  11.725   3.801   3.757
  117   1HD1  ILE  16          HD11      ILE  16   9.603   4.218   6.875
  118   2HD1  ILE  16          HD12      ILE  16   7.848   4.317   7.050
  119   3HD1  ILE  16          HD13      ILE  16   8.743   5.657   6.332
  120    H    LEU  17           HN       LEU  17   9.964   5.990   1.344
  121    HA   LEU  17           HA       LEU  17  12.876   6.029   1.193
  122   1HB   LEU  17          HB2       LEU  17  10.859   6.127  -1.040
  123   2HB   LEU  17          HB1       LEU  17  12.558   5.727  -1.167
  124    HG   LEU  17           HG       LEU  17  10.435   4.057   0.167
  125   1HD1  LEU  17          HD11      LEU  17  11.952   3.658  -2.394
  126   2HD1  LEU  17          HD12      LEU  17  10.237   4.042  -2.227
  127   3HD1  LEU  17          HD13      LEU  17  10.856   2.492  -1.655
  128   1HD2  LEU  17          HD21      LEU  17  13.371   3.476  -0.243
  129   2HD2  LEU  17          HD22      LEU  17  12.176   2.347   0.393
  130   3HD2  LEU  17          HD23      LEU  17  12.585   3.804   1.300
  131    H    GLY  18           HN       GLY  18  10.096   8.035   0.501
  132   1HA   GLY  18          HA2       GLY  18  10.340  10.432   0.955
  133   2HA   GLY  18          HA1       GLY  18  11.902  10.339   0.142
  134    H    ILE  19           HN       ILE  19   8.960   8.753  -0.925
  135    HA   ILE  19           HA       ILE  19   8.741  10.631  -3.113
  136    HB   ILE  19           HB       ILE  19   8.019   8.461  -4.413
  137   1HG1  ILE  19          HG12      ILE  19  10.087   7.394  -2.486
  138   2HG1  ILE  19          HG11      ILE  19   8.419   6.865  -2.646
  139   1HG2  ILE  19          HG21      ILE  19  10.276   8.391  -5.460
  140   2HG2  ILE  19          HG22      ILE  19  10.880   9.368  -4.121
  141   3HG2  ILE  19          HG23      ILE  19   9.648  10.020  -5.212
  142   1HD1  ILE  19          HD11      ILE  19   8.920   6.002  -4.880
  143   2HD1  ILE  19          HD12      ILE  19   9.947   5.272  -3.646
  144   3HD1  ILE  19          HD13      ILE  19  10.594   6.531  -4.702
  145    H    ARG  20           HN       ARG  20   6.743  10.723  -4.071
  146    HA   ARG  20           HA       ARG  20   4.465   9.258  -3.030
  147   1HB   ARG  20          HB2       ARG  20   4.761  11.114  -1.390
  148   2HB   ARG  20          HB1       ARG  20   4.611  12.249  -2.733
  149   1HG   ARG  20          HG2       ARG  20   2.351  11.264  -3.186
  150   2HG   ARG  20          HG1       ARG  20   2.509  10.391  -1.658
  151   1HD   ARG  20          HD2       ARG  20   1.251  12.413  -1.318
  152   2HD   ARG  20          HD1       ARG  20   2.813  12.546  -0.507
  153    HE   ARG  20           HE       ARG  20   3.121  13.625  -3.051
  154   1HH1  ARG  20          HH11      ARG  20   1.200  14.402  -0.168
  155   2HH1  ARG  20          HH12      ARG  20   1.204  16.068  -0.513
  156   1HH2  ARG  20          HH21      ARG  20   3.135  15.801  -3.457
  157   2HH2  ARG  20          HH22      ARG  20   2.387  16.913  -2.397
  158    H    ASP  21           HN       ASP  21   5.630  12.051  -4.822
  159    HA   ASP  21           HA       ASP  21   3.515  11.812  -6.839
  160   1HB   ASP  21          HB2       ASP  21   5.680  13.870  -6.408
  161   2HB   ASP  21          HB1       ASP  21   4.546  13.885  -7.756
  162    H    LEU  22           HN       LEU  22   6.704  10.950  -6.335
  163    HA   LEU  22           HA       LEU  22   8.156   9.757  -7.558
  164   1HB   LEU  22          HB2       LEU  22   5.655   8.969  -9.061
  165   2HB   LEU  22          HB1       LEU  22   7.228   8.311  -9.437
  166    HG   LEU  22           HG       LEU  22   6.054   6.708  -8.166
  167   1HD1  LEU  22          HD11      LEU  22   7.483   6.415  -6.228
  168   2HD1  LEU  22          HD12      LEU  22   8.084   8.068  -6.466
  169   3HD1  LEU  22          HD13      LEU  22   8.350   6.846  -7.703
  170   1HD2  LEU  22          HD21      LEU  22   5.205   7.098  -5.899
  171   2HD2  LEU  22          HD22      LEU  22   4.379   8.101  -7.085
  172   3HD2  LEU  22          HD23      LEU  22   5.603   8.808  -6.044
  173    H    ALA  23           HN       ALA  23   9.034  11.817  -8.120
  174    HA   ALA  23           HA       ALA  23   8.232  12.753 -10.645
  175   1HB   ALA  23          HB1       ALA  23   9.844  14.608 -10.295
  176   2HB   ALA  23          HB2       ALA  23  10.396  13.811  -8.822
  177   3HB   ALA  23          HB3       ALA  23   8.737  14.393  -8.939
  178    H    GLY  24           HN       GLY  24   8.929  10.749 -11.711
  179   1HA   GLY  24          HA2       GLY  24  10.326   9.865 -13.318
  180   2HA   GLY  24          HA1       GLY  24  11.636  10.934 -12.790
  181    H    ILE  25           HN       ILE  25   9.716   8.696 -10.936
  182    HA   ILE  25           HA       ILE  25  12.135   7.133 -10.334
  183    HB   ILE  25           HB       ILE  25   9.525   7.428  -8.787
  184   1HG1  ILE  25          HG12      ILE  25  10.935   8.047  -6.866
  185   2HG1  ILE  25          HG11      ILE  25  12.378   7.914  -7.834
  186   1HG2  ILE  25          HG21      ILE  25  10.337   5.776  -7.153
  187   2HG2  ILE  25          HG22      ILE  25  11.711   5.434  -8.208
  188   3HG2  ILE  25          HG23      ILE  25  10.070   5.076  -8.751
  189   1HD1  ILE  25          HD11      ILE  25  11.761  10.210  -7.504
  190   2HD1  ILE  25          HD12      ILE  25  10.146   9.905  -8.146
  191   3HD1  ILE  25          HD13      ILE  25  11.551   9.791  -9.204
  192    H    ASN  26           HN       ASN  26  12.068   4.945 -10.759
  193    HA   ASN  26           HA       ASN  26  10.138   4.326 -12.806
  194   1HB   ASN  26          HB2       ASN  26  12.483   2.675 -11.836
  195   2HB   ASN  26          HB1       ASN  26  11.417   2.224 -13.160
  196   1HD2  ASN  26          HD21      ASN  26  12.818   2.271 -14.800
  197   2HD2  ASN  26          HD22      ASN  26  13.712   3.652 -15.317
  198    H    LEU  27           HN       LEU  27   8.371   3.422 -12.488
  199    HA   LEU  27           HA       LEU  27   7.753   2.358  -9.871
  200   1HB   LEU  27          HB2       LEU  27   6.004   2.971 -12.247
  201   2HB   LEU  27          HB1       LEU  27   5.433   2.511 -10.648
  202    HG   LEU  27           HG       LEU  27   7.025   5.003 -11.249
  203   1HD1  LEU  27          HD11      LEU  27   4.803   5.144 -12.214
  204   2HD1  LEU  27          HD12      LEU  27   4.968   6.221 -10.828
  205   3HD1  LEU  27          HD13      LEU  27   4.091   4.700 -10.662
  206   1HD2  LEU  27          HD21      LEU  27   7.406   4.176  -9.016
  207   2HD2  LEU  27          HD22      LEU  27   5.671   4.044  -8.740
  208   3HD2  LEU  27          HD23      LEU  27   6.409   5.628  -8.960
  209    H    ASP  28           HN       ASP  28   9.105   1.127 -12.413
  210    HA   ASP  28           HA       ASP  28   7.642  -1.388 -12.622
  211   1HB   ASP  28          HB2       ASP  28  10.374  -0.704 -13.755
  212   2HB   ASP  28          HB1       ASP  28   9.345  -2.048 -14.222
  213    H    SER  29           HN       SER  29   9.885   0.077 -10.631
  214    HA   SER  29           HA       SER  29  11.438  -2.239  -9.990
  215   1HB   SER  29          HB2       SER  29  11.390   0.536  -8.806
  216   2HB   SER  29          HB1       SER  29  12.608  -0.703  -8.490
  217    HG   SER  29           HG       SER  29  13.398  -0.491 -10.456
  218    H    SER  30           HN       SER  30  10.928  -3.643  -8.521
  219    HA   SER  30           HA       SER  30   8.693  -3.531  -6.802
  220   1HB   SER  30          HB2       SER  30  11.100  -5.295  -7.021
  221   2HB   SER  30          HB1       SER  30   9.821  -5.649  -5.884
  222    HG   SER  30           HG       SER  30   8.407  -5.898  -7.622
  223    H    LEU  31           HN       LEU  31   8.808  -3.731  -4.430
  224    HA   LEU  31           HA       LEU  31  10.178  -1.744  -3.093
  225   1HB   LEU  31          HB2       LEU  31   9.154  -4.352  -1.982
  226   2HB   LEU  31          HB1       LEU  31   9.624  -2.967  -1.007
  227    HG   LEU  31           HG       LEU  31   7.275  -3.238  -2.860
  228   1HD1  LEU  31          HD11      LEU  31   6.000  -2.745  -0.844
  229   2HD1  LEU  31          HD12      LEU  31   7.497  -2.663   0.083
  230   3HD1  LEU  31          HD13      LEU  31   6.994  -4.187  -0.646
  231   1HD2  LEU  31          HD21      LEU  31   6.729  -0.954  -2.302
  232   2HD2  LEU  31          HD22      LEU  31   8.265  -1.075  -3.183
  233   3HD2  LEU  31          HD23      LEU  31   8.266  -0.798  -1.433
  234    H    ALA  32           HN       ALA  32  11.084  -5.057  -3.629
  235    HA   ALA  32           HA       ALA  32  13.300  -5.153  -1.980
  236   1HB   ALA  32          HB1       ALA  32  12.319  -7.147  -2.967
  237   2HB   ALA  32          HB2       ALA  32  14.046  -7.061  -3.322
  238   3HB   ALA  32          HB3       ALA  32  12.870  -6.635  -4.564
  239    H    ASP  33           HN       ASP  33  12.879  -3.857  -5.171
  240    HA   ASP  33           HA       ASP  33  15.617  -3.748  -5.862
  241   1HB   ASP  33          HB2       ASP  33  13.912  -3.745  -7.610
  242   2HB   ASP  33          HB1       ASP  33  13.267  -2.223  -7.012
  243    H    LEU  34           HN       LEU  34  13.215  -1.563  -4.683
  244    HA   LEU  34           HA       LEU  34  14.543   0.887  -4.564
  245   1HB   LEU  34          HB2       LEU  34  12.300  -0.314  -2.986
  246   2HB   LEU  34          HB1       LEU  34  12.889   1.287  -2.630
  247    HG   LEU  34           HG       LEU  34  11.746   2.220  -4.390
  248   1HD1  LEU  34          HD11      LEU  34  11.356   1.188  -6.552
  249   2HD1  LEU  34          HD12      LEU  34  12.038  -0.332  -5.976
  250   3HD1  LEU  34          HD13      LEU  34  13.069   1.092  -6.147
  251   1HD2  LEU  34          HD21      LEU  34   9.657   1.033  -4.809
  252   2HD2  LEU  34          HD22      LEU  34  10.131   0.959  -3.102
  253   3HD2  LEU  34          HD23      LEU  34  10.394  -0.429  -4.148
  254    H    GLY  35           HN       GLY  35  14.204  -1.623  -2.108
  255   1HA   GLY  35          HA2       GLY  35  16.631  -1.617  -0.986
  256   2HA   GLY  35          HA1       GLY  35  15.965  -0.137  -0.327
  257    H    LEU  36           HN       LEU  36  13.543  -2.518  -0.784
  258    HA   LEU  36           HA       LEU  36  13.335  -2.844   2.005
  259   1HB   LEU  36          HB2       LEU  36  11.253  -2.982   1.123
  260   2HB   LEU  36          HB1       LEU  36  11.726  -3.850  -0.303
  261    HG   LEU  36           HG       LEU  36  11.816  -5.951   1.014
  262   1HD1  LEU  36          HD11      LEU  36  10.893  -4.288   3.347
  263   2HD1  LEU  36          HD12      LEU  36  12.464  -5.074   3.184
  264   3HD1  LEU  36          HD13      LEU  36  10.999  -6.048   3.304
  265   1HD2  LEU  36          HD21      LEU  36   9.256  -4.419   1.380
  266   2HD2  LEU  36          HD22      LEU  36   9.433  -6.171   1.470
  267   3HD2  LEU  36          HD23      LEU  36   9.735  -5.334  -0.051
  268    H    ASP  37           HN       ASP  37  14.867  -3.685   2.932
  269    HA   ASP  37           HA       ASP  37  15.213  -6.561   2.600
  270   1HB   ASP  37          HB2       ASP  37  17.177  -5.418   1.582
  271   2HB   ASP  37          HB1       ASP  37  17.481  -4.613   3.116
  272    H    SER  38           HN       SER  38  15.149  -3.673   4.614
  273    HA   SER  38           HA       SER  38  15.082  -5.422   6.945
  274   1HB   SER  38          HB2       SER  38  15.772  -3.357   8.216
  275   2HB   SER  38          HB1       SER  38  16.971  -3.974   7.075
  276    HG   SER  38           HG       SER  38  16.522  -2.339   5.677
  277    H    LEU  39           HN       LEU  39  14.050  -2.087   6.770
  278    HA   LEU  39           HA       LEU  39  11.727  -2.640   8.417
  279   1HB   LEU  39          HB2       LEU  39  13.135  -0.763   8.902
  280   2HB   LEU  39          HB1       LEU  39  12.851  -0.090   7.312
  281    HG   LEU  39           HG       LEU  39  10.412   0.066   7.973
  282   1HD1  LEU  39          HD11      LEU  39   9.911   0.190  10.356
  283   2HD1  LEU  39          HD12      LEU  39  11.541  -0.374  10.718
  284   3HD1  LEU  39          HD13      LEU  39  10.414  -1.424   9.855
  285   1HD2  LEU  39          HD21      LEU  39  11.862   1.984   7.791
  286   2HD2  LEU  39          HD22      LEU  39  12.444   1.732   9.441
  287   3HD2  LEU  39          HD23      LEU  39  10.759   2.179   9.155
  288    H    MET  40           HN       MET  40  12.263  -1.901   5.083
  289    HA   MET  40           HA       MET  40   9.820  -0.603   4.454
  290   1HB   MET  40          HB2       MET  40  11.674  -2.048   2.590
  291   2HB   MET  40          HB1       MET  40  10.456  -0.869   2.125
  292   1HG   MET  40          HG2       MET  40  12.501   0.293   2.051
  293   2HG   MET  40          HG1       MET  40  11.755   0.769   3.570
  294   1HE   MET  40          HE1       MET  40  14.157   1.714   4.319
  295   2HE   MET  40          HE2       MET  40  14.879   1.131   2.820
  296   3HE   MET  40          HE3       MET  40  15.617   0.725   4.369
  297    H    GLY  41           HN       GLY  41  10.005  -3.665   5.385
  298   1HA   GLY  41          HA2       GLY  41   7.578  -4.325   3.835
  299   2HA   GLY  41          HA1       GLY  41   8.743  -5.548   4.335
  300    H    VAL  42           HN       VAL  42   9.130  -3.996   6.874
  301    HA   VAL  42           HA       VAL  42   7.357  -5.560   8.422
  302    HB   VAL  42           HB       VAL  42   9.209  -3.330   9.326
  303   1HG1  VAL  42          HG11      VAL  42   9.103  -4.385  11.534
  304   2HG1  VAL  42          HG12      VAL  42   7.922  -5.543  10.920
  305   3HG1  VAL  42          HG13      VAL  42   7.516  -3.830  10.999
  306   1HG2  VAL  42          HG21      VAL  42  10.441  -5.078   8.186
  307   2HG2  VAL  42          HG22      VAL  42   9.686  -6.304   9.205
  308   3HG2  VAL  42          HG23      VAL  42  10.778  -5.112   9.915
  309    H    GLU  43           HN       GLU  43   7.768  -2.047   8.009
  310    HA   GLU  43           HA       GLU  43   5.581  -1.387   9.644
  311   1HB   GLU  43          HB2       GLU  43   7.368   0.228   8.962
  312   2HB   GLU  43          HB1       GLU  43   6.649   0.275   7.355
  313   1HG   GLU  43          HG2       GLU  43   4.569   1.118   8.297
  314   2HG   GLU  43          HG1       GLU  43   5.271   1.053   9.908
  315    H    VAL  44           HN       VAL  44   5.843  -2.132   6.290
  316    HA   VAL  44           HA       VAL  44   3.271  -1.438   5.291
  317    HB   VAL  44           HB       VAL  44   4.864  -3.893   4.557
  318   1HG1  VAL  44          HG11      VAL  44   2.990  -2.181   2.957
  319   2HG1  VAL  44          HG12      VAL  44   2.683  -3.813   3.588
  320   3HG1  VAL  44          HG13      VAL  44   3.919  -3.559   2.350
  321   1HG2  VAL  44          HG21      VAL  44   6.367  -2.036   4.556
  322   2HG2  VAL  44          HG22      VAL  44   5.263  -1.084   3.553
  323   3HG2  VAL  44          HG23      VAL  44   6.029  -2.543   2.905
  324    H    ARG  45           HN       ARG  45   4.448  -4.554   6.417
  325    HA   ARG  45           HA       ARG  45   2.014  -5.870   6.504
  326   1HB   ARG  45          HB2       ARG  45   4.080  -7.041   6.525
  327   2HB   ARG  45          HB1       ARG  45   4.617  -6.205   7.964
  328   1HG   ARG  45          HG2       ARG  45   3.059  -7.446   9.306
  329   2HG   ARG  45          HG1       ARG  45   2.370  -8.197   7.857
  330   1HD   ARG  45          HD2       ARG  45   4.075  -9.578   9.129
  331   2HD   ARG  45          HD1       ARG  45   4.353  -9.383   7.399
  332    HE   ARG  45           HE       ARG  45   6.156  -7.955   7.845
  333   1HH1  ARG  45          HH11      ARG  45   4.739  -9.102  10.898
  334   2HH1  ARG  45          HH12      ARG  45   6.131  -8.757  11.817
  335   1HH2  ARG  45          HH21      ARG  45   8.027  -7.600   9.058
  336   2HH2  ARG  45          HH22      ARG  45   8.102  -7.885  10.746
  337    H    GLN  46           HN       GLN  46   3.592  -3.827   8.888
  338    HA   GLN  46           HA       GLN  46   1.581  -4.296  10.890
  339   1HB   GLN  46          HB2       GLN  46   3.875  -2.328  10.847
  340   2HB   GLN  46          HB1       GLN  46   2.859  -2.669  12.238
  341   1HG   GLN  46          HG2       GLN  46   4.702  -4.588  10.846
  342   2HG   GLN  46          HG1       GLN  46   4.968  -3.835  12.417
  343   1HE2  GLN  46          HE21      GLN  46   3.829  -4.604  14.192
  344   2HE2  GLN  46          HE22      GLN  46   2.948  -6.085  14.154
  345    H    ILE  47           HN       ILE  47   1.270  -2.747   8.158
  346    HA   ILE  47           HA       ILE  47  -0.490  -0.660   9.278
  347    HB   ILE  47           HB       ILE  47   0.486  -1.032   6.417
  348   1HG1  ILE  47          HG12      ILE  47   0.895   1.264   8.311
  349   2HG1  ILE  47          HG11      ILE  47   2.087  -0.011   8.048
  350   1HG2  ILE  47          HG21      ILE  47  -1.820  -0.278   6.396
  351   2HG2  ILE  47          HG22      ILE  47  -0.769   1.050   5.895
  352   3HG2  ILE  47          HG23      ILE  47  -1.439   1.012   7.530
  353   1HD1  ILE  47          HD11      ILE  47   2.243   0.661   5.696
  354   2HD1  ILE  47          HD12      ILE  47   2.644   1.986   6.788
  355   3HD1  ILE  47          HD13      ILE  47   1.070   1.944   5.992
  356    H    LEU  48           HN       LEU  48  -0.298  -3.156   6.812
  357    HA   LEU  48           HA       LEU  48  -3.032  -3.212   6.218
  358   1HB   LEU  48          HB2       LEU  48  -0.876  -5.262   5.798
  359   2HB   LEU  48          HB1       LEU  48  -2.523  -5.545   5.298
  360    HG   LEU  48           HG       LEU  48  -1.345  -4.886   3.385
  361   1HD1  LEU  48          HD11      LEU  48  -2.421  -2.842   2.695
  362   2HD1  LEU  48          HD12      LEU  48  -2.797  -2.476   4.377
  363   3HD1  LEU  48          HD13      LEU  48  -3.536  -3.883   3.596
  364   1HD2  LEU  48          HD21      LEU  48  -0.321  -2.512   4.906
  365   2HD2  LEU  48          HD22      LEU  48  -0.080  -2.818   3.183
  366   3HD2  LEU  48          HD23      LEU  48   0.616  -3.910   4.380
  367    H    GLU  49           HN       GLU  49  -1.158  -5.107   8.519
  368    HA   GLU  49           HA       GLU  49  -3.452  -6.639   9.336
  369   1HB   GLU  49          HB2       GLU  49  -0.972  -7.366   9.187
  370   2HB   GLU  49          HB1       GLU  49  -0.735  -6.467  10.662
  371   1HG   GLU  49          HG2       GLU  49  -2.744  -8.699  10.510
  372   2HG   GLU  49          HG1       GLU  49  -1.034  -9.013  10.742
  373    H    ARG  50           HN       ARG  50  -2.119  -3.604  10.028
  374    HA   ARG  50           HA       ARG  50  -3.026  -3.532  12.796
  375   1HB   ARG  50          HB2       ARG  50  -0.907  -2.386  11.857
  376   2HB   ARG  50          HB1       ARG  50  -2.018  -1.157  11.277
  377   1HG   ARG  50          HG2       ARG  50  -1.302  -0.290  13.302
  378   2HG   ARG  50          HG1       ARG  50  -2.829  -1.058  13.738
  379   1HD   ARG  50          HD2       ARG  50  -0.063  -2.216  14.113
  380   2HD   ARG  50          HD1       ARG  50  -1.107  -1.598  15.389
  381    HE   ARG  50           HE       ARG  50  -2.663  -3.473  14.631
  382   1HH1  ARG  50          HH11      ARG  50   0.880  -3.719  14.606
  383   2HH1  ARG  50          HH12      ARG  50   0.870  -5.431  14.652
  384   1HH2  ARG  50          HH21      ARG  50  -2.636  -5.783  14.645
  385   2HH2  ARG  50          HH22      ARG  50  -1.162  -6.619  14.529
  386    H    GLU  51           HN       GLU  51  -3.536  -1.461   9.942
  387    HA   GLU  51           HA       GLU  51  -5.737  -0.098  11.091
  388   1HB   GLU  51          HB2       GLU  51  -5.037  -0.291   8.158
  389   2HB   GLU  51          HB1       GLU  51  -6.016   0.944   8.927
  390   1HG   GLU  51          HG2       GLU  51  -3.049   0.511   9.225
  391   2HG   GLU  51          HG1       GLU  51  -3.861   1.850   8.425
  392    H    HIS  52           HN       HIS  52  -5.399  -2.783   8.865
  393    HA   HIS  52           HA       HIS  52  -8.299  -3.073   8.967
  394   1HB   HIS  52          HB2       HIS  52  -6.377  -3.757   6.801
  395   2HB   HIS  52          HB1       HIS  52  -7.810  -4.751   6.972
  396    HD1  HIS  52           HD1      HIS  52  -9.664  -3.999   5.562
  397    HD2  HIS  52           HD2      HIS  52  -7.189  -0.849   6.663
  398    HE1  HIS  52           HE1      HIS  52 -10.592  -1.974   4.420
  399    HE2  HIS  52           HE2      HIS  52  -9.239  -0.058   5.375
  400    H    ASP  53           HN       ASP  53  -6.145  -5.647   8.022
  401    HA   ASP  53           HA       ASP  53  -6.111  -7.142  10.233
  402   1HB   ASP  53          HB2       ASP  53  -7.985  -8.780   9.849
  403   2HB   ASP  53          HB1       ASP  53  -8.550  -7.176  10.293
  404    H    LEU  54           HN       LEU  54  -5.055  -6.496   7.362
  405    HA   LEU  54           HA       LEU  54  -5.123  -9.117   6.123
  406   1HB   LEU  54          HB2       LEU  54  -4.302  -6.398   5.144
  407   2HB   LEU  54          HB1       LEU  54  -3.862  -7.847   4.268
  408    HG   LEU  54           HG       LEU  54  -6.305  -8.306   3.955
  409   1HD1  LEU  54          HD11      LEU  54  -6.643  -5.556   5.126
  410   2HD1  LEU  54          HD12      LEU  54  -7.195  -7.067   5.849
  411   3HD1  LEU  54          HD13      LEU  54  -7.899  -6.505   4.333
  412   1HD2  LEU  54          HD21      LEU  54  -4.995  -7.235   2.222
  413   2HD2  LEU  54          HD22      LEU  54  -5.290  -5.656   2.953
  414   3HD2  LEU  54          HD23      LEU  54  -6.627  -6.567   2.262
  415    H    VAL  55           HN       VAL  55  -3.587 -10.449   6.710
  416    HA   VAL  55           HA       VAL  55  -0.957  -9.407   7.411
  417    HB   VAL  55           HB       VAL  55  -1.799 -12.316   7.246
  418   1HG1  VAL  55          HG11      VAL  55   0.592 -11.977   7.174
  419   2HG1  VAL  55          HG12      VAL  55   0.139 -12.707   8.709
  420   3HG1  VAL  55          HG13      VAL  55   0.527 -10.987   8.631
  421   1HG2  VAL  55          HG21      VAL  55  -3.226 -11.213   8.884
  422   2HG2  VAL  55          HG22      VAL  55  -1.814 -10.522   9.677
  423   3HG2  VAL  55          HG23      VAL  55  -2.069 -12.269   9.697
  424    H    LEU  56           HN       LEU  56  -0.378  -8.573   5.473
  425    HA   LEU  56           HA       LEU  56  -0.220 -10.374   3.212
  426   1HB   LEU  56          HB2       LEU  56   0.557  -7.470   3.452
  427   2HB   LEU  56          HB1       LEU  56   0.672  -8.407   1.980
  428    HG   LEU  56           HG       LEU  56  -1.878  -7.665   3.424
  429   1HD1  LEU  56          HD11      LEU  56  -2.342  -6.366   1.406
  430   2HD1  LEU  56          HD12      LEU  56  -0.759  -6.808   0.765
  431   3HD1  LEU  56          HD13      LEU  56  -0.876  -5.818   2.221
  432   1HD2  LEU  56          HD21      LEU  56  -2.063  -9.890   2.426
  433   2HD2  LEU  56          HD22      LEU  56  -1.499  -9.250   0.881
  434   3HD2  LEU  56          HD23      LEU  56  -3.043  -8.719   1.546
  435    HA   PRO  57           HA       PRO  57   3.786 -11.522   4.670
  436   1HB   PRO  57          HB2       PRO  57   3.659 -13.322   2.359
  437   2HB   PRO  57          HB1       PRO  57   3.781 -13.718   4.078
  438   1HG   PRO  57          HG2       PRO  57   1.512 -14.185   2.756
  439   2HG   PRO  57          HG1       PRO  57   1.461 -13.502   4.402
  440   1HD   PRO  57          HD2       PRO  57   1.295 -12.055   1.782
  441   2HD   PRO  57          HD1       PRO  57   0.193 -11.966   3.183
  442    H    ILE  58           HN       ILE  58   5.923 -11.796   3.735
  443    HA   ILE  58           HA       ILE  58   6.565  -9.538   2.140
  444    HB   ILE  58           HB       ILE  58   8.360 -11.772   3.176
  445   1HG1  ILE  58          HG12      ILE  58   9.268  -9.858   4.643
  446   2HG1  ILE  58          HG11      ILE  58   7.867  -8.948   4.103
  447   1HG2  ILE  58          HG21      ILE  58   9.372 -10.862   1.176
  448   2HG2  ILE  58          HG22      ILE  58  10.292 -10.369   2.596
  449   3HG2  ILE  58          HG23      ILE  58   9.217  -9.222   1.802
  450   1HD1  ILE  58          HD11      ILE  58   6.393 -10.570   5.157
  451   2HD1  ILE  58          HD12      ILE  58   7.533  -9.896   6.320
  452   3HD1  ILE  58          HD13      ILE  58   7.787 -11.517   5.672
  453    H    ARG  59           HN       ARG  59   6.173 -12.908   1.494
  454    HA   ARG  59           HA       ARG  59   7.370 -12.825  -1.078
  455   1HB   ARG  59          HB2       ARG  59   6.312 -15.007  -1.600
  456   2HB   ARG  59          HB1       ARG  59   7.201 -15.020  -0.096
  457   1HG   ARG  59          HG2       ARG  59   4.246 -14.599  -0.103
  458   2HG   ARG  59          HG1       ARG  59   4.918 -16.217  -0.289
  459   1HD   ARG  59          HD2       ARG  59   5.441 -14.325   2.007
  460   2HD   ARG  59          HD1       ARG  59   4.375 -15.717   2.043
  461    HE   ARG  59           HE       ARG  59   7.053 -16.369   1.262
  462   1HH1  ARG  59          HH11      ARG  59   4.784 -16.124   3.938
  463   2HH1  ARG  59          HH12      ARG  59   5.773 -16.877   5.095
  464   1HH2  ARG  59          HH21      ARG  59   8.459 -17.482   2.803
  465   2HH2  ARG  59          HH22      ARG  59   7.922 -17.673   4.418
  466    H    GLU  60           HN       GLU  60   4.588 -11.452  -0.057
  467    HA   GLU  60           HA       GLU  60   3.621 -11.146  -2.809
  468   1HB   GLU  60          HB2       GLU  60   2.363 -10.742  -0.103
  469   2HB   GLU  60          HB1       GLU  60   1.773  -9.804  -1.459
  470   1HG   GLU  60          HG2       GLU  60   0.447 -11.831  -0.930
  471   2HG   GLU  60          HG1       GLU  60   1.031 -11.758  -2.584
  472    H    VAL  61           HN       VAL  61   4.151  -9.280   0.138
  473    HA   VAL  61           HA       VAL  61   3.987  -6.725  -0.846
  474    HB   VAL  61           HB       VAL  61   5.555  -7.727   1.535
  475   1HG1  VAL  61          HG11      VAL  61   4.735  -4.898   0.881
  476   2HG1  VAL  61          HG12      VAL  61   6.385  -5.520   0.892
  477   3HG1  VAL  61          HG13      VAL  61   5.461  -5.436   2.395
  478   1HG2  VAL  61          HG21      VAL  61   3.178  -8.200   1.616
  479   2HG2  VAL  61          HG22      VAL  61   2.813  -6.504   1.288
  480   3HG2  VAL  61          HG23      VAL  61   3.603  -6.964   2.798
  481    H    ARG  62           HN       ARG  62   7.016  -8.594  -0.552
  482    HA   ARG  62           HA       ARG  62   8.754  -6.425  -1.024
  483   1HB   ARG  62          HB2       ARG  62   9.375  -8.603  -0.036
  484   2HB   ARG  62          HB1       ARG  62   9.256  -9.328  -1.632
  485   1HG   ARG  62          HG2       ARG  62  10.974  -7.757  -2.412
  486   2HG   ARG  62          HG1       ARG  62  11.174  -7.192  -0.757
  487   1HD   ARG  62          HD2       ARG  62  12.863  -8.848  -1.216
  488   2HD   ARG  62          HD1       ARG  62  11.682  -9.577  -0.125
  489    HE   ARG  62           HE       ARG  62  11.049 -10.064  -2.865
  490   1HH1  ARG  62          HH11      ARG  62  13.166 -11.203  -0.246
  491   2HH1  ARG  62          HH12      ARG  62  13.388 -12.744  -0.907
  492   1HH2  ARG  62          HH21      ARG  62  11.282 -12.218  -3.735
  493   2HH2  ARG  62          HH22      ARG  62  12.235 -13.359  -2.890
  494    H    GLN  63           HN       GLN  63   6.957  -8.333  -3.201
  495    HA   GLN  63           HA       GLN  63   8.620  -7.791  -5.514
  496   1HB   GLN  63          HB2       GLN  63   6.029  -9.341  -5.262
  497   2HB   GLN  63          HB1       GLN  63   6.924  -9.136  -6.743
  498   1HG   GLN  63          HG2       GLN  63   7.361 -11.341  -5.844
  499   2HG   GLN  63          HG1       GLN  63   8.824 -10.376  -5.797
  500   1HE2  GLN  63          HE21      GLN  63   6.225 -10.097  -3.493
  501   2HE2  GLN  63          HE22      GLN  63   7.132 -10.717  -2.145
  502    H    LEU  64           HN       LEU  64   6.077  -6.383  -3.850
  503    HA   LEU  64           HA       LEU  64   4.522  -5.372  -5.982
  504   1HB   LEU  64          HB2       LEU  64   4.918  -4.177  -3.242
  505   2HB   LEU  64          HB1       LEU  64   3.655  -3.747  -4.365
  506    HG   LEU  64           HG       LEU  64   3.997  -6.339  -2.897
  507   1HD1  LEU  64          HD11      LEU  64   1.889  -4.201  -2.726
  508   2HD1  LEU  64          HD12      LEU  64   3.133  -4.559  -1.526
  509   3HD1  LEU  64          HD13      LEU  64   1.858  -5.733  -1.851
  510   1HD2  LEU  64          HD21      LEU  64   3.133  -6.802  -5.132
  511   2HD2  LEU  64          HD22      LEU  64   1.867  -5.594  -4.904
  512   3HD2  LEU  64          HD23      LEU  64   1.878  -7.058  -3.918
  513    H    THR  65           HN       THR  65   4.774  -3.639  -7.218
  514    HA   THR  65           HA       THR  65   7.228  -2.189  -7.059
  515    HB   THR  65           HB       THR  65   6.295  -1.218  -9.202
  516    HG1  THR  65           HG1      THR  65   4.431  -2.079  -9.987
  517   1HG2  THR  65          HG21      THR  65   6.368  -4.211  -8.961
  518   2HG2  THR  65          HG22      THR  65   7.773  -3.170  -9.173
  519   3HG2  THR  65          HG23      THR  65   6.565  -3.308 -10.468
  520    H    LEU  66           HN       LEU  66   7.168   0.115  -7.098
  521    HA   LEU  66           HA       LEU  66   6.193   1.103  -4.771
  522   1HB   LEU  66          HB2       LEU  66   7.966   2.039  -6.359
  523   2HB   LEU  66          HB1       LEU  66   6.655   2.886  -7.147
  524    HG   LEU  66           HG       LEU  66   7.945   4.304  -5.572
  525   1HD1  LEU  66          HD11      LEU  66   5.115   3.822  -4.732
  526   2HD1  LEU  66          HD12      LEU  66   5.643   4.909  -6.027
  527   3HD1  LEU  66          HD13      LEU  66   6.055   5.263  -4.339
  528   1HD2  LEU  66          HD21      LEU  66   8.547   2.616  -3.946
  529   2HD2  LEU  66          HD22      LEU  66   6.859   2.434  -3.480
  530   3HD2  LEU  66          HD23      LEU  66   7.704   3.949  -3.155
  531    H    ARG  67           HN       ARG  67   4.482   1.549  -7.927
  532    HA   ARG  67           HA       ARG  67   2.427   2.903  -6.412
  533   1HB   ARG  67          HB2       ARG  67   3.022   2.768  -9.323
  534   2HB   ARG  67          HB1       ARG  67   1.393   3.165  -8.792
  535   1HG   ARG  67          HG2       ARG  67   3.885   4.629  -7.955
  536   2HG   ARG  67          HG1       ARG  67   2.748   5.163  -9.201
  537   1HD   ARG  67          HD2       ARG  67   0.944   5.103  -7.481
  538   2HD   ARG  67          HD1       ARG  67   2.161   4.722  -6.283
  539    HE   ARG  67           HE       ARG  67   2.883   6.885  -6.293
  540   1HH1  ARG  67          HH11      ARG  67   0.733   6.443  -9.076
  541   2HH1  ARG  67          HH12      ARG  67   0.398   8.085  -9.281
  542   1HH2  ARG  67          HH21      ARG  67   2.392   9.227  -6.546
  543   2HH2  ARG  67          HH22      ARG  67   1.327   9.694  -7.783
  544    H    LYS  68           HN       LYS  68   3.051  -0.183  -7.048
  545    HA   LYS  68           HA       LYS  68   0.336  -1.009  -7.531
  546   1HB   LYS  68          HB2       LYS  68   2.273  -2.378  -8.282
  547   2HB   LYS  68          HB1       LYS  68   2.737  -2.617  -6.605
  548   1HG   LYS  68          HG2       LYS  68   0.705  -3.866  -6.190
  549   2HG   LYS  68          HG1       LYS  68   0.154  -3.560  -7.835
  550   1HD   LYS  68          HD2       LYS  68   2.659  -5.087  -7.100
  551   2HD   LYS  68          HD1       LYS  68   1.122  -5.824  -7.533
  552   1HE   LYS  68          HE2       LYS  68   2.800  -4.045  -9.321
  553   2HE   LYS  68          HE1       LYS  68   2.688  -5.798  -9.424
  554   1HZ   LYS  68          HZ1       LYS  68   0.510  -3.843  -9.920
  555   2HZ   LYS  68          HZ2       LYS  68   0.255  -5.485  -9.817
  556   3HZ   LYS  68          HZ3       LYS  68   1.215  -4.871 -11.058
  557    H    LEU  69           HN       LEU  69   2.362  -0.185  -4.939
  558    HA   LEU  69           HA       LEU  69   1.127  -1.393  -2.759
  559   1HB   LEU  69          HB2       LEU  69   2.667   1.135  -3.019
  560   2HB   LEU  69          HB1       LEU  69   1.781   0.867  -1.536
  561    HG   LEU  69           HG       LEU  69   4.078   0.219  -1.253
  562   1HD1  LEU  69          HD11      LEU  69   2.264  -2.173  -1.375
  563   2HD1  LEU  69          HD12      LEU  69   2.399  -1.032  -0.048
  564   3HD1  LEU  69          HD13      LEU  69   3.772  -2.068  -0.461
  565   1HD2  LEU  69          HD21      LEU  69   5.070  -1.630  -2.503
  566   2HD2  LEU  69          HD22      LEU  69   4.632  -0.293  -3.572
  567   3HD2  LEU  69          HD23      LEU  69   3.615  -1.735  -3.494
  568    H    GLN  70           HN       GLN  70   0.038   1.495  -4.465
  569    HA   GLN  70           HA       GLN  70  -2.014   1.849  -2.469
  570   1HB   GLN  70          HB2       GLN  70  -2.867   3.721  -3.922
  571   2HB   GLN  70          HB1       GLN  70  -1.258   3.920  -3.263
  572   1HG   GLN  70          HG2       GLN  70  -0.258   3.475  -5.331
  573   2HG   GLN  70          HG1       GLN  70  -1.801   2.981  -6.078
  574   1HE2  GLN  70          HE21      GLN  70  -1.691   4.562  -7.663
  575   2HE2  GLN  70          HE22      GLN  70  -1.842   6.247  -7.312
  576    H    GLU  71           HN       GLU  71  -1.708  -0.155  -5.022
  577    HA   GLU  71           HA       GLU  71  -4.567  -0.200  -5.595
  578   1HB   GLU  71          HB2       GLU  71  -2.795  -0.412  -7.425
  579   2HB   GLU  71          HB1       GLU  71  -2.413  -1.988  -6.744
  580   1HG   GLU  71          HG2       GLU  71  -3.896  -2.194  -8.646
  581   2HG   GLU  71          HG1       GLU  71  -4.699  -2.720  -7.161
  582    H    MET  72           HN       MET  72  -2.007  -1.887  -3.977
  583    HA   MET  72           HA       MET  72  -3.819  -4.005  -3.038
  584   1HB   MET  72          HB2       MET  72  -0.808  -3.714  -2.872
  585   2HB   MET  72          HB1       MET  72  -1.717  -5.045  -2.178
  586   1HG   MET  72          HG2       MET  72  -1.475  -4.355  -5.095
  587   2HG   MET  72          HG1       MET  72  -0.700  -5.701  -4.260
  588   1HE   MET  72          HE1       MET  72  -1.599  -7.496  -5.941
  589   2HE   MET  72          HE2       MET  72  -2.314  -6.202  -6.903
  590   3HE   MET  72          HE3       MET  72  -3.283  -7.604  -6.456
  591    H    SER  73           HN       SER  73  -3.946  -1.257  -2.188
  592    HA   SER  73           HA       SER  73  -2.600  -1.035   0.331
  593   1HB   SER  73          HB2       SER  73  -2.937   0.860  -1.279
  594   2HB   SER  73          HB1       SER  73  -4.654   0.770  -0.948
  595    HG   SER  73           HG       SER  73  -4.121   1.279   1.286
  596    H    SER  74           HN       SER  74  -5.848  -1.417  -0.922
  597    HA   SER  74           HA       SER  74  -7.783  -2.173  -0.114
  598   1HB   SER  74          HB2       SER  74  -6.447  -4.157   0.598
  599   2HB   SER  74          HB1       SER  74  -6.161  -3.374   2.154
  600    HG   SER  74           HG       SER  74  -8.216  -4.899   1.440
  601    H    LYS  75           HN       LYS  75  -8.386  -0.034   0.155
  602    HA   LYS  75           HA       LYS  75  -8.320   1.103   2.839
  603   1HB   LYS  75          HB2       LYS  75  -9.606   2.137   0.303
  604   2HB   LYS  75          HB1       LYS  75  -9.415   3.030   1.798
  605   1HG   LYS  75          HG2       LYS  75  -6.975   2.951   1.505
  606   2HG   LYS  75          HG1       LYS  75  -7.214   2.113  -0.037
  607   1HD   LYS  75          HD2       LYS  75  -8.516   4.004  -0.867
  608   2HD   LYS  75          HD1       LYS  75  -8.286   4.841   0.668
  609   1HE   LYS  75          HE2       LYS  75  -6.731   5.706  -0.963
  610   2HE   LYS  75          HE1       LYS  75  -5.853   4.803   0.270
  611   1HZ   LYS  75          HZ1       LYS  75  -5.118   4.399  -1.997
  612   2HZ   LYS  75          HZ2       LYS  75  -6.616   3.677  -2.371
  613   3HZ   LYS  75          HZ3       LYS  75  -5.606   2.980  -1.206
  614    H    ALA  76           HN       ALA  76 -10.539   0.066   0.336
  615    HA   ALA  76           HA       ALA  76 -12.396  -1.193   2.014
  616   1HB   ALA  76          HB1       ALA  76 -14.312   0.326   1.733
  617   2HB   ALA  76          HB2       ALA  76 -13.265   1.512   0.955
  618   3HB   ALA  76          HB3       ALA  76 -13.026   1.107   2.654
  619    H    GLY  77           HN       GLY  77 -13.252  -2.680   0.711
  620   1HA   GLY  77          HA2       GLY  77 -13.183  -2.241  -2.178
  621   2HA   GLY  77          HA1       GLY  77 -13.575  -3.761  -1.353
  622    H    SER  78           HN       SER  78 -15.550  -4.076  -0.486
  623    HA   SER  78           HA       SER  78 -17.769  -3.932  -0.148
  624   1HB   SER  78          HB2       SER  78 -17.111  -0.994   0.084
  625   2HB   SER  78          HB1       SER  78 -18.564  -1.777   0.715
  626    HG   SER  78           HG       SER  78 -17.424  -2.174   2.418
  627    H    ASP  79           HN       ASP  79 -16.928  -3.765  -3.042
  628    HA   ASP  79           HA       ASP  79 -18.874  -2.010  -4.271
  629   1HB   ASP  79          HB2       ASP  79 -17.306  -4.321  -5.436
  630   2HB   ASP  79          HB1       ASP  79 -18.404  -3.320  -6.372
  631    H    THR  80           HN       THR  80 -18.852  -5.064  -2.906
  632    HA   THR  80           HA       THR  80 -21.072  -6.205  -4.222
  633    HB   THR  80           HB       THR  80 -20.714  -7.763  -2.131
  634    HG1  THR  80           HG1      THR  80 -19.390  -6.425  -0.939
  635   1HG2  THR  80          HG21      THR  80 -18.863  -8.855  -3.342
  636   2HG2  THR  80          HG22      THR  80 -18.631  -7.396  -4.305
  637   3HG2  THR  80          HG23      THR  80 -20.121  -8.327  -4.459
  638    H    GLU  81           HN       GLU  81 -21.038  -3.615  -2.262
  639    HA   GLU  81           HA       GLU  81 -23.703  -4.194  -1.307
  640   1HB   GLU  81          HB2       GLU  81 -23.199  -2.814   0.752
  641   2HB   GLU  81          HB1       GLU  81 -22.397  -4.375   0.693
  642   1HG   GLU  81          HG2       GLU  81 -20.371  -3.186  -0.156
  643   2HG   GLU  81          HG1       GLU  81 -21.205  -1.673   0.184
  644    H    LEU  82           HN       LEU  82 -25.078  -2.855  -2.081
  645    HA   LEU  82           HA       LEU  82 -24.106  -0.296  -3.158
  646   1HB   LEU  82          HB2       LEU  82 -26.331  -2.059  -4.193
  647   2HB   LEU  82          HB1       LEU  82 -25.886  -0.499  -4.856
  648    HG   LEU  82           HG       LEU  82 -24.088  -2.928  -4.813
  649   1HD1  LEU  82          HD11      LEU  82 -25.979  -3.253  -6.302
  650   2HD1  LEU  82          HD12      LEU  82 -24.486  -3.027  -7.215
  651   3HD1  LEU  82          HD13      LEU  82 -25.648  -1.703  -7.075
  652   1HD2  LEU  82          HD21      LEU  82 -23.772  -0.242  -6.158
  653   2HD2  LEU  82          HD22      LEU  82 -22.682  -1.619  -6.336
  654   3HD2  LEU  82          HD23      LEU  82 -22.852  -0.824  -4.770
  655    H    ALA  83           HN       ALA  83 -26.640  -1.967  -1.435
  656    HA   ALA  83           HA       ALA  83 -27.953   0.589  -0.825
  657   1HB   ALA  83          HB1       ALA  83 -28.883  -2.259  -0.417
  658   2HB   ALA  83          HB2       ALA  83 -29.414  -1.181  -1.706
  659   3HB   ALA  83          HB3       ALA  83 -29.815  -0.817  -0.029
  660    H    ALA  84           HN       ALA  84 -25.427  -0.256   0.195
  661    HA   ALA  84           HA       ALA  84 -25.594  -1.254   2.838
  662   1HB   ALA  84          HB1       ALA  84 -23.528  -1.339   1.528
  663   2HB   ALA  84          HB2       ALA  84 -23.284  -0.455   3.034
  664   3HB   ALA  84          HB3       ALA  84 -23.459   0.424   1.515
  665    HA   PRO  85           HA       PRO  85 -27.114   2.446   4.722
  666   1HB   PRO  85          HB2       PRO  85 -26.112   1.457   7.269
  667   2HB   PRO  85          HB1       PRO  85 -27.785   1.603   6.721
  668   1HG   PRO  85          HG2       PRO  85 -26.564  -0.789   7.097
  669   2HG   PRO  85          HG1       PRO  85 -27.840  -0.528   5.899
  670   1HD   PRO  85          HD2       PRO  85 -24.883  -0.664   5.517
  671   2HD   PRO  85          HD1       PRO  85 -26.186  -1.340   4.514
  672    H    LYS  86           HN       LYS  86 -26.240   4.394   5.192
  673    HA   LYS  86           HA       LYS  86 -23.428   4.743   5.085
  674   1HB   LYS  86          HB2       LYS  86 -23.885   7.133   5.572
  675   2HB   LYS  86          HB1       LYS  86 -24.859   6.497   4.257
  676   1HG   LYS  86          HG2       LYS  86 -26.793   6.340   5.717
  677   2HG   LYS  86          HG1       LYS  86 -25.820   6.863   7.091
  678   1HD   LYS  86          HD2       LYS  86 -27.189   8.694   6.167
  679   2HD   LYS  86          HD1       LYS  86 -25.464   9.029   6.044
  680   1HE   LYS  86          HE2       LYS  86 -26.609   9.673   4.000
  681   2HE   LYS  86          HE1       LYS  86 -25.502   8.341   3.691
  682   1HZ   LYS  86          HZ1       LYS  86 -27.474   6.826   3.803
  683   2HZ   LYS  86          HZ2       LYS  86 -27.504   7.945   2.558
  684   3HZ   LYS  86          HZ3       LYS  86 -28.477   8.194   3.896
  685    H    SER  87           HN       SER  87 -25.676   4.320   7.662
  686    HA   SER  87           HA       SER  87 -25.548   4.072   9.810
  687   1HB   SER  87          HB2       SER  87 -22.553   3.813   9.396
  688   2HB   SER  87          HB1       SER  87 -23.417   3.376  10.874
  689    HG   SER  87           HG       SER  87 -23.187   2.038   8.491
  690    H    LYS  88           HN       LYS  88 -26.368   5.813  10.477
  691    HA   LYS  88           HA       LYS  88 -24.954   8.317  10.341
  692   1HB   LYS  88          HB2       LYS  88 -27.077   9.337  11.009
  693   2HB   LYS  88          HB1       LYS  88 -27.243   8.293   9.612
  694   1HG   LYS  88          HG2       LYS  88 -28.188   6.542  11.063
  695   2HG   LYS  88          HG1       LYS  88 -28.058   7.644  12.440
  696   1HD   LYS  88          HD2       LYS  88 -29.521   9.238  11.299
  697   2HD   LYS  88          HD1       LYS  88 -29.650   8.139   9.928
  698   1HE   LYS  88          HE2       LYS  88 -31.609   7.946  11.310
  699   2HE   LYS  88          HE1       LYS  88 -30.673   6.459  11.410
  700   1HZ   LYS  88          HZ1       LYS  88 -29.878   7.108  13.597
  701   2HZ   LYS  88          HZ2       LYS  88 -31.558   7.301  13.559
  702   3HZ   LYS  88          HZ3       LYS  88 -30.553   8.636  13.419
  703    H    ASN  89           HN       ASN  89 -25.589   9.852  12.323
  704    HA   ASN  89           HA       ASN  89 -24.852   8.496  14.771
  705   1HB   ASN  89          HB2       ASN  89 -23.107  10.145  15.285
  706   2HB   ASN  89          HB1       ASN  89 -22.731   9.330  13.776
  707   1HD2  ASN  89          HD21      ASN  89 -23.423  12.299  15.311
  708   2HD2  ASN  89          HD22      ASN  89 -23.237  13.328  13.934
  Start of MODEL   20
    1   1H    GLY   1          HT1       GLY   1 -16.001  -2.080  12.539
    2   2H    GLY   1          HT2       GLY   1 -15.924  -3.462  11.555
    3   3H    GLY   1          HT3       GLY   1 -17.283  -3.203  12.555
    4   1HA   GLY   1          HA1       GLY   1 -17.727  -2.713  10.238
    5   2HA   GLY   1          HA2       GLY   1 -17.894  -1.300  11.281
    6    H    ASP   2           HN       ASP   2 -17.452   0.124   9.585
    7    HA   ASP   2           HA       ASP   2 -14.711  -0.023   8.564
    8   1HB   ASP   2          HB2       ASP   2 -17.119   1.375   7.362
    9   2HB   ASP   2          HB1       ASP   2 -15.478   1.561   6.763
   10    H    GLY   3           HN       GLY   3 -13.809   0.868  10.304
   11   1HA   GLY   3          HA2       GLY   3 -14.551   3.676  10.823
   12   2HA   GLY   3          HA1       GLY   3 -13.959   2.585  12.070
   13    H    GLU   4           HN       GLU   4 -11.910   1.341  10.613
   14    HA   GLU   4           HA       GLU   4  -9.859   3.241  11.023
   15   1HB   GLU   4          HB2       GLU   4  -9.703   0.541   9.663
   16   2HB   GLU   4          HB1       GLU   4  -8.344   1.485  10.246
   17   1HG   GLU   4          HG2       GLU   4 -10.491   0.181  11.906
   18   2HG   GLU   4          HG1       GLU   4  -8.802  -0.303  11.775
   19    H    ALA   5           HN       ALA   5  -9.525   4.870   9.672
   20    HA   ALA   5           HA       ALA   5 -10.144   4.640   6.877
   21   1HB   ALA   5          HB1       ALA   5 -10.574   6.762   8.045
   22   2HB   ALA   5          HB2       ALA   5  -9.387   6.980   6.762
   23   3HB   ALA   5          HB3       ALA   5  -8.860   6.889   8.442
   24    H    GLN   6           HN       GLN   6  -8.829   3.483   5.753
   25    HA   GLN   6           HA       GLN   6  -6.141   2.948   6.463
   26   1HB   GLN   6          HB2       GLN   6  -7.724   1.484   5.109
   27   2HB   GLN   6          HB1       GLN   6  -7.409   2.564   3.760
   28   1HG   GLN   6          HG2       GLN   6  -5.959   0.793   3.408
   29   2HG   GLN   6          HG1       GLN   6  -4.942   2.030   4.146
   30   1HE2  GLN   6          HE21      GLN   6  -4.222   1.697   6.323
   31   2HE2  GLN   6          HE22      GLN   6  -4.288   0.112   7.002
   32    H    ARG   7           HN       ARG   7  -4.421   4.076   5.978
   33    HA   ARG   7           HA       ARG   7  -4.478   6.539   4.541
   34   1HB   ARG   7          HB2       ARG   7  -2.075   6.585   4.912
   35   2HB   ARG   7          HB1       ARG   7  -2.872   6.059   6.389
   36   1HG   ARG   7          HG2       ARG   7  -2.250   3.762   5.976
   37   2HG   ARG   7          HG1       ARG   7  -1.630   4.186   4.382
   38   1HD   ARG   7          HD2       ARG   7   0.202   3.902   5.912
   39   2HD   ARG   7          HD1       ARG   7   0.082   5.586   5.430
   40    HE   ARG   7           HE       ARG   7  -1.053   4.682   7.983
   41   1HH1  ARG   7          HH11      ARG   7   1.304   6.627   6.208
   42   2HH1  ARG   7          HH12      ARG   7   1.827   7.536   7.542
   43   1HH2  ARG   7          HH21      ARG   7  -0.349   5.908   9.862
   44   2HH2  ARG   7          HH22      ARG   7   0.844   7.095   9.721
   45    H    ASP   8           HN       ASP   8  -2.936   6.888   2.663
   46    HA   ASP   8           HA       ASP   8  -3.265   4.755   0.756
   47   1HB   ASP   8          HB2       ASP   8  -3.414   7.182   0.114
   48   2HB   ASP   8          HB1       ASP   8  -1.691   7.322   0.469
   49    H    LEU   9           HN       LEU   9  -1.679   3.334   0.189
   50    HA   LEU   9           HA       LEU   9   0.399   3.037   2.103
   51   1HB   LEU   9          HB2       LEU   9  -0.149   1.443  -0.372
   52   2HB   LEU   9          HB1       LEU   9   1.045   1.033   0.840
   53    HG   LEU   9           HG       LEU   9  -1.940   1.097   1.183
   54   1HD1  LEU   9          HD11      LEU   9  -1.105  -0.846   0.016
   55   2HD1  LEU   9          HD12      LEU   9  -1.653  -1.285   1.634
   56   3HD1  LEU   9          HD13      LEU   9   0.072  -1.134   1.297
   57   1HD2  LEU   9          HD21      LEU   9   0.206   0.558   3.239
   58   2HD2  LEU   9          HD22      LEU   9  -1.525   0.328   3.482
   59   3HD2  LEU   9          HD23      LEU   9  -0.879   1.949   3.204
   60    H    VAL  10           HN       VAL  10   0.320   4.636  -0.931
   61    HA   VAL  10           HA       VAL  10   3.162   4.424  -1.283
   62    HB   VAL  10           HB       VAL  10   1.062   6.158  -2.642
   63   1HG1  VAL  10          HG11      VAL  10   3.985   5.838  -3.373
   64   2HG1  VAL  10          HG12      VAL  10   3.252   7.296  -2.706
   65   3HG1  VAL  10          HG13      VAL  10   2.775   6.722  -4.304
   66   1HG2  VAL  10          HG21      VAL  10   0.884   3.799  -3.103
   67   2HG2  VAL  10          HG22      VAL  10   2.588   3.736  -3.555
   68   3HG2  VAL  10          HG23      VAL  10   1.447   4.665  -4.530
   69    H    LYS  11           HN       LYS  11   0.913   6.387   0.358
   70    HA   LYS  11           HA       LYS  11   2.826   8.494   0.890
   71   1HB   LYS  11          HB2       LYS  11   0.172   8.040   2.256
   72   2HB   LYS  11          HB1       LYS  11   1.159   9.500   2.201
   73   1HG   LYS  11          HG2       LYS  11  -0.253   8.255  -0.136
   74   2HG   LYS  11          HG1       LYS  11  -0.780   9.682   0.756
   75   1HD   LYS  11          HD2       LYS  11   1.285  10.833   0.086
   76   2HD   LYS  11          HD1       LYS  11   1.760   9.405  -0.843
   77   1HE   LYS  11          HE2       LYS  11   0.760  11.007  -2.327
   78   2HE   LYS  11          HE1       LYS  11  -0.316   9.621  -2.155
   79   1HZ   LYS  11          HZ1       LYS  11  -1.563  10.982  -0.453
   80   2HZ   LYS  11          HZ2       LYS  11  -1.612  11.552  -2.034
   81   3HZ   LYS  11          HZ3       LYS  11  -0.589  12.294  -0.914
   82    H    ALA  12           HN       ALA  12   2.685   5.494   1.811
   83    HA   ALA  12           HA       ALA  12   3.714   6.006   4.510
   84   1HB   ALA  12          HB1       ALA  12   2.424   3.497   3.436
   85   2HB   ALA  12          HB2       ALA  12   1.672   4.654   4.533
   86   3HB   ALA  12          HB3       ALA  12   3.064   3.706   5.066
   87    H    VAL  13           HN       VAL  13   3.896   3.405   2.070
   88    HA   VAL  13           HA       VAL  13   6.461   2.535   2.840
   89    HB   VAL  13           HB       VAL  13   4.981   2.058   0.240
   90   1HG1  VAL  13          HG11      VAL  13   7.268   0.519   1.465
   91   2HG1  VAL  13          HG12      VAL  13   7.338   1.548   0.031
   92   3HG1  VAL  13          HG13      VAL  13   6.372   0.070   0.005
   93   1HG2  VAL  13          HG21      VAL  13   5.049   0.424   2.777
   94   2HG2  VAL  13          HG22      VAL  13   4.266  -0.050   1.269
   95   3HG2  VAL  13          HG23      VAL  13   3.676   1.349   2.167
   96    H    ALA  14           HN       ALA  14   5.373   4.394   0.029
   97    HA   ALA  14           HA       ALA  14   7.985   4.744  -0.992
   98   1HB   ALA  14          HB1       ALA  14   5.490   6.359  -1.530
   99   2HB   ALA  14          HB2       ALA  14   5.987   4.924  -2.415
  100   3HB   ALA  14          HB3       ALA  14   6.961   6.398  -2.505
  101    H    HIS  15           HN       HIS  15   5.973   6.491   1.215
  102    HA   HIS  15           HA       HIS  15   7.494   8.870   1.308
  103   1HB   HIS  15          HB2       HIS  15   5.152   8.753   2.071
  104   2HB   HIS  15          HB1       HIS  15   5.629   7.711   3.398
  105    HD1  HIS  15           HD1      HIS  15   5.852  11.345   2.231
  106    HD2  HIS  15           HD2      HIS  15   6.601   9.037   5.636
  107    HE1  HIS  15           HE1      HIS  15   6.191  12.954   4.078
  108    HE2  HIS  15           HE2      HIS  15   6.872  11.572   6.054
  109    H    ILE  16           HN       ILE  16   7.921   5.770   2.808
  110    HA   ILE  16           HA       ILE  16   9.790   6.521   4.787
  111    HB   ILE  16           HB       ILE  16   9.564   3.905   3.247
  112   1HG1  ILE  16          HG12      ILE  16   7.557   4.367   4.536
  113   2HG1  ILE  16          HG11      ILE  16   8.457   3.056   5.289
  114   1HG2  ILE  16          HG21      ILE  16  10.877   2.869   5.039
  115   2HG2  ILE  16          HG22      ILE  16  11.119   4.455   5.766
  116   3HG2  ILE  16          HG23      ILE  16  11.796   4.105   4.176
  117   1HD1  ILE  16          HD11      ILE  16   8.419   5.926   6.199
  118   2HD1  ILE  16          HD12      ILE  16   9.324   4.616   6.958
  119   3HD1  ILE  16          HD13      ILE  16   7.560   4.581   6.952
  120    H    LEU  17           HN       LEU  17  10.139   5.570   1.405
  121    HA   LEU  17           HA       LEU  17  12.974   5.962   1.318
  122   1HB   LEU  17          HB2       LEU  17  10.933   5.731  -0.890
  123   2HB   LEU  17          HB1       LEU  17  12.660   5.823  -1.161
  124    HG   LEU  17           HG       LEU  17  11.235   3.615   0.314
  125   1HD1  LEU  17          HD11      LEU  17  12.485   3.676  -2.428
  126   2HD1  LEU  17          HD12      LEU  17  10.760   3.592  -2.070
  127   3HD1  LEU  17          HD13      LEU  17  11.818   2.251  -1.630
  128   1HD2  LEU  17          HD21      LEU  17  13.406   2.485   0.252
  129   2HD2  LEU  17          HD22      LEU  17  13.500   4.002   1.149
  130   3HD2  LEU  17          HD23      LEU  17  14.132   3.911  -0.493
  131    H    GLY  18           HN       GLY  18  10.231   7.948   0.950
  132   1HA   GLY  18          HA2       GLY  18  10.456  10.336   1.255
  133   2HA   GLY  18          HA1       GLY  18  11.992  10.248   0.401
  134    H    ILE  19           HN       ILE  19   9.498   8.360  -0.923
  135    HA   ILE  19           HA       ILE  19   9.171  10.342  -3.017
  136    HB   ILE  19           HB       ILE  19   8.344   8.230  -4.335
  137   1HG1  ILE  19          HG12      ILE  19  10.237   7.014  -2.305
  138   2HG1  ILE  19          HG11      ILE  19   8.557   6.582  -2.606
  139   1HG2  ILE  19          HG21      ILE  19  10.101   9.678  -5.064
  140   2HG2  ILE  19          HG22      ILE  19  10.592   7.999  -5.299
  141   3HG2  ILE  19          HG23      ILE  19  11.246   8.927  -3.942
  142   1HD1  ILE  19          HD11      ILE  19  10.849   6.151  -4.503
  143   2HD1  ILE  19          HD12      ILE  19   9.167   5.722  -4.804
  144   3HD1  ILE  19          HD13      ILE  19  10.064   4.918  -3.512
  145    H    ARG  20           HN       ARG  20   7.304  10.774  -3.897
  146    HA   ARG  20           HA       ARG  20   4.813   9.615  -2.912
  147   1HB   ARG  20          HB2       ARG  20   5.276  11.396  -1.319
  148   2HB   ARG  20          HB1       ARG  20   5.561  12.527  -2.632
  149   1HG   ARG  20          HG2       ARG  20   3.247  12.313  -3.319
  150   2HG   ARG  20          HG1       ARG  20   2.954  11.189  -1.990
  151   1HD   ARG  20          HD2       ARG  20   2.220  13.409  -1.364
  152   2HD   ARG  20          HD1       ARG  20   3.625  12.956  -0.403
  153    HE   ARG  20           HE       ARG  20   4.471  14.385  -2.676
  154   1HH1  ARG  20          HH11      ARG  20   2.912  14.868   0.471
  155   2HH1  ARG  20          HH12      ARG  20   3.192  16.545   0.521
  156   1HH2  ARG  20          HH21      ARG  20   4.983  16.732  -2.544
  157   2HH2  ARG  20          HH22      ARG  20   4.460  17.578  -1.169
  158    H    ASP  21           HN       ASP  21   6.401  12.137  -4.754
  159    HA   ASP  21           HA       ASP  21   4.333  12.334  -6.739
  160   1HB   ASP  21          HB2       ASP  21   7.136  13.474  -6.677
  161   2HB   ASP  21          HB1       ASP  21   5.901  13.882  -7.857
  162    H    LEU  22           HN       LEU  22   7.456  10.882  -6.414
  163    HA   LEU  22           HA       LEU  22   8.455   9.160  -7.513
  164   1HB   LEU  22          HB2       LEU  22   5.625   8.742  -8.386
  165   2HB   LEU  22          HB1       LEU  22   6.899   7.806  -9.134
  166    HG   LEU  22           HG       LEU  22   5.880   6.520  -7.444
  167   1HD1  LEU  22          HD11      LEU  22   7.836   6.037  -6.012
  168   2HD1  LEU  22          HD12      LEU  22   8.553   7.558  -6.582
  169   3HD1  LEU  22          HD13      LEU  22   8.246   6.269  -7.717
  170   1HD2  LEU  22          HD21      LEU  22   5.894   7.132  -5.074
  171   2HD2  LEU  22          HD22      LEU  22   4.929   8.251  -6.039
  172   3HD2  LEU  22          HD23      LEU  22   6.541   8.716  -5.495
  173    H    ALA  23           HN       ALA  23   8.384  11.822  -8.613
  174    HA   ALA  23           HA       ALA  23   8.061  11.588 -11.414
  175   1HB   ALA  23          HB1       ALA  23   8.828  13.903 -11.501
  176   2HB   ALA  23          HB2       ALA  23   9.307  13.815  -9.805
  177   3HB   ALA  23          HB3       ALA  23   7.603  13.689 -10.247
  178    H    GLY  24           HN       GLY  24   9.458   9.887 -11.922
  179   1HA   GLY  24          HA2       GLY  24  11.650   9.959 -13.236
  180   2HA   GLY  24          HA1       GLY  24  12.266  10.574 -11.692
  181    H    ILE  25           HN       ILE  25  10.169   8.540 -10.597
  182    HA   ILE  25           HA       ILE  25  12.263   6.590 -10.139
  183    HB   ILE  25           HB       ILE  25   9.513   6.796  -8.874
  184   1HG1  ILE  25          HG12      ILE  25  10.915   8.748  -8.365
  185   2HG1  ILE  25          HG11      ILE  25  10.642   7.757  -6.941
  186   1HG2  ILE  25          HG21      ILE  25  10.404   4.523  -8.727
  187   2HG2  ILE  25          HG22      ILE  25  10.400   5.290  -7.141
  188   3HG2  ILE  25          HG23      ILE  25  11.908   5.145  -8.044
  189   1HD1  ILE  25          HD11      ILE  25  12.869   6.804  -7.179
  190   2HD1  ILE  25          HD12      ILE  25  12.924   8.560  -7.031
  191   3HD1  ILE  25          HD13      ILE  25  13.146   7.799  -8.610
  192    H    ASN  26           HN       ASN  26  12.067   4.449 -10.583
  193    HA   ASN  26           HA       ASN  26  10.439   3.842 -12.874
  194   1HB   ASN  26          HB2       ASN  26  12.452   2.145 -11.374
  195   2HB   ASN  26          HB1       ASN  26  11.667   1.690 -12.882
  196   1HD2  ASN  26          HD21      ASN  26  12.355   2.618 -14.785
  197   2HD2  ASN  26          HD22      ASN  26  13.755   3.635 -14.879
  198    H    LEU  27           HN       LEU  27   8.384   3.529 -12.385
  199    HA   LEU  27           HA       LEU  27   7.518   2.233  -9.958
  200   1HB   LEU  27          HB2       LEU  27   5.937   3.191 -12.347
  201   2HB   LEU  27          HB1       LEU  27   5.254   2.646 -10.825
  202    HG   LEU  27           HG       LEU  27   6.973   5.093 -11.220
  203   1HD1  LEU  27          HD11      LEU  27   4.707   5.375 -12.092
  204   2HD1  LEU  27          HD12      LEU  27   4.953   6.337 -10.634
  205   3HD1  LEU  27          HD13      LEU  27   4.037   4.849 -10.547
  206   1HD2  LEU  27          HD21      LEU  27   7.395   4.066  -9.064
  207   2HD2  LEU  27          HD22      LEU  27   5.660   4.006  -8.736
  208   3HD2  LEU  27          HD23      LEU  27   6.481   5.559  -8.871
  209    H    ASP  28           HN       ASP  28   8.634   1.161 -12.804
  210    HA   ASP  28           HA       ASP  28   6.992  -1.233 -12.970
  211   1HB   ASP  28          HB2       ASP  28   7.748  -0.076 -15.015
  212   2HB   ASP  28          HB1       ASP  28   9.418  -0.336 -14.546
  213    H    SER  29           HN       SER  29   9.330  -0.208 -10.993
  214    HA   SER  29           HA       SER  29  10.963  -2.608 -10.855
  215   1HB   SER  29          HB2       SER  29  10.917  -0.112  -9.157
  216   2HB   SER  29          HB1       SER  29  12.104  -1.386  -9.007
  217    HG   SER  29           HG       SER  29  11.774   0.576 -10.874
  218    H    SER  30           HN       SER  30  10.881  -4.057  -9.162
  219    HA   SER  30           HA       SER  30   8.413  -4.306  -7.744
  220   1HB   SER  30          HB2       SER  30  11.036  -5.772  -7.451
  221   2HB   SER  30          HB1       SER  30   9.458  -6.366  -6.948
  222    HG   SER  30           HG       SER  30  10.630  -6.201  -9.447
  223    H    LEU  31           HN       LEU  31   8.454  -4.453  -5.284
  224    HA   LEU  31           HA       LEU  31   9.706  -2.227  -4.089
  225   1HB   LEU  31          HB2       LEU  31   7.625  -3.541  -3.262
  226   2HB   LEU  31          HB1       LEU  31   8.782  -4.652  -2.557
  227    HG   LEU  31           HG       LEU  31   9.681  -2.791  -1.198
  228   1HD1  LEU  31          HD11      LEU  31   8.408  -0.705  -1.102
  229   2HD1  LEU  31          HD12      LEU  31   7.380  -1.306  -2.414
  230   3HD1  LEU  31          HD13      LEU  31   9.088  -0.980  -2.713
  231   1HD2  LEU  31          HD21      LEU  31   6.705  -3.191  -0.978
  232   2HD2  LEU  31          HD22      LEU  31   7.772  -2.603   0.299
  233   3HD2  LEU  31          HD23      LEU  31   7.941  -4.253  -0.303
  234    H    ALA  32           HN       ALA  32  10.655  -5.506  -4.564
  235    HA   ALA  32           HA       ALA  32  12.806  -5.482  -2.770
  236   1HB   ALA  32          HB1       ALA  32  12.197  -7.251  -5.128
  237   2HB   ALA  32          HB2       ALA  32  12.053  -7.612  -3.385
  238   3HB   ALA  32          HB3       ALA  32  13.627  -7.456  -4.127
  239    H    ASP  33           HN       ASP  33  12.351  -4.337  -6.030
  240    HA   ASP  33           HA       ASP  33  15.102  -4.212  -6.769
  241   1HB   ASP  33          HB2       ASP  33  12.623  -2.939  -7.884
  242   2HB   ASP  33          HB1       ASP  33  14.203  -2.420  -8.454
  243    H    LEU  34           HN       LEU  34  12.802  -2.173  -5.280
  244    HA   LEU  34           HA       LEU  34  14.380   0.182  -5.000
  245   1HB   LEU  34          HB2       LEU  34  11.975  -0.938  -3.584
  246   2HB   LEU  34          HB1       LEU  34  12.719   0.550  -3.068
  247    HG   LEU  34           HG       LEU  34  11.888   1.745  -4.945
  248   1HD1  LEU  34          HD11      LEU  34  10.939   0.736  -6.927
  249   2HD1  LEU  34          HD12      LEU  34  11.247  -0.879  -6.284
  250   3HD1  LEU  34          HD13      LEU  34  12.596   0.171  -6.715
  251   1HD2  LEU  34          HD21      LEU  34  10.178   1.155  -3.399
  252   2HD2  LEU  34          HD22      LEU  34  10.004  -0.407  -4.183
  253   3HD2  LEU  34          HD23      LEU  34   9.522   1.065  -5.052
  254    H    GLY  35           HN       GLY  35  13.597  -2.576  -2.981
  255   1HA   GLY  35          HA2       GLY  35  15.262  -3.715  -1.729
  256   2HA   GLY  35          HA1       GLY  35  16.125  -2.189  -1.563
  257    H    LEU  36           HN       LEU  36  13.250  -3.955  -0.563
  258    HA   LEU  36           HA       LEU  36  12.787  -2.034   1.513
  259   1HB   LEU  36          HB2       LEU  36  10.730  -3.182   1.931
  260   2HB   LEU  36          HB1       LEU  36  11.015  -3.480   0.263
  261    HG   LEU  36           HG       LEU  36  11.985  -5.767   1.007
  262   1HD1  LEU  36          HD11      LEU  36  10.328  -5.065   3.433
  263   2HD1  LEU  36          HD12      LEU  36  12.076  -5.308   3.416
  264   3HD1  LEU  36          HD13      LEU  36  10.994  -6.658   3.068
  265   1HD2  LEU  36          HD21      LEU  36   9.751  -6.730   0.962
  266   2HD2  LEU  36          HD22      LEU  36   9.924  -5.441  -0.239
  267   3HD2  LEU  36          HD23      LEU  36   9.065  -5.135   1.273
  268    H    ASP  37           HN       ASP  37  14.007  -1.967   3.221
  269    HA   ASP  37           HA       ASP  37  16.008  -3.914   3.720
  270   1HB   ASP  37          HB2       ASP  37  15.066  -1.704   5.545
  271   2HB   ASP  37          HB1       ASP  37  16.572  -2.597   5.690
  272    H    SER  38           HN       SER  38  13.552  -2.758   5.920
  273    HA   SER  38           HA       SER  38  12.644  -5.382   6.543
  274   1HB   SER  38          HB2       SER  38  14.827  -5.196   7.834
  275   2HB   SER  38          HB1       SER  38  14.100  -3.871   8.740
  276    HG   SER  38           HG       SER  38  13.028  -6.497   8.558
  277    H    LEU  39           HN       LEU  39  12.904  -1.965   7.563
  278    HA   LEU  39           HA       LEU  39  10.477  -1.815   8.919
  279   1HB   LEU  39          HB2       LEU  39  12.176  -0.028   8.922
  280   2HB   LEU  39          HB1       LEU  39  11.742   0.357   7.265
  281    HG   LEU  39           HG       LEU  39   9.401   0.758   8.106
  282   1HD1  LEU  39          HD11      LEU  39   9.142   1.329  10.462
  283   2HD1  LEU  39          HD12      LEU  39  10.782   0.757  10.771
  284   3HD1  LEU  39          HD13      LEU  39   9.542  -0.373  10.222
  285   1HD2  LEU  39          HD21      LEU  39   9.914   3.000   8.877
  286   2HD2  LEU  39          HD22      LEU  39  10.871   2.534   7.461
  287   3HD2  LEU  39          HD23      LEU  39  11.613   2.539   9.070
  288    H    MET  40           HN       MET  40  11.202  -1.294   5.498
  289    HA   MET  40           HA       MET  40   8.462  -0.856   4.780
  290   1HB   MET  40          HB2       MET  40  10.922  -1.389   3.123
  291   2HB   MET  40          HB1       MET  40   9.332  -1.189   2.401
  292   1HG   MET  40          HG2       MET  40   9.175   1.042   3.378
  293   2HG   MET  40          HG1       MET  40  10.769   0.840   4.097
  294   1HE   MET  40          HE1       MET  40  12.394  -0.638   1.839
  295   2HE   MET  40          HE2       MET  40  13.015   0.753   2.729
  296   3HE   MET  40          HE3       MET  40  13.089   0.729   0.969
  297    H    GLY  41           HN       GLY  41   9.109  -3.278   6.190
  298   1HA   GLY  41          HA2       GLY  41   7.525  -5.096   4.551
  299   2HA   GLY  41          HA1       GLY  41   8.982  -5.699   5.351
  300    H    VAL  42           HN       VAL  42   8.862  -4.235   7.722
  301    HA   VAL  42           HA       VAL  42   6.855  -5.720   9.167
  302    HB   VAL  42           HB       VAL  42   8.743  -3.596  10.235
  303   1HG1  VAL  42          HG11      VAL  42   6.899  -4.062  11.740
  304   2HG1  VAL  42          HG12      VAL  42   8.409  -4.688  12.405
  305   3HG1  VAL  42          HG13      VAL  42   7.248  -5.789  11.668
  306   1HG2  VAL  42          HG21      VAL  42  10.190  -5.444  10.939
  307   2HG2  VAL  42          HG22      VAL  42  10.021  -5.352   9.188
  308   3HG2  VAL  42          HG23      VAL  42   9.134  -6.582  10.097
  309    H    GLU  43           HN       GLU  43   7.516  -2.257   8.607
  310    HA   GLU  43           HA       GLU  43   5.308  -1.393  10.123
  311   1HB   GLU  43          HB2       GLU  43   7.247   0.059   9.583
  312   2HB   GLU  43          HB1       GLU  43   6.741   0.079   7.901
  313   1HG   GLU  43          HG2       GLU  43   4.719   1.232   8.468
  314   2HG   GLU  43          HG1       GLU  43   5.076   1.084  10.186
  315    H    VAL  44           HN       VAL  44   5.746  -2.282   6.815
  316    HA   VAL  44           HA       VAL  44   3.296  -1.421   5.732
  317    HB   VAL  44           HB       VAL  44   4.916  -3.887   4.987
  318   1HG1  VAL  44          HG11      VAL  44   2.831  -2.398   3.393
  319   2HG1  VAL  44          HG12      VAL  44   2.653  -4.004   4.100
  320   3HG1  VAL  44          HG13      VAL  44   3.821  -3.739   2.804
  321   1HG2  VAL  44          HG21      VAL  44   5.879  -2.479   3.235
  322   2HG2  VAL  44          HG22      VAL  44   6.233  -1.859   4.843
  323   3HG2  VAL  44          HG23      VAL  44   4.983  -1.092   3.860
  324    H    ARG  45           HN       ARG  45   4.245  -4.516   7.170
  325    HA   ARG  45           HA       ARG  45   1.744  -5.737   7.098
  326   1HB   ARG  45          HB2       ARG  45   4.178  -6.144   8.781
  327   2HB   ARG  45          HB1       ARG  45   2.730  -7.059   9.140
  328   1HG   ARG  45          HG2       ARG  45   2.759  -7.956   6.856
  329   2HG   ARG  45          HG1       ARG  45   4.216  -7.021   6.525
  330   1HD   ARG  45          HD2       ARG  45   4.006  -9.065   8.724
  331   2HD   ARG  45          HD1       ARG  45   4.590  -9.435   7.105
  332    HE   ARG  45           HE       ARG  45   6.157  -7.421   7.736
  333   1HH1  ARG  45          HH11      ARG  45   5.252 -10.221   9.729
  334   2HH1  ARG  45          HH12      ARG  45   6.748 -10.320  10.536
  335   1HH2  ARG  45          HH21      ARG  45   8.334  -7.688   8.777
  336   2HH2  ARG  45          HH22      ARG  45   8.526  -8.873   9.954
  337    H    GLN  46           HN       GLN  46   3.246  -3.795   9.622
  338    HA   GLN  46           HA       GLN  46   1.183  -4.033  11.487
  339   1HB   GLN  46          HB2       GLN  46   3.175  -1.805  11.114
  340   2HB   GLN  46          HB1       GLN  46   2.140  -1.986  12.529
  341   1HG   GLN  46          HG2       GLN  46   3.151  -4.139  13.013
  342   2HG   GLN  46          HG1       GLN  46   4.152  -4.004  11.573
  343   1HE2  GLN  46          HE21      GLN  46   4.899  -4.321  14.340
  344   2HE2  GLN  46          HE22      GLN  46   5.901  -2.969  14.742
  345    H    ILE  47           HN       ILE  47   1.342  -2.037   8.661
  346    HA   ILE  47           HA       ILE  47  -0.894  -0.405   9.466
  347    HB   ILE  47           HB       ILE  47   0.353  -0.777   6.716
  348   1HG1  ILE  47          HG12      ILE  47   0.669   1.472   8.711
  349   2HG1  ILE  47          HG11      ILE  47   1.860   0.209   8.396
  350   1HG2  ILE  47          HG21      ILE  47  -0.856   1.279   6.099
  351   2HG2  ILE  47          HG22      ILE  47  -1.626   1.283   7.689
  352   3HG2  ILE  47          HG23      ILE  47  -1.956  -0.024   6.557
  353   1HD1  ILE  47          HD11      ILE  47   2.449   2.293   7.283
  354   2HD1  ILE  47          HD12      ILE  47   0.913   2.277   6.420
  355   3HD1  ILE  47          HD13      ILE  47   2.110   1.022   6.108
  356    H    LEU  48           HN       LEU  48  -0.365  -2.867   6.998
  357    HA   LEU  48           HA       LEU  48  -3.082  -2.995   6.273
  358   1HB   LEU  48          HB2       LEU  48  -0.726  -4.692   5.599
  359   2HB   LEU  48          HB1       LEU  48  -2.311  -5.178   5.067
  360    HG   LEU  48           HG       LEU  48  -1.358  -4.098   3.245
  361   1HD1  LEU  48          HD11      LEU  48  -2.676  -2.090   2.881
  362   2HD1  LEU  48          HD12      LEU  48  -3.054  -2.037   4.603
  363   3HD1  LEU  48          HD13      LEU  48  -3.631  -3.384   3.616
  364   1HD2  LEU  48          HD21      LEU  48  -0.288  -1.893   3.317
  365   2HD2  LEU  48          HD22      LEU  48   0.543  -3.061   4.342
  366   3HD2  LEU  48          HD23      LEU  48  -0.516  -1.847   5.065
  367    H    GLU  49           HN       GLU  49  -1.182  -5.154   8.317
  368    HA   GLU  49           HA       GLU  49  -3.108  -7.175   8.707
  369   1HB   GLU  49          HB2       GLU  49  -0.736  -7.398   9.320
  370   2HB   GLU  49          HB1       GLU  49  -0.939  -6.176  10.558
  371   1HG   GLU  49          HG2       GLU  49  -2.748  -7.831  11.463
  372   2HG   GLU  49          HG1       GLU  49  -1.837  -9.008  10.516
  373    H    ARG  50           HN       ARG  50  -2.284  -4.311  10.548
  374    HA   ARG  50           HA       ARG  50  -4.180  -4.936  12.596
  375   1HB   ARG  50          HB2       ARG  50  -2.259  -2.664  12.259
  376   2HB   ARG  50          HB1       ARG  50  -3.332  -2.837  13.647
  377   1HG   ARG  50          HG2       ARG  50  -2.296  -4.907  14.268
  378   2HG   ARG  50          HG1       ARG  50  -1.340  -4.920  12.787
  379   1HD   ARG  50          HD2       ARG  50  -0.029  -4.230  14.730
  380   2HD   ARG  50          HD1       ARG  50  -0.133  -2.960  13.514
  381    HE   ARG  50           HE       ARG  50  -2.165  -2.414  15.230
  382   1HH1  ARG  50          HH11      ARG  50   1.271  -3.110  15.843
  383   2HH1  ARG  50          HH12      ARG  50   1.472  -1.847  16.965
  384   1HH2  ARG  50          HH21      ARG  50  -1.851  -0.644  16.807
  385   2HH2  ARG  50          HH22      ARG  50  -0.347  -0.449  17.547
  386    H    GLU  51           HN       GLU  51  -4.329  -3.022   9.742
  387    HA   GLU  51           HA       GLU  51  -6.652  -1.731  10.944
  388   1HB   GLU  51          HB2       GLU  51  -5.024  -0.787   8.610
  389   2HB   GLU  51          HB1       GLU  51  -6.481   0.012   9.207
  390   1HG   GLU  51          HG2       GLU  51  -5.406   0.274  11.402
  391   2HG   GLU  51          HG1       GLU  51  -3.940  -0.446  10.744
  392    H    HIS  52           HN       HIS  52  -5.806  -3.762   8.205
  393    HA   HIS  52           HA       HIS  52  -8.688  -4.013   7.849
  394   1HB   HIS  52          HB2       HIS  52  -6.801  -3.157   5.771
  395   2HB   HIS  52          HB1       HIS  52  -8.001  -4.325   5.251
  396    HD1  HIS  52           HD1      HIS  52  -7.574  -0.963   5.086
  397    HD2  HIS  52           HD2      HIS  52 -10.671  -3.257   6.581
  398    HE1  HIS  52           HE1      HIS  52  -9.579   0.562   5.144
  399    HE2  HIS  52           HE2      HIS  52 -11.477  -0.978   5.715
  400    H    ASP  53           HN       ASP  53  -6.238  -5.629   8.802
  401    HA   ASP  53           HA       ASP  53  -5.642  -7.750   8.953
  402   1HB   ASP  53          HB2       ASP  53  -7.875  -8.137   9.779
  403   2HB   ASP  53          HB1       ASP  53  -8.532  -8.193   8.153
  404    H    LEU  54           HN       LEU  54  -4.283  -7.071   7.186
  405    HA   LEU  54           HA       LEU  54  -4.383  -9.094   5.075
  406   1HB   LEU  54          HB2       LEU  54  -3.932  -6.182   4.840
  407   2HB   LEU  54          HB1       LEU  54  -2.901  -7.189   3.834
  408    HG   LEU  54           HG       LEU  54  -5.148  -8.063   2.917
  409   1HD1  LEU  54          HD11      LEU  54  -6.056  -5.496   4.208
  410   2HD1  LEU  54          HD12      LEU  54  -6.579  -7.120   4.653
  411   3HD1  LEU  54          HD13      LEU  54  -6.991  -6.462   3.069
  412   1HD2  LEU  54          HD21      LEU  54  -3.612  -6.684   1.661
  413   2HD2  LEU  54          HD22      LEU  54  -4.257  -5.232   2.421
  414   3HD2  LEU  54          HD23      LEU  54  -5.276  -6.193   1.347
  415    H    VAL  55           HN       VAL  55  -2.862 -10.450   5.873
  416    HA   VAL  55           HA       VAL  55  -0.405  -9.229   6.888
  417    HB   VAL  55           HB       VAL  55  -1.278 -12.126   7.104
  418   1HG1  VAL  55          HG11      VAL  55   0.515 -12.316   8.768
  419   2HG1  VAL  55          HG12      VAL  55   0.978 -10.644   8.457
  420   3HG1  VAL  55          HG13      VAL  55   1.144 -11.853   7.186
  421   1HG2  VAL  55          HG21      VAL  55  -1.743 -11.631   9.461
  422   2HG2  VAL  55          HG22      VAL  55  -2.764 -10.678   8.380
  423   3HG2  VAL  55          HG23      VAL  55  -1.374  -9.930   9.171
  424    H    LEU  56           HN       LEU  56   0.761  -8.772   5.108
  425    HA   LEU  56           HA       LEU  56   1.255 -10.993   3.265
  426   1HB   LEU  56          HB2       LEU  56   1.983  -8.080   2.860
  427   2HB   LEU  56          HB1       LEU  56   2.136  -9.351   1.679
  428    HG   LEU  56           HG       LEU  56   0.337  -8.122   0.945
  429   1HD1  LEU  56          HD11      LEU  56  -0.253 -10.411   0.817
  430   2HD1  LEU  56          HD12      LEU  56  -1.696  -9.471   1.228
  431   3HD1  LEU  56          HD13      LEU  56  -0.861 -10.391   2.472
  432   1HD2  LEU  56          HD21      LEU  56  -1.544  -7.342   2.325
  433   2HD2  LEU  56          HD22      LEU  56   0.001  -6.687   2.862
  434   3HD2  LEU  56          HD23      LEU  56  -0.753  -8.012   3.752
  435    HA   PRO  57           HA       PRO  57   4.921 -11.322   5.866
  436   1HB   PRO  57          HB2       PRO  57   5.349 -13.669   4.203
  437   2HB   PRO  57          HB1       PRO  57   5.182 -13.572   5.944
  438   1HG   PRO  57          HG2       PRO  57   3.209 -14.607   4.483
  439   2HG   PRO  57          HG1       PRO  57   2.799 -13.439   5.762
  440   1HD   PRO  57          HD2       PRO  57   3.134 -12.927   2.826
  441   2HD   PRO  57          HD1       PRO  57   1.763 -12.508   3.882
  442    H    ILE  58           HN       ILE  58   5.161  -9.890   3.236
  443    HA   ILE  58           HA       ILE  58   6.911  -8.800   2.249
  444    HB   ILE  58           HB       ILE  58   8.657 -10.656   3.877
  445   1HG1  ILE  58          HG12      ILE  58   9.578  -8.431   4.709
  446   2HG1  ILE  58          HG11      ILE  58   8.290  -7.690   3.764
  447   1HG2  ILE  58          HG21      ILE  58  10.691  -9.609   3.005
  448   2HG2  ILE  58          HG22      ILE  58   9.738  -8.784   1.767
  449   3HG2  ILE  58          HG23      ILE  58   9.817 -10.547   1.800
  450   1HD1  ILE  58          HD11      ILE  58   6.625  -8.790   5.117
  451   2HD1  ILE  58          HD12      ILE  58   7.727  -7.851   6.127
  452   3HD1  ILE  58          HD13      ILE  58   7.887  -9.606   6.040
  453    H    ARG  59           HN       ARG  59   7.131 -12.261   2.086
  454    HA   ARG  59           HA       ARG  59   8.214 -12.329  -0.494
  455   1HB   ARG  59          HB2       ARG  59   7.334 -14.661  -0.719
  456   2HB   ARG  59          HB1       ARG  59   8.223 -14.349   0.766
  457   1HG   ARG  59          HG2       ARG  59   5.283 -14.146   0.840
  458   2HG   ARG  59          HG1       ARG  59   5.988 -15.744   0.787
  459   1HD   ARG  59          HD2       ARG  59   6.389 -13.590   2.824
  460   2HD   ARG  59          HD1       ARG  59   5.696 -15.191   3.059
  461    HE   ARG  59           HE       ARG  59   8.431 -15.266   2.168
  462   1HH1  ARG  59          HH11      ARG  59   6.354 -15.445   4.997
  463   2HH1  ARG  59          HH12      ARG  59   7.637 -15.510   6.123
  464   1HH2  ARG  59          HH21      ARG  59  10.156 -15.504   3.630
  465   2HH2  ARG  59          HH22      ARG  59   9.892 -15.601   5.328
  466    H    GLU  60           HN       GLU  60   5.104 -11.480   0.507
  467    HA   GLU  60           HA       GLU  60   4.161 -11.431  -2.297
  468   1HB   GLU  60          HB2       GLU  60   2.617 -11.305   0.304
  469   2HB   GLU  60          HB1       GLU  60   1.914 -11.323  -1.310
  470   1HG   GLU  60          HG2       GLU  60   2.695 -13.551  -1.694
  471   2HG   GLU  60          HG1       GLU  60   3.619 -13.533  -0.199
  472    H    VAL  61           HN       VAL  61   5.861  -9.552  -0.510
  473    HA   VAL  61           HA       VAL  61   4.308  -7.086  -1.014
  474    HB   VAL  61           HB       VAL  61   6.492  -7.486   1.068
  475   1HG1  VAL  61          HG11      VAL  61   6.402  -5.200   0.257
  476   2HG1  VAL  61          HG12      VAL  61   5.817  -5.294   1.918
  477   3HG1  VAL  61          HG13      VAL  61   4.672  -5.136   0.583
  478   1HG2  VAL  61          HG21      VAL  61   4.725  -7.289   2.728
  479   2HG2  VAL  61          HG22      VAL  61   4.476  -8.681   1.668
  480   3HG2  VAL  61          HG23      VAL  61   3.525  -7.217   1.438
  481    H    ARG  62           HN       ARG  62   7.417  -8.696  -1.215
  482    HA   ARG  62           HA       ARG  62   8.999  -6.590  -2.100
  483   1HB   ARG  62          HB2       ARG  62   9.207  -9.521  -2.560
  484   2HB   ARG  62          HB1       ARG  62  10.419  -8.419  -3.158
  485   1HG   ARG  62          HG2       ARG  62  10.636  -7.643  -0.732
  486   2HG   ARG  62          HG1       ARG  62   9.678  -9.069  -0.320
  487   1HD   ARG  62          HD2       ARG  62  12.347  -9.013  -1.725
  488   2HD   ARG  62          HD1       ARG  62  12.008  -9.644  -0.115
  489    HE   ARG  62           HE       ARG  62  10.572 -11.315  -1.277
  490   1HH1  ARG  62          HH11      ARG  62  13.544 -10.013  -2.743
  491   2HH1  ARG  62          HH12      ARG  62  13.617 -11.202  -3.950
  492   1HH2  ARG  62          HH21      ARG  62  10.692 -12.944  -2.971
  493   2HH2  ARG  62          HH22      ARG  62  11.948 -12.910  -4.088
  494    H    GLN  63           HN       GLN  63   6.511  -8.100  -3.841
  495    HA   GLN  63           HA       GLN  63   7.768  -7.396  -6.371
  496   1HB   GLN  63          HB2       GLN  63   5.350  -9.115  -5.831
  497   2HB   GLN  63          HB1       GLN  63   5.980  -8.789  -7.426
  498   1HG   GLN  63          HG2       GLN  63   6.793 -10.911  -6.923
  499   2HG   GLN  63          HG1       GLN  63   8.147  -9.851  -6.567
  500   1HE2  GLN  63          HE21      GLN  63   5.380 -10.147  -4.438
  501   2HE2  GLN  63          HE22      GLN  63   6.204 -11.057  -3.219
  502    H    LEU  64           HN       LEU  64   5.875  -5.988  -4.137
  503    HA   LEU  64           HA       LEU  64   3.870  -4.851  -5.822
  504   1HB   LEU  64          HB2       LEU  64   4.895  -3.861  -3.154
  505   2HB   LEU  64          HB1       LEU  64   3.424  -3.334  -3.947
  506    HG   LEU  64           HG       LEU  64   3.961  -6.077  -2.837
  507   1HD1  LEU  64          HD11      LEU  64   2.120  -3.898  -1.881
  508   2HD1  LEU  64          HD12      LEU  64   3.614  -4.431  -1.107
  509   3HD1  LEU  64          HD13      LEU  64   2.232  -5.524  -1.205
  510   1HD2  LEU  64          HD21      LEU  64   2.520  -6.218  -4.795
  511   2HD2  LEU  64          HD22      LEU  64   1.465  -4.972  -4.129
  512   3HD2  LEU  64          HD23      LEU  64   1.592  -6.537  -3.330
  513    H    THR  65           HN       THR  65   4.245  -3.404  -7.353
  514    HA   THR  65           HA       THR  65   6.807  -2.272  -7.713
  515    HB   THR  65           HB       THR  65   5.575  -1.412  -9.799
  516    HG1  THR  65           HG1      THR  65   3.431  -1.703  -9.609
  517   1HG2  THR  65          HG21      THR  65   5.671  -3.650 -10.754
  518   2HG2  THR  65          HG22      THR  65   5.649  -4.304  -9.101
  519   3HG2  THR  65          HG23      THR  65   7.045  -3.366  -9.655
  520    H    LEU  66           HN       LEU  66   5.943  -1.118  -5.459
  521    HA   LEU  66           HA       LEU  66   5.752   0.845  -4.338
  522   1HB   LEU  66          HB2       LEU  66   7.603   1.404  -6.043
  523   2HB   LEU  66          HB1       LEU  66   6.375   2.258  -6.941
  524    HG   LEU  66           HG       LEU  66   7.803   3.767  -5.608
  525   1HD1  LEU  66          HD11      LEU  66   5.535   4.489  -6.080
  526   2HD1  LEU  66          HD12      LEU  66   6.055   5.054  -4.482
  527   3HD1  LEU  66          HD13      LEU  66   4.979   3.662  -4.625
  528   1HD2  LEU  66          HD21      LEU  66   7.651   3.774  -3.170
  529   2HD2  LEU  66          HD22      LEU  66   8.321   2.261  -3.778
  530   3HD2  LEU  66          HD23      LEU  66   6.646   2.325  -3.232
  531    H    ARG  67           HN       ARG  67   4.364   1.570  -7.497
  532    HA   ARG  67           HA       ARG  67   2.212   2.973  -6.220
  533   1HB   ARG  67          HB2       ARG  67   2.934   2.512  -9.081
  534   2HB   ARG  67          HB1       ARG  67   1.371   3.193  -8.633
  535   1HG   ARG  67          HG2       ARG  67   4.041   4.327  -7.838
  536   2HG   ARG  67          HG1       ARG  67   3.013   4.935  -9.143
  537   1HD   ARG  67          HD2       ARG  67   1.195   5.244  -7.465
  538   2HD   ARG  67          HD1       ARG  67   2.323   4.768  -6.224
  539    HE   ARG  67           HE       ARG  67   3.130   6.847  -6.177
  540   1HH1  ARG  67          HH11      ARG  67   1.668   6.443  -9.421
  541   2HH1  ARG  67          HH12      ARG  67   1.839   8.077  -9.831
  542   1HH2  ARG  67          HH21      ARG  67   3.230   9.183  -6.757
  543   2HH2  ARG  67          HH22      ARG  67   2.685   9.621  -8.303
  544    H    LYS  68           HN       LYS  68   2.784  -0.181  -7.040
  545    HA   LYS  68           HA       LYS  68   0.064  -0.990  -7.366
  546   1HB   LYS  68          HB2       LYS  68   2.095  -2.366  -7.993
  547   2HB   LYS  68          HB1       LYS  68   2.345  -2.641  -6.275
  548   1HG   LYS  68          HG2       LYS  68   0.205  -3.762  -6.122
  549   2HG   LYS  68          HG1       LYS  68  -0.081  -3.461  -7.839
  550   1HD   LYS  68          HD2       LYS  68   1.871  -4.789  -8.410
  551   2HD   LYS  68          HD1       LYS  68   2.201  -5.052  -6.696
  552   1HE   LYS  68          HE2       LYS  68   1.101  -6.991  -7.518
  553   2HE   LYS  68          HE1       LYS  68   0.007  -6.063  -6.481
  554   1HZ   LYS  68          HZ1       LYS  68  -0.043  -5.923  -9.452
  555   2HZ   LYS  68          HZ2       LYS  68  -1.206  -5.279  -8.395
  556   3HZ   LYS  68          HZ3       LYS  68  -1.016  -6.945  -8.554
  557    H    LEU  69           HN       LEU  69   2.050  -0.126  -4.833
  558    HA   LEU  69           HA       LEU  69   0.651  -1.107  -2.580
  559   1HB   LEU  69          HB2       LEU  69   2.336   1.350  -2.896
  560   2HB   LEU  69          HB1       LEU  69   1.422   1.132  -1.425
  561    HG   LEU  69           HG       LEU  69   3.697   0.467  -1.073
  562   1HD1  LEU  69          HD11      LEU  69   3.405  -1.818  -0.281
  563   2HD1  LEU  69          HD12      LEU  69   1.898  -1.927  -1.193
  564   3HD1  LEU  69          HD13      LEU  69   2.047  -0.773   0.133
  565   1HD2  LEU  69          HD21      LEU  69   4.347  -0.078  -3.363
  566   2HD2  LEU  69          HD22      LEU  69   3.334  -1.520  -3.314
  567   3HD2  LEU  69          HD23      LEU  69   4.745  -1.400  -2.265
  568    H    GLN  70           HN       GLN  70  -0.135   1.702  -4.612
  569    HA   GLN  70           HA       GLN  70  -2.386   2.247  -2.863
  570   1HB   GLN  70          HB2       GLN  70  -2.939   4.072  -4.618
  571   2HB   GLN  70          HB1       GLN  70  -1.564   4.301  -3.551
  572   1HG   GLN  70          HG2       GLN  70  -0.063   3.613  -5.321
  573   2HG   GLN  70          HG1       GLN  70  -1.435   3.341  -6.406
  574   1HE2  GLN  70          HE21      GLN  70  -2.346   5.135  -7.423
  575   2HE2  GLN  70          HE22      GLN  70  -1.627   6.705  -7.285
  576    H    GLU  71           HN       GLU  71  -1.875   0.008  -4.872
  577    HA   GLU  71           HA       GLU  71  -4.576  -0.138  -6.014
  578   1HB   GLU  71          HB2       GLU  71  -2.742  -0.589  -7.556
  579   2HB   GLU  71          HB1       GLU  71  -2.051  -1.749  -6.441
  580   1HG   GLU  71          HG2       GLU  71  -4.029  -3.184  -6.780
  581   2HG   GLU  71          HG1       GLU  71  -4.617  -2.027  -7.977
  582    H    MET  72           HN       MET  72  -2.310  -1.604  -3.841
  583    HA   MET  72           HA       MET  72  -4.325  -3.520  -2.893
  584   1HB   MET  72          HB2       MET  72  -1.323  -3.447  -2.527
  585   2HB   MET  72          HB1       MET  72  -2.386  -4.639  -1.790
  586   1HG   MET  72          HG2       MET  72  -1.922  -4.219  -4.732
  587   2HG   MET  72          HG1       MET  72  -1.323  -5.552  -3.745
  588   1HE   MET  72          HE1       MET  72  -3.825  -6.137  -1.866
  589   2HE   MET  72          HE2       MET  72  -2.888  -7.408  -2.651
  590   3HE   MET  72          HE3       MET  72  -4.647  -7.401  -2.781
  591    H    SER  73           HN       SER  73  -4.260  -0.673  -2.310
  592    HA   SER  73           HA       SER  73  -3.136  -0.205   0.217
  593   1HB   SER  73          HB2       SER  73  -4.508   1.919  -0.040
  594   2HB   SER  73          HB1       SER  73  -3.316   1.572  -1.281
  595    HG   SER  73           HG       SER  73  -5.339   2.124  -2.272
  596    H    SER  74           HN       SER  74  -6.173  -1.402  -0.882
  597    HA   SER  74           HA       SER  74  -8.031  -2.165   0.112
  598   1HB   SER  74          HB2       SER  74  -6.422  -3.570   1.426
  599   2HB   SER  74          HB1       SER  74  -6.346  -2.307   2.647
  600    HG   SER  74           HG       SER  74  -8.322  -4.213   2.173
  601    H    LYS  75           HN       LYS  75  -8.812  -0.021  -0.352
  602    HA   LYS  75           HA       LYS  75  -9.526   1.477   2.085
  603   1HB   LYS  75          HB2       LYS  75  -9.420   2.458  -0.782
  604   2HB   LYS  75          HB1       LYS  75  -9.868   3.416   0.618
  605   1HG   LYS  75          HG2       LYS  75  -7.615   3.293   1.478
  606   2HG   LYS  75          HG1       LYS  75  -7.150   2.182   0.183
  607   1HD   LYS  75          HD2       LYS  75  -7.734   3.942  -1.464
  608   2HD   LYS  75          HD1       LYS  75  -8.037   5.045  -0.123
  609   1HE   LYS  75          HE2       LYS  75  -5.744   4.978   0.541
  610   2HE   LYS  75          HE1       LYS  75  -5.401   3.659  -0.583
  611   1HZ   LYS  75          HZ1       LYS  75  -6.011   5.199  -2.402
  612   2HZ   LYS  75          HZ2       LYS  75  -4.628   5.679  -1.605
  613   3HZ   LYS  75          HZ3       LYS  75  -6.081   6.479  -1.308
  614    H    ALA  76           HN       ALA  76 -11.735   2.325   2.078
  615    HA   ALA  76           HA       ALA  76 -13.535   0.468   0.694
  616   1HB   ALA  76          HB1       ALA  76 -13.725   0.523   3.139
  617   2HB   ALA  76          HB2       ALA  76 -15.201   1.095   2.361
  618   3HB   ALA  76          HB3       ALA  76 -14.069   2.251   3.066
  619    H    GLY  77           HN       GLY  77 -14.721   1.172  -0.909
  620   1HA   GLY  77          HA2       GLY  77 -15.234   4.077  -1.095
  621   2HA   GLY  77          HA1       GLY  77 -14.967   3.052  -2.503
  622    H    SER  78           HN       SER  78 -16.770   1.837   0.168
  623    HA   SER  78           HA       SER  78 -19.231   2.272  -1.303
  624   1HB   SER  78          HB2       SER  78 -19.806  -0.118  -0.476
  625   2HB   SER  78          HB1       SER  78 -18.749   0.069  -1.876
  626    HG   SER  78           HG       SER  78 -18.239  -1.146   0.452
  627    H    ASP  79           HN       ASP  79 -20.260   3.641  -0.070
  628    HA   ASP  79           HA       ASP  79 -20.260   3.577   2.828
  629   1HB   ASP  79          HB2       ASP  79 -20.477   5.738   1.772
  630   2HB   ASP  79          HB1       ASP  79 -21.814   5.178   0.778
  631    H    THR  80           HN       THR  80 -22.445   2.949   0.183
  632    HA   THR  80           HA       THR  80 -24.195   1.473   1.988
  633    HB   THR  80           HB       THR  80 -24.778   2.555  -0.790
  634    HG1  THR  80           HG1      THR  80 -24.449   3.917   1.417
  635   1HG2  THR  80          HG21      THR  80 -26.215   0.679  -0.077
  636   2HG2  THR  80          HG22      THR  80 -27.129   2.186  -0.147
  637   3HG2  THR  80          HG23      THR  80 -26.603   1.545   1.410
  638    H    GLU  81           HN       GLU  81 -23.689  -0.590   1.912
  639    HA   GLU  81           HA       GLU  81 -22.068  -1.732  -0.126
  640   1HB   GLU  81          HB2       GLU  81 -22.286  -3.831   1.114
  641   2HB   GLU  81          HB1       GLU  81 -21.929  -2.499   2.202
  642   1HG   GLU  81          HG2       GLU  81 -24.355  -2.395   2.747
  643   2HG   GLU  81          HG1       GLU  81 -24.580  -3.851   1.782
  644    H    LEU  82           HN       LEU  82 -22.762  -3.890  -1.144
  645    HA   LEU  82           HA       LEU  82 -25.069  -3.165  -2.705
  646   1HB   LEU  82          HB2       LEU  82 -22.976  -5.306  -3.093
  647   2HB   LEU  82          HB1       LEU  82 -24.349  -5.087  -4.152
  648    HG   LEU  82           HG       LEU  82 -22.487  -4.162  -5.241
  649   1HD1  LEU  82          HD11      LEU  82 -23.044  -1.805  -5.519
  650   2HD1  LEU  82          HD12      LEU  82 -24.081  -1.899  -4.096
  651   3HD1  LEU  82          HD13      LEU  82 -24.459  -2.860  -5.525
  652   1HD2  LEU  82          HD21      LEU  82 -20.945  -3.913  -3.370
  653   2HD2  LEU  82          HD22      LEU  82 -21.882  -2.551  -2.756
  654   3HD2  LEU  82          HD23      LEU  82 -21.028  -2.412  -4.294
  655    H    ALA  83           HN       ALA  83 -26.940  -4.038  -2.512
  656    HA   ALA  83           HA       ALA  83 -27.363  -6.262  -0.700
  657   1HB   ALA  83          HB1       ALA  83 -29.753  -5.808  -1.093
  658   2HB   ALA  83          HB2       ALA  83 -29.321  -4.594  -2.296
  659   3HB   ALA  83          HB3       ALA  83 -28.899  -4.348  -0.601
  660    H    ALA  84           HN       ALA  84 -26.864  -5.565  -3.918
  661    HA   ALA  84           HA       ALA  84 -27.875  -8.031  -5.016
  662   1HB   ALA  84          HB1       ALA  84 -25.927  -5.968  -6.096
  663   2HB   ALA  84          HB2       ALA  84 -27.658  -6.039  -6.444
  664   3HB   ALA  84          HB3       ALA  84 -26.590  -7.318  -7.020
  665    HA   PRO  85           HA       PRO  85 -24.776 -10.701  -3.288
  666   1HB   PRO  85          HB2       PRO  85 -24.664 -11.749  -6.091
  667   2HB   PRO  85          HB1       PRO  85 -24.758 -12.636  -4.563
  668   1HG   PRO  85          HG2       PRO  85 -26.928 -12.321  -6.036
  669   2HG   PRO  85          HG1       PRO  85 -27.009 -12.159  -4.270
  670   1HD   PRO  85          HD2       PRO  85 -27.108 -10.052  -6.370
  671   2HD   PRO  85          HD1       PRO  85 -27.893 -10.102  -4.781
  672    H    LYS  86           HN       LYS  86 -22.933  -9.682  -2.837
  673    HA   LYS  86           HA       LYS  86 -21.172  -8.842  -5.014
  674   1HB   LYS  86          HB2       LYS  86 -21.574  -7.223  -3.202
  675   2HB   LYS  86          HB1       LYS  86 -20.970  -8.372  -2.023
  676   1HG   LYS  86          HG2       LYS  86 -19.348  -6.601  -2.545
  677   2HG   LYS  86          HG1       LYS  86 -18.740  -8.206  -2.944
  678   1HD   LYS  86          HD2       LYS  86 -19.281  -7.834  -5.301
  679   2HD   LYS  86          HD1       LYS  86 -19.928  -6.240  -4.907
  680   1HE   LYS  86          HE2       LYS  86 -17.757  -5.469  -4.212
  681   2HE   LYS  86          HE1       LYS  86 -17.085  -7.090  -4.368
  682   1HZ   LYS  86          HZ1       LYS  86 -16.538  -5.637  -6.291
  683   2HZ   LYS  86          HZ2       LYS  86 -18.189  -5.552  -6.677
  684   3HZ   LYS  86          HZ3       LYS  86 -17.395  -7.013  -6.703
  685    H    SER  87           HN       SER  87 -21.372 -11.050  -2.362
  686    HA   SER  87           HA       SER  87 -19.460 -12.766  -3.683
  687   1HB   SER  87          HB2       SER  87 -18.416 -13.236  -1.361
  688   2HB   SER  87          HB1       SER  87 -17.958 -11.722  -2.142
  689    HG   SER  87           HG       SER  87 -18.841 -10.664  -0.607
  690    H    LYS  88           HN       LYS  88 -21.785 -13.373  -4.115
  691    HA   LYS  88           HA       LYS  88 -23.512 -14.733  -3.954
  692   1HB   LYS  88          HB2       LYS  88 -22.166 -16.569  -3.087
  693   2HB   LYS  88          HB1       LYS  88 -22.142 -15.857  -1.482
  694   1HG   LYS  88          HG2       LYS  88 -24.476 -16.342  -1.170
  695   2HG   LYS  88          HG1       LYS  88 -24.634 -16.866  -2.844
  696   1HD   LYS  88          HD2       LYS  88 -22.850 -18.195  -0.806
  697   2HD   LYS  88          HD1       LYS  88 -24.483 -18.731  -1.198
  698   1HE   LYS  88          HE2       LYS  88 -22.184 -18.540  -3.148
  699   2HE   LYS  88          HE1       LYS  88 -22.771 -20.026  -2.405
  700   1HZ   LYS  88          HZ1       LYS  88 -23.691 -19.768  -4.618
  701   2HZ   LYS  88          HZ2       LYS  88 -24.324 -18.261  -4.242
  702   3HZ   LYS  88          HZ3       LYS  88 -24.926 -19.631  -3.473
  703    H    ASN  89           HN       ASN  89 -22.623 -13.273  -0.923
  704    HA   ASN  89           HA       ASN  89 -25.272 -12.049  -0.824
  705   1HB   ASN  89          HB2       ASN  89 -23.686 -12.936   1.626
  706   2HB   ASN  89          HB1       ASN  89 -25.275 -12.188   1.621
  707   1HD2  ASN  89          HD21      ASN  89 -23.470 -15.066   1.215
  708   2HD2  ASN  89          HD22      ASN  89 -24.775 -16.179   1.179
  Start of MODEL   21
    1   1H    GLY   1          HT1       GLY   1 -14.568   8.542  11.697
    2   2H    GLY   1          HT2       GLY   1 -13.124   8.728  12.596
    3   3H    GLY   1          HT3       GLY   1 -13.675   7.202  12.133
    4   1HA   GLY   1          HA1       GLY   1 -12.881   9.270  10.204
    5   2HA   GLY   1          HA2       GLY   1 -11.851   7.946  10.740
    6    H    ASP   2           HN       ASP   2 -13.970   8.920   8.425
    7    HA   ASP   2           HA       ASP   2 -14.703   6.133   7.833
    8   1HB   ASP   2          HB2       ASP   2 -16.187   8.650   7.099
    9   2HB   ASP   2          HB1       ASP   2 -16.526   7.093   6.349
   10    H    GLY   3           HN       GLY   3 -14.277   9.090   5.901
   11   1HA   GLY   3          HA2       GLY   3 -13.069   7.419   3.856
   12   2HA   GLY   3          HA1       GLY   3 -13.478   9.131   3.711
   13    H    GLU   4           HN       GLU   4 -12.291  10.489   5.349
   14    HA   GLU   4           HA       GLU   4  -9.476  10.053   4.858
   15   1HB   GLU   4          HB2       GLU   4 -10.951  12.415   6.058
   16   2HB   GLU   4          HB1       GLU   4  -9.213  12.351   5.870
   17   1HG   GLU   4          HG2       GLU   4 -10.165  13.679   4.111
   18   2HG   GLU   4          HG1       GLU   4  -9.499  12.206   3.424
   19    H    ALA   5           HN       ALA   5  -8.718   8.603   6.177
   20    HA   ALA   5           HA       ALA   5  -8.193   9.173   8.908
   21   1HB   ALA   5          HB1       ALA   5  -9.361   7.226   9.891
   22   2HB   ALA   5          HB2       ALA   5 -10.132   6.907   8.339
   23   3HB   ALA   5          HB3       ALA   5 -10.511   8.385   9.223
   24    H    GLN   6           HN       GLN   6  -8.649   6.744   6.455
   25    HA   GLN   6           HA       GLN   6  -6.092   5.522   7.138
   26   1HB   GLN   6          HB2       GLN   6  -8.373   4.275   6.734
   27   2HB   GLN   6          HB1       GLN   6  -7.985   4.547   5.039
   28   1HG   GLN   6          HG2       GLN   6  -5.840   3.421   5.379
   29   2HG   GLN   6          HG1       GLN   6  -6.314   3.078   7.043
   30   1HE2  GLN   6          HE21      GLN   6  -5.632   1.159   5.150
   31   2HE2  GLN   6          HE22      GLN   6  -7.047   0.195   4.860
   32    H    ARG   7           HN       ARG   7  -4.576   5.255   5.317
   33    HA   ARG   7           HA       ARG   7  -5.110   7.229   3.225
   34   1HB   ARG   7          HB2       ARG   7  -2.701   7.751   3.224
   35   2HB   ARG   7          HB1       ARG   7  -3.493   8.175   4.734
   36   1HG   ARG   7          HG2       ARG   7  -2.594   6.133   5.760
   37   2HG   ARG   7          HG1       ARG   7  -1.774   5.755   4.242
   38   1HD   ARG   7          HD2       ARG   7  -0.296   6.854   5.903
   39   2HD   ARG   7          HD1       ARG   7  -0.450   7.764   4.401
   40    HE   ARG   7           HE       ARG   7  -2.349   8.541   6.366
   41   1HH1  ARG   7          HH11      ARG   7   1.055   8.963   5.508
   42   2HH1  ARG   7          HH12      ARG   7   1.161  10.559   6.101
   43   1HH2  ARG   7          HH21      ARG   7  -2.232  10.728   7.148
   44   2HH2  ARG   7          HH22      ARG   7  -0.796  11.633   6.981
   45    H    ASP   8           HN       ASP   8  -3.688   6.848   1.326
   46    HA   ASP   8           HA       ASP   8  -3.707   4.011   0.839
   47   1HB   ASP   8          HB2       ASP   8  -3.232   6.318  -1.047
   48   2HB   ASP   8          HB1       ASP   8  -3.189   4.619  -1.543
   49    H    LEU   9           HN       LEU   9  -1.867   2.938  -0.072
   50    HA   LEU   9           HA       LEU   9   0.079   3.213   1.885
   51   1HB   LEU   9          HB2       LEU   9   0.171   1.505  -0.565
   52   2HB   LEU   9          HB1       LEU   9   1.187   1.333   0.849
   53    HG   LEU   9           HG       LEU   9  -1.791   0.941   0.739
   54   1HD1  LEU   9          HD11      LEU   9   0.459  -0.997   1.178
   55   2HD1  LEU   9          HD12      LEU   9  -0.567  -0.873  -0.256
   56   3HD1  LEU   9          HD13      LEU   9  -1.264  -1.357   1.293
   57   1HD2  LEU   9          HD21      LEU   9  -1.151   1.938   2.846
   58   2HD2  LEU   9          HD22      LEU   9   0.100   0.710   3.070
   59   3HD2  LEU   9          HD23      LEU   9  -1.606   0.250   3.070
   60    H    VAL  10           HN       VAL  10   0.092   4.601  -1.268
   61    HA   VAL  10           HA       VAL  10   2.933   4.979  -1.359
   62    HB   VAL  10           HB       VAL  10   0.726   6.464  -2.844
   63   1HG1  VAL  10          HG11      VAL  10   2.809   7.776  -2.829
   64   2HG1  VAL  10          HG12      VAL  10   2.469   7.136  -4.437
   65   3HG1  VAL  10          HG13      VAL  10   3.694   6.373  -3.424
   66   1HG2  VAL  10          HG21      VAL  10   0.737   4.118  -3.310
   67   2HG2  VAL  10          HG22      VAL  10   2.476   4.156  -3.608
   68   3HG2  VAL  10          HG23      VAL  10   1.380   5.011  -4.701
   69    H    LYS  11           HN       LYS  11   0.428   6.420   0.367
   70    HA   LYS  11           HA       LYS  11   1.865   8.890   0.844
   71   1HB   LYS  11          HB2       LYS  11  -0.847   7.877   1.617
   72   2HB   LYS  11          HB1       LYS  11  -0.213   9.380   2.290
   73   1HG   LYS  11          HG2       LYS  11  -1.666   9.981   0.514
   74   2HG   LYS  11          HG1       LYS  11  -0.036  10.190  -0.113
   75   1HD   LYS  11          HD2       LYS  11  -0.230   7.988  -1.224
   76   2HD   LYS  11          HD1       LYS  11  -1.890   7.867  -0.633
   77   1HE   LYS  11          HE2       LYS  11  -0.818  10.018  -2.456
   78   2HE   LYS  11          HE1       LYS  11  -1.792   8.641  -2.960
   79   1HZ   LYS  11          HZ1       LYS  11  -3.595   9.493  -1.534
   80   2HZ   LYS  11          HZ2       LYS  11  -3.156  10.561  -2.762
   81   3HZ   LYS  11          HZ3       LYS  11  -2.678  10.863  -1.169
   82    H    ALA  12           HN       ALA  12   2.279   5.928   1.841
   83    HA   ALA  12           HA       ALA  12   3.069   6.701   4.558
   84   1HB   ALA  12          HB1       ALA  12   1.667   4.124   3.832
   85   2HB   ALA  12          HB2       ALA  12   0.954   5.467   4.728
   86   3HB   ALA  12          HB3       ALA  12   2.289   4.553   5.426
   87    H    VAL  13           HN       VAL  13   3.154   3.817   2.495
   88    HA   VAL  13           HA       VAL  13   5.594   2.763   3.342
   89    HB   VAL  13           HB       VAL  13   4.147   2.415   0.706
   90   1HG1  VAL  13          HG11      VAL  13   6.334   0.712   1.907
   91   2HG1  VAL  13          HG12      VAL  13   6.454   1.738   0.476
   92   3HG1  VAL  13          HG13      VAL  13   5.400   0.326   0.454
   93   1HG2  VAL  13          HG21      VAL  13   3.283   0.360   1.715
   94   2HG2  VAL  13          HG22      VAL  13   2.804   1.795   2.628
   95   3HG2  VAL  13          HG23      VAL  13   4.109   0.761   3.221
   96    H    ALA  14           HN       ALA  14   4.818   4.836   0.619
   97    HA   ALA  14           HA       ALA  14   7.378   4.772  -0.522
   98   1HB   ALA  14          HB1       ALA  14   6.627   6.663  -1.915
   99   2HB   ALA  14          HB2       ALA  14   5.227   6.864  -0.837
  100   3HB   ALA  14          HB3       ALA  14   5.395   5.402  -1.786
  101    H    HIS  15           HN       HIS  15   6.156   6.532   2.189
  102    HA   HIS  15           HA       HIS  15   8.082   8.634   2.150
  103   1HB   HIS  15          HB2       HIS  15   6.342   7.550   4.346
  104   2HB   HIS  15          HB1       HIS  15   7.593   8.734   4.691
  105    HD1  HIS  15           HD1      HIS  15   6.922  11.078   4.489
  106    HD2  HIS  15           HD2      HIS  15   4.387   8.566   2.385
  107    HE1  HIS  15           HE1      HIS  15   5.051  12.541   3.692
  108    HE2  HIS  15           HE2      HIS  15   3.389  10.926   2.735
  109    H    ILE  16           HN       ILE  16   8.232   5.329   3.085
  110    HA   ILE  16           HA       ILE  16  10.499   5.541   4.783
  111    HB   ILE  16           HB       ILE  16   9.541   3.162   3.140
  112   1HG1  ILE  16          HG12      ILE  16   7.818   3.919   4.687
  113   2HG1  ILE  16          HG11      ILE  16   8.488   2.389   5.232
  114   1HG2  ILE  16          HG21      ILE  16  11.431   3.214   5.497
  115   2HG2  ILE  16          HG22      ILE  16  11.858   2.862   3.822
  116   3HG2  ILE  16          HG23      ILE  16  10.805   1.761   4.712
  117   1HD1  ILE  16          HD11      ILE  16   9.842   3.576   6.894
  118   2HD1  ILE  16          HD12      ILE  16   8.121   3.904   7.098
  119   3HD1  ILE  16          HD13      ILE  16   9.166   5.110   6.345
  120    H    LEU  17           HN       LEU  17  10.014   5.442   1.370
  121    HA   LEU  17           HA       LEU  17  12.884   5.185   0.877
  122   1HB   LEU  17          HB2       LEU  17  10.568   5.257  -1.044
  123   2HB   LEU  17          HB1       LEU  17  12.245   5.087  -1.511
  124    HG   LEU  17           HG       LEU  17  10.659   3.105   0.124
  125   1HD1  LEU  17          HD11      LEU  17  11.669   2.991  -2.712
  126   2HD1  LEU  17          HD12      LEU  17   9.988   3.181  -2.213
  127   3HD1  LEU  17          HD13      LEU  17  10.852   1.690  -1.845
  128   1HD2  LEU  17          HD21      LEU  17  13.019   3.151   0.760
  129   2HD2  LEU  17          HD22      LEU  17  13.485   2.974  -0.932
  130   3HD2  LEU  17          HD23      LEU  17  12.626   1.669  -0.112
  131    H    GLY  18           HN       GLY  18  10.659   7.580   1.420
  132   1HA   GLY  18          HA2       GLY  18  11.021   9.890   1.407
  133   2HA   GLY  18          HA1       GLY  18  12.475   9.629   0.450
  134    H    ILE  19           HN       ILE  19   9.365   8.295  -0.412
  135    HA   ILE  19           HA       ILE  19   9.145  10.255  -2.534
  136    HB   ILE  19           HB       ILE  19   8.189   8.311  -3.866
  137   1HG1  ILE  19          HG12      ILE  19  10.034   6.764  -2.047
  138   2HG1  ILE  19          HG11      ILE  19   8.293   6.588  -2.179
  139   1HG2  ILE  19          HG21      ILE  19  10.454   7.860  -4.867
  140   2HG2  ILE  19          HG22      ILE  19  11.174   8.658  -3.469
  141   3HG2  ILE  19          HG23      ILE  19  10.148   9.572  -4.577
  142   1HD1  ILE  19          HD11      ILE  19   8.552   5.780  -4.471
  143   2HD1  ILE  19          HD12      ILE  19   9.457   4.794  -3.324
  144   3HD1  ILE  19          HD13      ILE  19  10.301   5.969  -4.335
  145    H    ARG  20           HN       ARG  20   7.080   9.825  -3.710
  146    HA   ARG  20           HA       ARG  20   4.777   8.680  -2.850
  147   1HB   ARG  20          HB2       ARG  20   4.897  10.177  -0.829
  148   2HB   ARG  20          HB1       ARG  20   4.929  11.564  -1.907
  149   1HG   ARG  20          HG2       ARG  20   2.702  10.910  -2.766
  150   2HG   ARG  20          HG1       ARG  20   2.680   9.593  -1.602
  151   1HD   ARG  20          HD2       ARG  20   1.446  11.581  -0.798
  152   2HD   ARG  20          HD1       ARG  20   2.784  11.111   0.253
  153    HE   ARG  20           HE       ARG  20   3.385  13.100  -1.745
  154   1HH1  ARG  20          HH11      ARG  20   2.202  12.635   1.552
  155   2HH1  ARG  20          HH12      ARG  20   2.845  14.071   2.164
  156   1HH2  ARG  20          HH21      ARG  20   4.376  15.030  -0.913
  157   2HH2  ARG  20          HH22      ARG  20   4.203  15.446   0.737
  158    H    ASP  21           HN       ASP  21   6.381  11.491  -4.039
  159    HA   ASP  21           HA       ASP  21   4.530  12.243  -6.018
  160   1HB   ASP  21          HB2       ASP  21   6.383  13.590  -6.937
  161   2HB   ASP  21          HB1       ASP  21   6.295  13.767  -5.189
  162    H    LEU  22           HN       LEU  22   7.520  10.312  -6.252
  163    HA   LEU  22           HA       LEU  22   8.130   8.614  -7.639
  164   1HB   LEU  22          HB2       LEU  22   5.177   8.617  -8.175
  165   2HB   LEU  22          HB1       LEU  22   6.232   7.650  -9.176
  166    HG   LEU  22           HG       LEU  22   5.132   6.380  -7.428
  167   1HD1  LEU  22          HD11      LEU  22   8.115   6.621  -7.106
  168   2HD1  LEU  22          HD12      LEU  22   7.264   5.639  -8.295
  169   3HD1  LEU  22          HD13      LEU  22   7.146   5.247  -6.576
  170   1HD2  LEU  22          HD21      LEU  22   4.987   8.047  -5.670
  171   2HD2  LEU  22          HD22      LEU  22   6.742   8.049  -5.505
  172   3HD2  LEU  22          HD23      LEU  22   5.817   6.605  -5.082
  173    H    ALA  23           HN       ALA  23   8.181  11.455  -8.421
  174    HA   ALA  23           HA       ALA  23   7.522  11.560 -11.178
  175   1HB   ALA  23          HB1       ALA  23   7.405  13.523  -9.729
  176   2HB   ALA  23          HB2       ALA  23   8.451  13.794 -11.123
  177   3HB   ALA  23          HB3       ALA  23   9.159  13.475  -9.539
  178    H    GLY  24           HN       GLY  24  10.033  10.195  -9.635
  179   1HA   GLY  24          HA2       GLY  24  11.438   9.838 -12.132
  180   2HA   GLY  24          HA1       GLY  24  12.376  10.665 -10.886
  181    H    ILE  25           HN       ILE  25  10.030   8.075 -10.550
  182    HA   ILE  25           HA       ILE  25  12.190   6.303  -9.637
  183    HB   ILE  25           HB       ILE  25   9.410   6.539  -8.402
  184   1HG1  ILE  25          HG12      ILE  25  10.875   8.444  -7.804
  185   2HG1  ILE  25          HG11      ILE  25  10.454   7.448  -6.418
  186   1HG2  ILE  25          HG21      ILE  25  11.741   4.814  -7.550
  187   2HG2  ILE  25          HG22      ILE  25  10.237   4.249  -8.278
  188   3HG2  ILE  25          HG23      ILE  25  10.219   4.983  -6.674
  189   1HD1  ILE  25          HD11      ILE  25  12.652   6.395  -6.517
  190   2HD1  ILE  25          HD12      ILE  25  12.769   8.146  -6.330
  191   3HD1  ILE  25          HD13      ILE  25  13.073   7.401  -7.906
  192    H    ASN  26           HN       ASN  26  11.715   4.069 -10.033
  193    HA   ASN  26           HA       ASN  26  10.150   3.657 -12.426
  194   1HB   ASN  26          HB2       ASN  26  11.887   1.813 -10.790
  195   2HB   ASN  26          HB1       ASN  26  10.908   1.239 -12.129
  196   1HD2  ASN  26          HD21      ASN  26  13.803   1.279 -11.709
  197   2HD2  ASN  26          HD22      ASN  26  14.472   2.053 -13.081
  198    H    LEU  27           HN       LEU  27   8.300   2.589 -12.593
  199    HA   LEU  27           HA       LEU  27   6.938   1.859 -10.105
  200   1HB   LEU  27          HB2       LEU  27   5.852   2.482 -12.854
  201   2HB   LEU  27          HB1       LEU  27   4.882   2.040 -11.463
  202    HG   LEU  27           HG       LEU  27   6.575   4.535 -11.662
  203   1HD1  LEU  27          HD11      LEU  27   4.446   5.709 -11.856
  204   2HD1  LEU  27          HD12      LEU  27   3.588   4.170 -11.882
  205   3HD1  LEU  27          HD13      LEU  27   4.683   4.593 -13.199
  206   1HD2  LEU  27          HD21      LEU  27   5.431   5.200  -9.635
  207   2HD2  LEU  27          HD22      LEU  27   6.259   3.663  -9.360
  208   3HD2  LEU  27          HD23      LEU  27   4.511   3.708  -9.627
  209    H    ASP  28           HN       ASP  28   8.589   0.563 -12.649
  210    HA   ASP  28           HA       ASP  28   6.940  -1.852 -12.843
  211   1HB   ASP  28          HB2       ASP  28   7.777  -0.825 -14.937
  212   2HB   ASP  28          HB1       ASP  28   9.427  -1.110 -14.401
  213    H    SER  29           HN       SER  29   9.745  -0.736 -11.277
  214    HA   SER  29           HA       SER  29  11.081  -3.235 -10.994
  215   1HB   SER  29          HB2       SER  29  11.388  -0.683  -9.430
  216   2HB   SER  29          HB1       SER  29  12.562  -1.994  -9.572
  217    HG   SER  29           HG       SER  29  13.234  -0.664 -11.048
  218    H    SER  30           HN       SER  30  11.123  -4.565  -9.205
  219    HA   SER  30           HA       SER  30   8.879  -4.728  -7.526
  220   1HB   SER  30          HB2       SER  30  11.627  -5.939  -7.308
  221   2HB   SER  30          HB1       SER  30  10.239  -6.492  -6.390
  222    HG   SER  30           HG       SER  30  10.974  -6.871  -9.005
  223    H    LEU  31           HN       LEU  31   8.712  -4.283  -5.316
  224    HA   LEU  31           HA       LEU  31   9.800  -1.961  -4.291
  225   1HB   LEU  31          HB2       LEU  31   7.686  -3.180  -3.611
  226   2HB   LEU  31          HB1       LEU  31   8.689  -4.281  -2.696
  227    HG   LEU  31           HG       LEU  31   9.389  -2.404  -1.238
  228   1HD1  LEU  31          HD11      LEU  31   8.211  -0.298  -1.414
  229   2HD1  LEU  31          HD12      LEU  31   7.362  -0.914  -2.841
  230   3HD1  LEU  31          HD13      LEU  31   9.113  -0.642  -2.904
  231   1HD2  LEU  31          HD21      LEU  31   7.250  -2.098  -0.123
  232   2HD2  LEU  31          HD22      LEU  31   7.470  -3.774  -0.625
  233   3HD2  LEU  31          HD23      LEU  31   6.410  -2.708  -1.546
  234    H    ALA  32           HN       ALA  32  10.931  -5.183  -4.202
  235    HA   ALA  32           HA       ALA  32  12.783  -4.905  -2.108
  236   1HB   ALA  32          HB1       ALA  32  13.810  -6.969  -2.944
  237   2HB   ALA  32          HB2       ALA  32  12.864  -6.830  -4.425
  238   3HB   ALA  32          HB3       ALA  32  12.053  -7.101  -2.884
  239    H    ASP  33           HN       ASP  33  12.857  -4.192  -5.490
  240    HA   ASP  33           HA       ASP  33  15.683  -3.919  -5.703
  241   1HB   ASP  33          HB2       ASP  33  14.355  -4.504  -7.664
  242   2HB   ASP  33          HB1       ASP  33  13.440  -3.008  -7.525
  243    H    LEU  34           HN       LEU  34  12.958  -1.994  -4.980
  244    HA   LEU  34           HA       LEU  34  14.088   0.597  -5.257
  245   1HB   LEU  34          HB2       LEU  34  11.816  -0.210  -3.477
  246   2HB   LEU  34          HB1       LEU  34  12.117   1.362  -4.182
  247    HG   LEU  34           HG       LEU  34  11.338  -1.115  -5.704
  248   1HD1  LEU  34          HD11      LEU  34   9.206  -0.049  -5.970
  249   2HD1  LEU  34          HD12      LEU  34   9.761   1.322  -4.989
  250   3HD1  LEU  34          HD13      LEU  34   9.627  -0.288  -4.270
  251   1HD2  LEU  34          HD21      LEU  34  10.985   0.361  -7.555
  252   2HD2  LEU  34          HD22      LEU  34  12.680   0.391  -7.044
  253   3HD2  LEU  34          HD23      LEU  34  11.594   1.737  -6.628
  254    H    GLY  35           HN       GLY  35  13.513  -1.573  -2.505
  255   1HA   GLY  35          HA2       GLY  35  15.828  -1.012  -1.128
  256   2HA   GLY  35          HA1       GLY  35  14.723   0.253  -0.642
  257    H    LEU  36           HN       LEU  36  12.848  -2.499  -1.154
  258    HA   LEU  36           HA       LEU  36  12.802  -2.899   1.667
  259   1HB   LEU  36          HB2       LEU  36  10.686  -2.944   1.137
  260   2HB   LEU  36          HB1       LEU  36  10.846  -3.537  -0.470
  261    HG   LEU  36           HG       LEU  36  11.206  -5.845   0.594
  262   1HD1  LEU  36          HD11      LEU  36  11.829  -5.157   2.814
  263   2HD1  LEU  36          HD12      LEU  36  10.384  -6.171   2.860
  264   3HD1  LEU  36          HD13      LEU  36  10.244  -4.422   3.053
  265   1HD2  LEU  36          HD21      LEU  36   9.126  -5.192  -0.433
  266   2HD2  LEU  36          HD22      LEU  36   8.591  -4.455   1.074
  267   3HD2  LEU  36          HD23      LEU  36   8.840  -6.201   0.983
  268    H    ASP  37           HN       ASP  37  14.287  -3.913   2.508
  269    HA   ASP  37           HA       ASP  37  14.843  -6.647   1.602
  270   1HB   ASP  37          HB2       ASP  37  16.971  -6.525   2.734
  271   2HB   ASP  37          HB1       ASP  37  16.835  -5.098   1.721
  272    H    SER  38           HN       SER  38  13.902  -4.567   4.298
  273    HA   SER  38           HA       SER  38  12.783  -6.839   5.633
  274   1HB   SER  38          HB2       SER  38  14.022  -6.300   7.791
  275   2HB   SER  38          HB1       SER  38  14.965  -7.081   6.523
  276    HG   SER  38           HG       SER  38  15.994  -5.182   6.085
  277    H    LEU  39           HN       LEU  39  13.757  -3.542   6.615
  278    HA   LEU  39           HA       LEU  39  11.676  -3.058   8.348
  279   1HB   LEU  39          HB2       LEU  39  13.633  -1.616   8.239
  280   2HB   LEU  39          HB1       LEU  39  13.096  -0.980   6.695
  281    HG   LEU  39           HG       LEU  39  11.003  -0.206   7.885
  282   1HD1  LEU  39          HD11      LEU  39  11.122  -1.556   9.857
  283   2HD1  LEU  39          HD12      LEU  39  11.136   0.152  10.296
  284   3HD1  LEU  39          HD13      LEU  39  12.631  -0.781  10.338
  285   1HD2  LEU  39          HD21      LEU  39  12.039   1.808   8.764
  286   2HD2  LEU  39          HD22      LEU  39  12.720   1.343   7.208
  287   3HD2  LEU  39          HD23      LEU  39  13.628   1.035   8.698
  288    H    MET  40           HN       MET  40  11.699  -2.364   4.883
  289    HA   MET  40           HA       MET  40   9.269  -0.899   4.851
  290   1HB   MET  40          HB2       MET  40  10.469  -2.532   2.648
  291   2HB   MET  40          HB1       MET  40   9.123  -1.415   2.477
  292   1HG   MET  40          HG2       MET  40  10.655   0.386   3.326
  293   2HG   MET  40          HG1       MET  40  11.968  -0.781   3.175
  294   1HE   MET  40          HE1       MET  40   9.272   1.334   1.342
  295   2HE   MET  40          HE2       MET  40   8.801  -0.310   0.910
  296   3HE   MET  40          HE3       MET  40   9.432   0.779  -0.326
  297    H    GLY  41           HN       GLY  41   9.794  -4.323   4.689
  298   1HA   GLY  41          HA2       GLY  41   7.067  -4.891   4.061
  299   2HA   GLY  41          HA1       GLY  41   8.262  -6.044   4.657
  300    H    VAL  42           HN       VAL  42   8.925  -4.488   6.956
  301    HA   VAL  42           HA       VAL  42   6.968  -5.417   8.792
  302    HB   VAL  42           HB       VAL  42   9.200  -3.406   9.196
  303   1HG1  VAL  42          HG11      VAL  42   7.618  -4.949  11.242
  304   2HG1  VAL  42          HG12      VAL  42   7.567  -3.209  10.922
  305   3HG1  VAL  42          HG13      VAL  42   9.032  -3.937  11.575
  306   1HG2  VAL  42          HG21      VAL  42  10.069  -5.537   8.433
  307   2HG2  VAL  42          HG22      VAL  42   9.173  -6.378   9.697
  308   3HG2  VAL  42          HG23      VAL  42  10.485  -5.279  10.127
  309    H    GLU  43           HN       GLU  43   7.896  -2.235   7.653
  310    HA   GLU  43           HA       GLU  43   6.063  -0.708   9.057
  311   1HB   GLU  43          HB2       GLU  43   8.049   0.048   7.745
  312   2HB   GLU  43          HB1       GLU  43   7.102  -0.188   6.286
  313   1HG   GLU  43          HG2       GLU  43   7.210   2.092   7.010
  314   2HG   GLU  43          HG1       GLU  43   5.539   1.511   6.981
  315    H    VAL  44           HN       VAL  44   5.869  -2.309   5.930
  316    HA   VAL  44           HA       VAL  44   3.309  -1.405   5.132
  317    HB   VAL  44           HB       VAL  44   4.885  -3.874   4.298
  318   1HG1  VAL  44          HG11      VAL  44   3.411  -4.045   2.393
  319   2HG1  VAL  44          HG12      VAL  44   2.404  -2.742   3.044
  320   3HG1  VAL  44          HG13      VAL  44   2.524  -4.289   3.905
  321   1HG2  VAL  44          HG21      VAL  44   5.891  -1.778   3.684
  322   2HG2  VAL  44          HG22      VAL  44   4.389  -1.248   2.915
  323   3HG2  VAL  44          HG23      VAL  44   5.294  -2.620   2.258
  324    H    ARG  45           HN       ARG  45   4.360  -4.356   6.770
  325    HA   ARG  45           HA       ARG  45   1.859  -5.564   6.955
  326   1HB   ARG  45          HB2       ARG  45   4.314  -5.858   8.641
  327   2HB   ARG  45          HB1       ARG  45   2.870  -6.805   8.949
  328   1HG   ARG  45          HG2       ARG  45   2.978  -7.663   6.651
  329   2HG   ARG  45          HG1       ARG  45   4.462  -6.742   6.408
  330   1HD   ARG  45          HD2       ARG  45   4.060  -8.874   8.484
  331   2HD   ARG  45          HD1       ARG  45   4.854  -9.113   6.930
  332    HE   ARG  45           HE       ARG  45   6.205  -7.073   7.992
  333   1HH1  ARG  45          HH11      ARG  45   5.263 -10.218   9.301
  334   2HH1  ARG  45          HH12      ARG  45   6.649 -10.477  10.235
  335   1HH2  ARG  45          HH21      ARG  45   8.232  -7.408   9.294
  336   2HH2  ARG  45          HH22      ARG  45   8.430  -8.839  10.172
  337    H    GLN  46           HN       GLN  46   3.426  -3.349   9.186
  338    HA   GLN  46           HA       GLN  46   1.405  -3.505  11.172
  339   1HB   GLN  46          HB2       GLN  46   3.278  -1.202  10.575
  340   2HB   GLN  46          HB1       GLN  46   2.370  -1.422  12.061
  341   1HG   GLN  46          HG2       GLN  46   3.669  -3.289  12.683
  342   2HG   GLN  46          HG1       GLN  46   4.386  -3.403  11.080
  343   1HE2  GLN  46          HE21      GLN  46   4.747  -0.489  10.906
  344   2HE2  GLN  46          HE22      GLN  46   6.087  -0.119  11.916
  345    H    ILE  47           HN       ILE  47   1.360  -2.092   8.128
  346    HA   ILE  47           HA       ILE  47  -0.792  -0.260   8.787
  347    HB   ILE  47           HB       ILE  47   0.385  -0.978   6.070
  348   1HG1  ILE  47          HG12      ILE  47   0.866   1.489   7.753
  349   2HG1  ILE  47          HG11      ILE  47   1.989   0.143   7.608
  350   1HG2  ILE  47          HG21      ILE  47  -0.757   1.058   5.291
  351   2HG2  ILE  47          HG22      ILE  47  -1.471   1.259   6.895
  352   3HG2  ILE  47          HG23      ILE  47  -1.890  -0.143   5.909
  353   1HD1  ILE  47          HD11      ILE  47   1.100   1.962   5.374
  354   2HD1  ILE  47          HD12      ILE  47   2.217   0.605   5.217
  355   3HD1  ILE  47          HD13      ILE  47   2.661   2.000   6.199
  356    H    LEU  48           HN       LEU  48  -0.303  -2.846   6.417
  357    HA   LEU  48           HA       LEU  48  -3.040  -3.158   5.904
  358   1HB   LEU  48          HB2       LEU  48  -0.701  -4.893   5.223
  359   2HB   LEU  48          HB1       LEU  48  -2.317  -5.364   4.776
  360    HG   LEU  48           HG       LEU  48  -1.367  -4.389   2.868
  361   1HD1  LEU  48          HD11      LEU  48  -3.641  -3.708   3.218
  362   2HD1  LEU  48          HD12      LEU  48  -2.730  -2.416   2.431
  363   3HD1  LEU  48          HD13      LEU  48  -3.102  -2.310   4.152
  364   1HD2  LEU  48          HD21      LEU  48   0.524  -3.254   3.888
  365   2HD2  LEU  48          HD22      LEU  48  -0.555  -2.032   4.560
  366   3HD2  LEU  48          HD23      LEU  48  -0.345  -2.162   2.812
  367    H    GLU  49           HN       GLU  49  -0.984  -5.017   8.091
  368    HA   GLU  49           HA       GLU  49  -2.888  -7.049   8.622
  369   1HB   GLU  49          HB2       GLU  49  -0.506  -7.390   8.943
  370   2HB   GLU  49          HB1       GLU  49  -0.458  -6.130  10.157
  371   1HG   GLU  49          HG2       GLU  49  -1.943  -7.554  11.571
  372   2HG   GLU  49          HG1       GLU  49  -1.756  -8.834  10.367
  373    H    ARG  50           HN       ARG  50  -2.453  -3.893   9.716
  374    HA   ARG  50           HA       ARG  50  -3.979  -4.270  12.176
  375   1HB   ARG  50          HB2       ARG  50  -1.891  -3.142  12.379
  376   2HB   ARG  50          HB1       ARG  50  -2.295  -2.046  11.078
  377   1HG   ARG  50          HG2       ARG  50  -3.953  -0.973  12.484
  378   2HG   ARG  50          HG1       ARG  50  -3.597  -2.116  13.791
  379   1HD   ARG  50          HD2       ARG  50  -1.351  -1.347  13.957
  380   2HD   ARG  50          HD1       ARG  50  -1.513  -0.375  12.503
  381    HE   ARG  50           HE       ARG  50  -3.402   0.588  14.245
  382   1HH1  ARG  50          HH11      ARG  50   0.105   0.128  14.477
  383   2HH1  ARG  50          HH12      ARG  50   0.375   1.555  15.356
  384   1HH2  ARG  50          HH21      ARG  50  -3.058   2.512  15.372
  385   2HH2  ARG  50          HH22      ARG  50  -1.465   3.017  15.813
  386    H    GLU  51           HN       GLU  51  -4.107  -2.548   9.081
  387    HA   GLU  51           HA       GLU  51  -6.528  -1.216   9.876
  388   1HB   GLU  51          HB2       GLU  51  -5.117  -1.157   7.224
  389   2HB   GLU  51          HB1       GLU  51  -6.429  -0.099   7.732
  390   1HG   GLU  51          HG2       GLU  51  -4.974   0.678   9.602
  391   2HG   GLU  51          HG1       GLU  51  -3.659  -0.235   8.867
  392    H    HIS  52           HN       HIS  52  -5.643  -3.724   7.506
  393    HA   HIS  52           HA       HIS  52  -8.552  -4.034   7.031
  394   1HB   HIS  52          HB2       HIS  52  -7.037  -3.155   5.136
  395   2HB   HIS  52          HB1       HIS  52  -6.408  -4.790   5.046
  396    HD1  HIS  52           HD1      HIS  52  -7.984  -6.606   3.914
  397    HD2  HIS  52           HD2      HIS  52  -9.655  -2.800   4.182
  398    HE1  HIS  52           HE1      HIS  52  -9.922  -6.612   2.376
  399    HE2  HIS  52           HE2      HIS  52 -10.654  -4.215   2.294
  400    H    ASP  53           HN       ASP  53  -6.258  -5.371   8.738
  401    HA   ASP  53           HA       ASP  53  -5.749  -7.433   9.643
  402   1HB   ASP  53          HB2       ASP  53  -8.284  -8.376   8.249
  403   2HB   ASP  53          HB1       ASP  53  -7.382  -9.310   9.427
  404    H    LEU  54           HN       LEU  54  -4.960  -6.646   6.921
  405    HA   LEU  54           HA       LEU  54  -4.883  -9.107   5.390
  406   1HB   LEU  54          HB2       LEU  54  -5.497  -7.094   4.299
  407   2HB   LEU  54          HB1       LEU  54  -4.032  -6.295   4.805
  408    HG   LEU  54           HG       LEU  54  -2.731  -7.815   3.353
  409   1HD1  LEU  54          HD11      LEU  54  -3.905  -9.246   1.756
  410   2HD1  LEU  54          HD12      LEU  54  -5.447  -8.837   2.504
  411   3HD1  LEU  54          HD13      LEU  54  -4.243  -9.751   3.412
  412   1HD2  LEU  54          HD21      LEU  54  -3.500  -6.842   1.257
  413   2HD2  LEU  54          HD22      LEU  54  -3.538  -5.666   2.589
  414   3HD2  LEU  54          HD23      LEU  54  -5.029  -6.432   2.048
  415    H    VAL  55           HN       VAL  55  -3.332 -10.490   5.830
  416    HA   VAL  55           HA       VAL  55  -0.798  -9.542   6.869
  417    HB   VAL  55           HB       VAL  55  -1.744 -12.389   6.392
  418   1HG1  VAL  55          HG11      VAL  55   0.158 -13.052   7.809
  419   2HG1  VAL  55          HG12      VAL  55   0.672 -11.367   7.891
  420   3HG1  VAL  55          HG13      VAL  55   0.698 -12.219   6.351
  421   1HG2  VAL  55          HG21      VAL  55  -2.029 -12.494   8.832
  422   2HG2  VAL  55          HG22      VAL  55  -3.068 -11.261   8.112
  423   3HG2  VAL  55          HG23      VAL  55  -1.591 -10.789   8.950
  424    H    LEU  56           HN       LEU  56   0.447  -8.739   5.363
  425    HA   LEU  56           HA       LEU  56   0.982 -10.335   2.949
  426   1HB   LEU  56          HB2       LEU  56   1.336  -7.385   3.404
  427   2HB   LEU  56          HB1       LEU  56   1.846  -8.230   1.973
  428    HG   LEU  56           HG       LEU  56  -1.037  -7.955   2.827
  429   1HD1  LEU  56          HD11      LEU  56  -0.059  -5.808   2.165
  430   2HD1  LEU  56          HD12      LEU  56  -1.208  -6.387   0.964
  431   3HD1  LEU  56          HD13      LEU  56   0.526  -6.535   0.668
  432   1HD2  LEU  56          HD21      LEU  56  -1.500  -8.816   0.593
  433   2HD2  LEU  56          HD22      LEU  56  -0.562  -9.973   1.536
  434   3HD2  LEU  56          HD23      LEU  56   0.229  -8.997   0.299
  435    HA   PRO  57           HA       PRO  57   4.874 -10.570   5.288
  436   1HB   PRO  57          HB2       PRO  57   5.393 -12.768   3.444
  437   2HB   PRO  57          HB1       PRO  57   5.291 -12.819   5.213
  438   1HG   PRO  57          HG2       PRO  57   3.414 -13.947   3.646
  439   2HG   PRO  57          HG1       PRO  57   2.990 -13.157   5.180
  440   1HD   PRO  57          HD2       PRO  57   2.795 -12.116   2.380
  441   2HD   PRO  57          HD1       PRO  57   1.603 -12.027   3.698
  442    H    ILE  58           HN       ILE  58   7.187 -10.576   4.491
  443    HA   ILE  58           HA       ILE  58   7.509  -8.650   2.456
  444    HB   ILE  58           HB       ILE  58   9.514 -10.362   3.973
  445   1HG1  ILE  58          HG12      ILE  58  10.275  -8.131   4.866
  446   2HG1  ILE  58          HG11      ILE  58   8.935  -7.397   4.002
  447   1HG2  ILE  58          HG21      ILE  58  10.506 -10.043   1.804
  448   2HG2  ILE  58          HG22      ILE  58  11.361  -9.084   3.012
  449   3HG2  ILE  58          HG23      ILE  58  10.234  -8.304   1.901
  450   1HD1  ILE  58          HD11      ILE  58   7.368  -8.670   5.396
  451   2HD1  ILE  58          HD12      ILE  58   8.440  -7.661   6.362
  452   3HD1  ILE  58          HD13      ILE  58   8.730  -9.397   6.251
  453    H    ARG  59           HN       ARG  59   7.438 -12.037   2.478
  454    HA   ARG  59           HA       ARG  59   8.734 -12.649   0.062
  455   1HB   ARG  59          HB2       ARG  59   6.401 -14.135   1.311
  456   2HB   ARG  59          HB1       ARG  59   7.395 -14.745   0.009
  457   1HG   ARG  59          HG2       ARG  59   8.260 -15.848   1.846
  458   2HG   ARG  59          HG1       ARG  59   9.349 -14.473   1.717
  459   1HD   ARG  59          HD2       ARG  59   7.965 -13.310   3.450
  460   2HD   ARG  59          HD1       ARG  59   7.020 -14.782   3.619
  461    HE   ARG  59           HE       ARG  59   9.899 -14.968   3.992
  462   1HH1  ARG  59          HH11      ARG  59   6.657 -15.181   5.477
  463   2HH1  ARG  59          HH12      ARG  59   7.237 -15.491   7.029
  464   1HH2  ARG  59          HH21      ARG  59  10.684 -15.472   6.201
  465   2HH2  ARG  59          HH22      ARG  59   9.549 -15.647   7.443
  466    H    GLU  60           HN       GLU  60   5.601 -11.286   0.680
  467    HA   GLU  60           HA       GLU  60   4.892 -11.523  -2.150
  468   1HB   GLU  60          HB2       GLU  60   3.225 -10.883   0.273
  469   2HB   GLU  60          HB1       GLU  60   2.618 -10.798  -1.375
  470   1HG   GLU  60          HG2       GLU  60   3.115 -13.171  -1.671
  471   2HG   GLU  60          HG1       GLU  60   3.694 -13.248  -0.009
  472    H    VAL  61           HN       VAL  61   5.217  -9.224   0.498
  473    HA   VAL  61           HA       VAL  61   4.454  -6.921  -0.871
  474    HB   VAL  61           HB       VAL  61   6.426  -7.118   1.442
  475   1HG1  VAL  61          HG11      VAL  61   6.533  -4.934   0.354
  476   2HG1  VAL  61          HG12      VAL  61   5.790  -4.818   1.952
  477   3HG1  VAL  61          HG13      VAL  61   4.782  -4.771   0.505
  478   1HG2  VAL  61          HG21      VAL  61   4.293  -8.134   1.968
  479   2HG2  VAL  61          HG22      VAL  61   3.452  -6.677   1.441
  480   3HG2  VAL  61          HG23      VAL  61   4.505  -6.626   2.854
  481    H    ARG  62           HN       ARG  62   7.492  -8.637  -0.949
  482    HA   ARG  62           HA       ARG  62   9.054  -6.566  -1.959
  483   1HB   ARG  62          HB2       ARG  62   9.388  -9.479  -1.815
  484   2HB   ARG  62          HB1       ARG  62  10.355  -8.642  -3.023
  485   1HG   ARG  62          HG2       ARG  62  11.163  -7.122  -1.256
  486   2HG   ARG  62          HG1       ARG  62  10.283  -8.094  -0.075
  487   1HD   ARG  62          HD2       ARG  62  11.669  -9.911  -0.305
  488   2HD   ARG  62          HD1       ARG  62  12.183  -9.448  -1.929
  489    HE   ARG  62           HE       ARG  62  13.116  -7.472  -0.267
  490   1HH1  ARG  62          HH11      ARG  62  13.579 -11.007  -0.381
  491   2HH1  ARG  62          HH12      ARG  62  15.237 -10.911  -0.020
  492   1HH2  ARG  62          HH21      ARG  62  15.440  -7.389   0.150
  493   2HH2  ARG  62          HH22      ARG  62  16.304  -8.849   0.243
  494    H    GLN  63           HN       GLN  63   6.603  -8.312  -3.638
  495    HA   GLN  63           HA       GLN  63   7.823  -7.467  -6.158
  496   1HB   GLN  63          HB2       GLN  63   5.550  -9.422  -5.803
  497   2HB   GLN  63          HB1       GLN  63   6.194  -8.892  -7.340
  498   1HG   GLN  63          HG2       GLN  63   7.173 -10.970  -7.012
  499   2HG   GLN  63          HG1       GLN  63   8.427  -9.825  -6.554
  500   1HE2  GLN  63          HE21      GLN  63   5.633 -10.718  -4.630
  501   2HE2  GLN  63          HE22      GLN  63   6.528 -11.496  -3.373
  502    H    LEU  64           HN       LEU  64   5.972  -6.182  -3.991
  503    HA   LEU  64           HA       LEU  64   3.988  -5.048  -5.730
  504   1HB   LEU  64          HB2       LEU  64   5.062  -3.880  -3.144
  505   2HB   LEU  64          HB1       LEU  64   3.562  -3.451  -3.935
  506    HG   LEU  64           HG       LEU  64   4.214  -5.993  -2.502
  507   1HD1  LEU  64          HD11      LEU  64   2.380  -5.332  -1.010
  508   2HD1  LEU  64          HD12      LEU  64   2.222  -3.823  -1.911
  509   3HD1  LEU  64          HD13      LEU  64   3.705  -4.171  -1.023
  510   1HD2  LEU  64          HD21      LEU  64   1.682  -5.294  -3.996
  511   2HD2  LEU  64          HD22      LEU  64   1.897  -6.707  -2.963
  512   3HD2  LEU  64          HD23      LEU  64   2.848  -6.540  -4.439
  513    H    THR  65           HN       THR  65   4.237  -2.729  -6.494
  514    HA   THR  65           HA       THR  65   7.082  -2.252  -6.889
  515    HB   THR  65           HB       THR  65   6.353  -0.868  -8.824
  516    HG1  THR  65           HG1      THR  65   3.909  -1.694  -9.257
  517   1HG2  THR  65          HG21      THR  65   5.277  -3.707  -8.793
  518   2HG2  THR  65          HG22      THR  65   6.943  -3.255  -9.102
  519   3HG2  THR  65          HG23      THR  65   5.681  -2.779 -10.242
  520    H    LEU  66           HN       LEU  66   4.812   0.184  -7.356
  521    HA   LEU  66           HA       LEU  66   5.299   1.242  -4.714
  522   1HB   LEU  66          HB2       LEU  66   7.077   2.062  -6.545
  523   2HB   LEU  66          HB1       LEU  66   5.795   3.208  -6.899
  524    HG   LEU  66           HG       LEU  66   7.378   4.222  -5.373
  525   1HD1  LEU  66          HD11      LEU  66   5.919   4.817  -3.515
  526   2HD1  LEU  66          HD12      LEU  66   4.870   3.455  -3.951
  527   3HD1  LEU  66          HD13      LEU  66   5.056   4.812  -5.066
  528   1HD2  LEU  66          HD21      LEU  66   7.789   3.320  -3.143
  529   2HD2  LEU  66          HD22      LEU  66   8.313   2.197  -4.396
  530   3HD2  LEU  66          HD23      LEU  66   6.804   1.909  -3.528
  531    H    ARG  67           HN       ARG  67   3.973   2.144  -7.905
  532    HA   ARG  67           HA       ARG  67   1.753   3.303  -6.523
  533   1HB   ARG  67          HB2       ARG  67   2.216   2.930  -9.478
  534   2HB   ARG  67          HB1       ARG  67   0.745   3.636  -8.822
  535   1HG   ARG  67          HG2       ARG  67   3.544   4.726  -8.498
  536   2HG   ARG  67          HG1       ARG  67   2.291   5.367  -9.561
  537   1HD   ARG  67          HD2       ARG  67   0.898   5.806  -7.539
  538   2HD   ARG  67          HD1       ARG  67   2.243   5.268  -6.545
  539    HE   ARG  67           HE       ARG  67   3.528   7.165  -7.437
  540   1HH1  ARG  67          HH11      ARG  67   0.011   7.308  -7.527
  541   2HH1  ARG  67          HH12      ARG  67  -0.091   8.975  -7.731
  542   1HH2  ARG  67          HH21      ARG  67   3.425   9.566  -7.689
  543   2HH2  ARG  67          HH22      ARG  67   1.897  10.266  -7.822
  544    H    LYS  68           HN       LYS  68   2.538   0.191  -7.340
  545    HA   LYS  68           HA       LYS  68  -0.102  -0.833  -7.533
  546   1HB   LYS  68          HB2       LYS  68   1.874  -2.158  -8.228
  547   2HB   LYS  68          HB1       LYS  68   2.429  -2.201  -6.563
  548   1HG   LYS  68          HG2       LYS  68   0.493  -3.502  -5.915
  549   2HG   LYS  68          HG1       LYS  68  -0.139  -3.404  -7.559
  550   1HD   LYS  68          HD2       LYS  68   1.719  -4.661  -8.402
  551   2HD   LYS  68          HD1       LYS  68   2.500  -4.631  -6.818
  552   1HE   LYS  68          HE2       LYS  68   0.695  -5.931  -5.875
  553   2HE   LYS  68          HE1       LYS  68  -0.162  -5.903  -7.412
  554   1HZ   LYS  68          HZ1       LYS  68   1.375  -7.342  -8.371
  555   2HZ   LYS  68          HZ2       LYS  68   1.157  -7.957  -6.809
  556   3HZ   LYS  68          HZ3       LYS  68   2.546  -7.109  -7.184
  557    H    LEU  69           HN       LEU  69   1.813   0.426  -5.006
  558    HA   LEU  69           HA       LEU  69   0.581  -0.852  -2.810
  559   1HB   LEU  69          HB2       LEU  69   2.193   1.667  -3.083
  560   2HB   LEU  69          HB1       LEU  69   1.387   1.315  -1.577
  561    HG   LEU  69           HG       LEU  69   3.736   0.712  -1.475
  562   1HD1  LEU  69          HD11      LEU  69   3.536  -1.595  -0.710
  563   2HD1  LEU  69          HD12      LEU  69   1.957  -1.699  -1.487
  564   3HD1  LEU  69          HD13      LEU  69   2.208  -0.581  -0.147
  565   1HD2  LEU  69          HD21      LEU  69   3.160  -1.231  -3.711
  566   2HD2  LEU  69          HD22      LEU  69   4.670  -1.122  -2.803
  567   3HD2  LEU  69          HD23      LEU  69   4.155   0.220  -3.826
  568    H    GLN  70           HN       GLN  70  -0.436   1.671  -4.892
  569    HA   GLN  70           HA       GLN  70  -2.583   2.292  -3.069
  570   1HB   GLN  70          HB2       GLN  70  -3.212   3.940  -5.118
  571   2HB   GLN  70          HB1       GLN  70  -2.126   4.361  -3.804
  572   1HG   GLN  70          HG2       GLN  70  -0.206   3.866  -5.173
  573   2HG   GLN  70          HG1       GLN  70  -1.245   3.283  -6.467
  574   1HE2  GLN  70          HE21      GLN  70  -1.923   4.684  -7.937
  575   2HE2  GLN  70          HE22      GLN  70  -1.802   6.400  -7.848
  576    H    GLU  71           HN       GLU  71  -2.097  -0.086  -5.053
  577    HA   GLU  71           HA       GLU  71  -4.952  -0.306  -5.708
  578   1HB   GLU  71          HB2       GLU  71  -3.360  -0.610  -7.640
  579   2HB   GLU  71          HB1       GLU  71  -2.652  -1.974  -6.786
  580   1HG   GLU  71          HG2       GLU  71  -4.193  -2.749  -8.480
  581   2HG   GLU  71          HG1       GLU  71  -4.806  -3.140  -6.873
  582    H    MET  72           HN       MET  72  -2.233  -1.602  -4.016
  583    HA   MET  72           HA       MET  72  -3.800  -3.752  -2.808
  584   1HB   MET  72          HB2       MET  72  -0.896  -2.957  -2.490
  585   2HB   MET  72          HB1       MET  72  -1.647  -4.316  -1.675
  586   1HG   MET  72          HG2       MET  72  -1.392  -4.015  -4.659
  587   2HG   MET  72          HG1       MET  72  -0.315  -4.962  -3.639
  588   1HE   MET  72          HE1       MET  72  -2.689  -7.801  -2.341
  589   2HE   MET  72          HE2       MET  72  -2.333  -6.266  -1.548
  590   3HE   MET  72          HE3       MET  72  -1.044  -7.163  -2.348
  591    H    SER  73           HN       SER  73  -3.844  -0.643  -2.401
  592    HA   SER  73           HA       SER  73  -3.011  -0.246   0.249
  593   1HB   SER  73          HB2       SER  73  -4.146   1.983   0.019
  594   2HB   SER  73          HB1       SER  73  -2.946   1.584  -1.184
  595    HG   SER  73           HG       SER  73  -5.431   0.745  -1.998
  596    H    SER  74           HN       SER  74  -5.741  -1.625  -1.054
  597    HA   SER  74           HA       SER  74  -7.596  -2.550  -0.287
  598   1HB   SER  74          HB2       SER  74  -6.165  -2.471   2.363
  599   2HB   SER  74          HB1       SER  74  -7.471  -3.570   1.899
  600    HG   SER  74           HG       SER  74  -4.850  -3.403   0.830
  601    H    LYS  75           HN       LYS  75  -8.992  -0.835  -0.739
  602    HA   LYS  75           HA       LYS  75  -9.877   0.595   1.657
  603   1HB   LYS  75          HB2       LYS  75  -9.740   1.645  -1.161
  604   2HB   LYS  75          HB1       LYS  75 -10.633   2.429   0.132
  605   1HG   LYS  75          HG2       LYS  75  -7.668   1.967  -0.008
  606   2HG   LYS  75          HG1       LYS  75  -8.522   3.508  -0.160
  607   1HD   LYS  75          HD2       LYS  75  -9.359   3.248   2.135
  608   2HD   LYS  75          HD1       LYS  75  -8.455   1.738   2.278
  609   1HE   LYS  75          HE2       LYS  75  -7.376   4.511   1.915
  610   2HE   LYS  75          HE1       LYS  75  -7.184   3.452   3.313
  611   1HZ   LYS  75          HZ1       LYS  75  -6.008   3.190   0.632
  612   2HZ   LYS  75          HZ2       LYS  75  -5.978   1.904   1.764
  613   3HZ   LYS  75          HZ3       LYS  75  -5.209   3.377   2.115
  614    H    ALA  76           HN       ALA  76 -11.843   0.119   2.219
  615    HA   ALA  76           HA       ALA  76 -13.721  -0.873   0.261
  616   1HB   ALA  76          HB1       ALA  76 -14.065  -0.192   3.203
  617   2HB   ALA  76          HB2       ALA  76 -13.789  -1.805   2.548
  618   3HB   ALA  76          HB3       ALA  76 -15.293  -0.952   2.192
  619    H    GLY  77           HN       GLY  77 -13.432   0.983  -1.030
  620   1HA   GLY  77          HA2       GLY  77 -13.813   3.622  -0.062
  621   2HA   GLY  77          HA1       GLY  77 -13.675   3.138  -1.743
  622    H    SER  78           HN       SER  78 -15.475   4.877   0.010
  623    HA   SER  78           HA       SER  78 -18.080   3.820  -0.626
  624   1HB   SER  78          HB2       SER  78 -17.253   6.539   0.414
  625   2HB   SER  78          HB1       SER  78 -18.899   5.901   0.365
  626    HG   SER  78           HG       SER  78 -16.991   4.334   1.604
  627    H    ASP  79           HN       ASP  79 -18.506   3.780  -2.682
  628    HA   ASP  79           HA       ASP  79 -17.399   5.704  -4.511
  629   1HB   ASP  79          HB2       ASP  79 -17.582   3.350  -5.185
  630   2HB   ASP  79          HB1       ASP  79 -19.329   3.424  -5.019
  631    H    THR  80           HN       THR  80 -20.750   4.590  -4.424
  632    HA   THR  80           HA       THR  80 -22.661   5.598  -4.864
  633    HB   THR  80           HB       THR  80 -21.563   7.844  -3.139
  634    HG1  THR  80           HG1      THR  80 -23.051   5.515  -2.506
  635   1HG2  THR  80          HG21      THR  80 -24.411   6.970  -3.725
  636   2HG2  THR  80          HG22      THR  80 -23.643   8.434  -4.342
  637   3HG2  THR  80          HG23      THR  80 -23.938   8.254  -2.611
  638    H    GLU  81           HN       GLU  81 -22.368   5.809  -7.058
  639    HA   GLU  81           HA       GLU  81 -21.224   8.091  -8.246
  640   1HB   GLU  81          HB2       GLU  81 -22.508   7.330 -10.323
  641   2HB   GLU  81          HB1       GLU  81 -21.366   6.184  -9.647
  642   1HG   GLU  81          HG2       GLU  81 -23.219   4.984  -8.582
  643   2HG   GLU  81          HG1       GLU  81 -24.353   6.142  -9.272
  644    H    LEU  82           HN       LEU  82 -21.969  10.029  -8.603
  645    HA   LEU  82           HA       LEU  82 -24.430  10.671  -7.276
  646   1HB   LEU  82          HB2       LEU  82 -23.871  12.992  -7.485
  647   2HB   LEU  82          HB1       LEU  82 -22.495  12.107  -6.883
  648    HG   LEU  82           HG       LEU  82 -22.767  13.037  -9.752
  649   1HD1  LEU  82          HD11      LEU  82 -22.752  14.940  -8.241
  650   2HD1  LEU  82          HD12      LEU  82 -21.230  14.831  -9.125
  651   3HD1  LEU  82          HD13      LEU  82 -21.313  14.309  -7.443
  652   1HD2  LEU  82          HD21      LEU  82 -20.369  12.099  -8.166
  653   2HD2  LEU  82          HD22      LEU  82 -20.345  12.673  -9.834
  654   3HD2  LEU  82          HD23      LEU  82 -21.191  11.179  -9.425
  655    H    ALA  83           HN       ALA  83 -26.189  11.492  -8.046
  656    HA   ALA  83           HA       ALA  83 -26.555  11.477 -10.953
  657   1HB   ALA  83          HB1       ALA  83 -28.011   9.905  -9.741
  658   2HB   ALA  83          HB2       ALA  83 -28.959  11.221 -10.433
  659   3HB   ALA  83          HB3       ALA  83 -28.579  11.220  -8.709
  660    H    ALA  84           HN       ALA  84 -26.449  13.457 -11.731
  661    HA   ALA  84           HA       ALA  84 -27.240  15.661  -9.970
  662   1HB   ALA  84          HB1       ALA  84 -25.724  17.072 -11.269
  663   2HB   ALA  84          HB2       ALA  84 -25.308  15.697 -12.292
  664   3HB   ALA  84          HB3       ALA  84 -24.867  15.691 -10.584
  665    HA   PRO  85           HA       PRO  85 -30.393  16.184 -13.125
  666   1HB   PRO  85          HB2       PRO  85 -31.722  17.987 -11.321
  667   2HB   PRO  85          HB1       PRO  85 -32.155  16.318 -11.691
  668   1HG   PRO  85          HG2       PRO  85 -31.246  17.156  -9.238
  669   2HG   PRO  85          HG1       PRO  85 -31.079  15.498  -9.846
  670   1HD   PRO  85          HD2       PRO  85 -29.071  17.731  -9.849
  671   2HD   PRO  85          HD1       PRO  85 -28.850  16.014  -9.432
  672    H    LYS  86           HN       LYS  86 -27.927  17.832 -12.905
  673    HA   LYS  86           HA       LYS  86 -28.745  20.579 -13.258
  674   1HB   LYS  86          HB2       LYS  86 -26.069  19.247 -13.760
  675   2HB   LYS  86          HB1       LYS  86 -26.362  20.980 -13.702
  676   1HG   LYS  86          HG2       LYS  86 -27.007  20.779 -11.341
  677   2HG   LYS  86          HG1       LYS  86 -26.673  19.049 -11.414
  678   1HD   LYS  86          HD2       LYS  86 -24.338  19.510 -11.934
  679   2HD   LYS  86          HD1       LYS  86 -24.668  21.245 -11.917
  680   1HE   LYS  86          HE2       LYS  86 -25.294  21.117  -9.569
  681   2HE   LYS  86          HE1       LYS  86 -25.015  19.377  -9.575
  682   1HZ   LYS  86          HZ1       LYS  86 -23.114  20.513  -8.644
  683   2HZ   LYS  86          HZ2       LYS  86 -22.963  21.478 -10.035
  684   3HZ   LYS  86          HZ3       LYS  86 -22.695  19.815 -10.117
  685    H    SER  87           HN       SER  87 -27.233  18.074 -15.255
  686    HA   SER  87           HA       SER  87 -28.677  19.155 -17.546
  687   1HB   SER  87          HB2       SER  87 -26.110  19.588 -17.470
  688   2HB   SER  87          HB1       SER  87 -25.951  17.848 -17.719
  689    HG   SER  87           HG       SER  87 -27.168  19.774 -19.351
  690    H    LYS  88           HN       LYS  88 -30.106  17.663 -18.130
  691    HA   LYS  88           HA       LYS  88 -30.324  15.178 -16.885
  692   1HB   LYS  88          HB2       LYS  88 -32.320  16.131 -17.724
  693   2HB   LYS  88          HB1       LYS  88 -31.688  16.187 -19.371
  694   1HG   LYS  88          HG2       LYS  88 -31.596  13.709 -19.379
  695   2HG   LYS  88          HG1       LYS  88 -32.345  13.707 -17.789
  696   1HD   LYS  88          HD2       LYS  88 -34.352  14.642 -18.682
  697   2HD   LYS  88          HD1       LYS  88 -33.587  14.909 -20.255
  698   1HE   LYS  88          HE2       LYS  88 -33.959  12.204 -18.972
  699   2HE   LYS  88          HE1       LYS  88 -35.034  12.886 -20.187
  700   1HZ   LYS  88          HZ1       LYS  88 -33.349  11.347 -21.121
  701   2HZ   LYS  88          HZ2       LYS  88 -32.106  12.405 -20.686
  702   3HZ   LYS  88          HZ3       LYS  88 -33.307  12.884 -21.776
  703    H    ASN  89           HN       ASN  89 -29.449  15.790 -20.260
  704    HA   ASN  89           HA       ASN  89 -28.487  14.564 -21.839
  705   1HB   ASN  89          HB2       ASN  89 -26.658  13.768 -20.443
  706   2HB   ASN  89          HB1       ASN  89 -27.712  12.612 -19.632
  707   1HD2  ASN  89          HD21      ASN  89 -26.052  13.363 -22.595
  708   2HD2  ASN  89          HD22      ASN  89 -26.097  11.780 -23.269
  Start of MODEL   22
    1   1H    GLY   1          HT1       GLY   1 -10.050   7.751  18.819
    2   2H    GLY   1          HT2       GLY   1 -11.308   7.745  19.962
    3   3H    GLY   1          HT3       GLY   1 -11.160   6.494  18.821
    4   1HA   GLY   1          HA1       GLY   1  -9.156   7.009  20.904
    5   2HA   GLY   1          HA2       GLY   1 -10.437   5.799  21.011
    6    H    ASP   2           HN       ASP   2  -7.517   6.767  19.382
    7    HA   ASP   2           HA       ASP   2  -6.809   4.128  18.677
    8   1HB   ASP   2          HB2       ASP   2  -6.778   4.451  16.212
    9   2HB   ASP   2          HB1       ASP   2  -8.410   4.427  16.859
   10    H    GLY   3           HN       GLY   3  -4.674   4.070  17.969
   11   1HA   GLY   3          HA2       GLY   3  -3.203   6.503  18.511
   12   2HA   GLY   3          HA1       GLY   3  -2.529   4.904  18.210
   13    H    GLU   4           HN       GLU   4  -4.303   4.615  15.832
   14    HA   GLU   4           HA       GLU   4  -3.385   6.619  14.021
   15   1HB   GLU   4          HB2       GLU   4  -2.152   5.139  12.559
   16   2HB   GLU   4          HB1       GLU   4  -1.412   5.151  14.145
   17   1HG   GLU   4          HG2       GLU   4  -3.254   2.964  13.164
   18   2HG   GLU   4          HG1       GLU   4  -1.504   2.918  13.025
   19    H    ALA   5           HN       ALA   5  -4.499   6.633  12.186
   20    HA   ALA   5           HA       ALA   5  -6.608   4.636  11.768
   21   1HB   ALA   5          HB1       ALA   5  -7.330   6.983  11.624
   22   2HB   ALA   5          HB2       ALA   5  -7.417   6.237  10.025
   23   3HB   ALA   5          HB3       ALA   5  -6.076   7.311  10.425
   24    H    GLN   6           HN       GLN   6  -6.713   3.896   9.338
   25    HA   GLN   6           HA       GLN   6  -4.039   3.092   8.722
   26   1HB   GLN   6          HB2       GLN   6  -6.032   1.611   8.384
   27   2HB   GLN   6          HB1       GLN   6  -6.503   2.648   7.040
   28   1HG   GLN   6          HG2       GLN   6  -4.287   2.191   6.007
   29   2HG   GLN   6          HG1       GLN   6  -3.991   1.024   7.288
   30   1HE2  GLN   6          HE21      GLN   6  -3.879  -0.693   5.964
   31   2HE2  GLN   6          HE22      GLN   6  -5.218  -1.295   5.051
   32    H    ARG   7           HN       ARG   7  -2.694   4.142   7.530
   33    HA   ARG   7           HA       ARG   7  -3.609   6.349   5.858
   34   1HB   ARG   7          HB2       ARG   7  -1.219   6.950   5.692
   35   2HB   ARG   7          HB1       ARG   7  -1.713   6.775   7.367
   36   1HG   ARG   7          HG2       ARG   7  -0.719   4.472   7.331
   37   2HG   ARG   7          HG1       ARG   7  -0.073   4.848   5.734
   38   1HD   ARG   7          HD2       ARG   7   1.618   5.236   7.440
   39   2HD   ARG   7          HD1       ARG   7   1.145   6.767   6.696
   40    HE   ARG   7           HE       ARG   7  -0.487   6.651   8.826
   41   1HH1  ARG   7          HH11      ARG   7   3.069   6.217   8.666
   42   2HH1  ARG   7          HH12      ARG   7   3.250   6.775  10.273
   43   1HH2  ARG   7          HH21      ARG   7  -0.087   7.427  10.982
   44   2HH2  ARG   7          HH22      ARG   7   1.536   7.418  11.548
   45    H    ASP   8           HN       ASP   8  -1.939   6.439   3.790
   46    HA   ASP   8           HA       ASP   8  -2.611   4.017   2.332
   47   1HB   ASP   8          HB2       ASP   8  -3.047   6.204   1.273
   48   2HB   ASP   8          HB1       ASP   8  -1.326   6.570   1.367
   49    H    LEU   9           HN       LEU   9  -0.950   2.957   1.003
   50    HA   LEU   9           HA       LEU   9   1.342   2.502   2.658
   51   1HB   LEU   9          HB2       LEU   9   0.490   1.172   0.099
   52   2HB   LEU   9          HB1       LEU   9   1.860   0.680   1.076
   53    HG   LEU   9           HG       LEU   9  -1.036   0.622   1.917
   54   1HD1  LEU   9          HD11      LEU   9  -0.460  -1.112   0.306
   55   2HD1  LEU   9          HD12      LEU   9  -0.730  -1.801   1.908
   56   3HD1  LEU   9          HD13      LEU   9   0.914  -1.592   1.303
   57   1HD2  LEU   9          HD21      LEU   9  -0.222  -0.508   3.928
   58   2HD2  LEU   9          HD22      LEU   9   0.412   1.135   3.790
   59   3HD2  LEU   9          HD23      LEU   9   1.442  -0.243   3.396
   60    H    VAL  10           HN       VAL  10   0.705   4.232  -0.317
   61    HA   VAL  10           HA       VAL  10   3.492   4.384  -1.017
   62    HB   VAL  10           HB       VAL  10   1.043   5.907  -2.028
   63   1HG1  VAL  10          HG11      VAL  10   3.864   6.010  -3.105
   64   2HG1  VAL  10          HG12      VAL  10   3.021   7.334  -2.295
   65   3HG1  VAL  10          HG13      VAL  10   2.446   6.743  -3.855
   66   1HG2  VAL  10          HG21      VAL  10   2.733   3.753  -3.278
   67   2HG2  VAL  10          HG22      VAL  10   1.370   4.567  -4.048
   68   3HG2  VAL  10          HG23      VAL  10   1.110   3.561  -2.620
   69    H    LYS  11           HN       LYS  11   1.242   6.033   0.916
   70    HA   LYS  11           HA       LYS  11   2.895   8.326   1.416
   71   1HB   LYS  11          HB2       LYS  11   0.330   7.286   2.497
   72   2HB   LYS  11          HB1       LYS  11   1.174   8.531   3.410
   73   1HG   LYS  11          HG2       LYS  11  -0.589   9.462   1.967
   74   2HG   LYS  11          HG1       LYS  11   1.000  10.057   1.523
   75   1HD   LYS  11          HD2       LYS  11   1.074   8.560  -0.369
   76   2HD   LYS  11          HD1       LYS  11  -0.444   7.807   0.105
   77   1HE   LYS  11          HE2       LYS  11  -0.092  10.704  -0.665
   78   2HE   LYS  11          HE1       LYS  11  -0.721   9.439  -1.723
   79   1HZ   LYS  11          HZ1       LYS  11  -1.964  10.302   0.839
   80   2HZ   LYS  11          HZ2       LYS  11  -2.603   9.155  -0.227
   81   3HZ   LYS  11          HZ3       LYS  11  -2.493  10.757  -0.684
   82    H    ALA  12           HN       ALA  12   3.301   5.246   2.183
   83    HA   ALA  12           HA       ALA  12   4.703   5.866   4.683
   84   1HB   ALA  12          HB1       ALA  12   2.835   4.330   5.080
   85   2HB   ALA  12          HB2       ALA  12   4.380   3.518   5.335
   86   3HB   ALA  12          HB3       ALA  12   3.469   3.230   3.856
   87    H    VAL  13           HN       VAL  13   4.708   3.300   2.200
   88    HA   VAL  13           HA       VAL  13   7.426   2.612   2.457
   89    HB   VAL  13           HB       VAL  13   5.631   2.224   0.051
   90   1HG1  VAL  13          HG11      VAL  13   7.087   0.322  -0.490
   91   2HG1  VAL  13          HG12      VAL  13   8.131   0.747   0.868
   92   3HG1  VAL  13          HG13      VAL  13   7.959   1.857  -0.494
   93   1HG2  VAL  13          HG21      VAL  13   4.602   1.300   2.045
   94   2HG2  VAL  13          HG22      VAL  13   6.082   0.421   2.426
   95   3HG2  VAL  13          HG23      VAL  13   5.156   0.001   0.985
   96    H    ALA  14           HN       ALA  14   5.751   4.545   0.026
   97    HA   ALA  14           HA       ALA  14   8.133   5.153  -1.367
   98   1HB   ALA  14          HB1       ALA  14   6.748   6.714  -2.681
   99   2HB   ALA  14          HB2       ALA  14   5.441   6.527  -1.504
  100   3HB   ALA  14          HB3       ALA  14   5.930   5.164  -2.485
  101    H    HIS  15           HN       HIS  15   6.372   6.616   1.241
  102    HA   HIS  15           HA       HIS  15   7.625   9.152   1.216
  103   1HB   HIS  15          HB2       HIS  15   5.533   8.563   2.521
  104   2HB   HIS  15          HB1       HIS  15   6.556   7.701   3.658
  105    HD1  HIS  15           HD1      HIS  15   5.366   9.523   5.380
  106    HD2  HIS  15           HD2      HIS  15   8.170  11.028   2.688
  107    HE1  HIS  15           HE1      HIS  15   5.954  11.787   6.212
  108    HE2  HIS  15           HE2      HIS  15   7.929  12.429   4.846
  109    H    ILE  16           HN       ILE  16   8.483   6.078   2.682
  110    HA   ILE  16           HA       ILE  16  10.756   6.826   4.132
  111    HB   ILE  16           HB       ILE  16  10.093   4.233   2.698
  112   1HG1  ILE  16          HG12      ILE  16   8.563   4.816   4.525
  113   2HG1  ILE  16          HG11      ILE  16   9.497   3.373   4.905
  114   1HG2  ILE  16          HG21      ILE  16  12.335   4.672   4.661
  115   2HG2  ILE  16          HG22      ILE  16  12.489   4.287   2.946
  116   3HG2  ILE  16          HG23      ILE  16  11.795   3.106   4.055
  117   1HD1  ILE  16          HD11      ILE  16  10.953   4.703   6.344
  118   2HD1  ILE  16          HD12      ILE  16   9.262   4.836   6.837
  119   3HD1  ILE  16          HD13      ILE  16  10.028   6.149   5.947
  120    H    LEU  17           HN       LEU  17  10.329   6.097   0.724
  121    HA   LEU  17           HA       LEU  17  13.183   6.206   0.173
  122   1HB   LEU  17          HB2       LEU  17  10.866   5.910  -1.718
  123   2HB   LEU  17          HB1       LEU  17  12.555   5.724  -2.136
  124    HG   LEU  17           HG       LEU  17  10.974   3.967  -0.288
  125   1HD1  LEU  17          HD11      LEU  17  11.247   2.294  -2.044
  126   2HD1  LEU  17          HD12      LEU  17  12.062   3.491  -3.050
  127   3HD1  LEU  17          HD13      LEU  17  10.367   3.711  -2.617
  128   1HD2  LEU  17          HD21      LEU  17  12.964   2.519  -0.289
  129   2HD2  LEU  17          HD22      LEU  17  13.309   4.099   0.416
  130   3HD2  LEU  17          HD23      LEU  17  13.838   3.734  -1.225
  131    H    GLY  18           HN       GLY  18  10.799   8.479   0.518
  132   1HA   GLY  18          HA2       GLY  18  10.988  10.779   0.191
  133   2HA   GLY  18          HA1       GLY  18  12.432  10.495  -0.767
  134    H    ILE  19           HN       ILE  19   9.458   8.811  -1.432
  135    HA   ILE  19           HA       ILE  19   9.007  10.544  -3.718
  136    HB   ILE  19           HB       ILE  19   8.010   8.336  -4.717
  137   1HG1  ILE  19          HG12      ILE  19  10.275   7.283  -3.011
  138   2HG1  ILE  19          HG11      ILE  19   8.576   6.843  -2.903
  139   1HG2  ILE  19          HG21      ILE  19  10.071   8.041  -6.003
  140   2HG2  ILE  19          HG22      ILE  19  10.870   9.159  -4.876
  141   3HG2  ILE  19          HG23      ILE  19   9.488   9.701  -5.854
  142   1HD1  ILE  19          HD11      ILE  19  10.413   6.264  -5.214
  143   2HD1  ILE  19          HD12      ILE  19   8.708   5.831  -5.122
  144   3HD1  ILE  19          HD13      ILE  19   9.862   5.106  -4.002
  145    H    ARG  20           HN       ARG  20   6.880  10.401  -4.591
  146    HA   ARG  20           HA       ARG  20   4.759   9.357  -2.933
  147   1HB   ARG  20          HB2       ARG  20   5.489  11.447  -1.778
  148   2HB   ARG  20          HB1       ARG  20   5.049  12.337  -3.227
  149   1HG   ARG  20          HG2       ARG  20   2.740  11.661  -2.963
  150   2HG   ARG  20          HG1       ARG  20   3.167  10.721  -1.527
  151   1HD   ARG  20          HD2       ARG  20   3.402  13.701  -1.905
  152   2HD   ARG  20          HD1       ARG  20   2.308  12.845  -0.811
  153    HE   ARG  20           HE       ARG  20   4.873  12.063  -0.130
  154   1HH1  ARG  20          HH11      ARG  20   3.130  15.147  -0.226
  155   2HH1  ARG  20          HH12      ARG  20   3.933  15.787   1.135
  156   1HH2  ARG  20          HH21      ARG  20   6.045  12.970   1.574
  157   2HH2  ARG  20          HH22      ARG  20   5.713  14.545   2.155
  158    H    ASP  21           HN       ASP  21   5.726  11.631  -5.443
  159    HA   ASP  21           HA       ASP  21   3.169  11.386  -6.743
  160   1HB   ASP  21          HB2       ASP  21   3.962  13.034  -8.361
  161   2HB   ASP  21          HB1       ASP  21   4.289  13.550  -6.706
  162    H    LEU  22           HN       LEU  22   6.462  10.444  -7.495
  163    HA   LEU  22           HA       LEU  22   7.274   8.870  -8.906
  164   1HB   LEU  22          HB2       LEU  22   4.496   7.785  -8.512
  165   2HB   LEU  22          HB1       LEU  22   5.622   6.995  -9.585
  166    HG   LEU  22           HG       LEU  22   5.545   5.871  -7.501
  167   1HD1  LEU  22          HD11      LEU  22   7.663   5.877  -8.611
  168   2HD1  LEU  22          HD12      LEU  22   7.943   5.957  -6.867
  169   3HD1  LEU  22          HD13      LEU  22   8.096   7.407  -7.866
  170   1HD2  LEU  22          HD21      LEU  22   4.814   7.648  -6.023
  171   2HD2  LEU  22          HD22      LEU  22   6.366   8.463  -6.193
  172   3HD2  LEU  22          HD23      LEU  22   6.277   6.896  -5.386
  173    H    ALA  23           HN       ALA  23   5.971  11.349  -9.966
  174    HA   ALA  23           HA       ALA  23   4.831  10.493 -12.462
  175   1HB   ALA  23          HB1       ALA  23   5.548  13.280 -11.536
  176   2HB   ALA  23          HB2       ALA  23   3.974  12.508 -11.343
  177   3HB   ALA  23          HB3       ALA  23   4.583  12.882 -12.956
  178    H    GLY  24           HN       GLY  24   7.800  10.924 -11.253
  179   1HA   GLY  24          HA2       GLY  24   8.999  10.537 -13.853
  180   2HA   GLY  24          HA1       GLY  24   9.560  11.978 -12.988
  181    H    ILE  25           HN       ILE  25   8.651   8.824 -11.722
  182    HA   ILE  25           HA       ILE  25  11.389   8.212 -11.105
  183    HB   ILE  25           HB       ILE  25   9.189   8.137  -8.971
  184   1HG1  ILE  25          HG12      ILE  25  10.853   9.675  -7.672
  185   2HG1  ILE  25          HG11      ILE  25  11.526  10.028  -9.253
  186   1HG2  ILE  25          HG21      ILE  25  10.937   7.413  -7.415
  187   2HG2  ILE  25          HG22      ILE  25  12.091   7.369  -8.749
  188   3HG2  ILE  25          HG23      ILE  25  10.705   6.282  -8.748
  189   1HD1  ILE  25          HD11      ILE  25   9.374  10.897  -9.976
  190   2HD1  ILE  25          HD12      ILE  25   9.956  11.748  -8.540
  191   3HD1  ILE  25          HD13      ILE  25   8.681  10.534  -8.394
  192    H    ASN  26           HN       ASN  26  11.615   5.920 -11.091
  193    HA   ASN  26           HA       ASN  26   9.568   4.588 -12.526
  194   1HB   ASN  26          HB2       ASN  26  12.173   3.640 -11.381
  195   2HB   ASN  26          HB1       ASN  26  11.021   2.499 -12.053
  196   1HD2  ASN  26          HD21      ASN  26  10.154   4.364 -14.187
  197   2HD2  ASN  26          HD22      ASN  26  11.465   4.404 -15.306
  198    H    LEU  27           HN       LEU  27   7.797   4.124 -11.694
  199    HA   LEU  27           HA       LEU  27   7.601   3.236  -8.939
  200   1HB   LEU  27          HB2       LEU  27   5.094   3.304  -9.466
  201   2HB   LEU  27          HB1       LEU  27   5.964   4.818  -9.401
  202    HG   LEU  27           HG       LEU  27   6.063   4.739 -11.935
  203   1HD1  LEU  27          HD11      LEU  27   4.000   2.579 -11.608
  204   2HD1  LEU  27          HD12      LEU  27   5.620   2.413 -12.302
  205   3HD1  LEU  27          HD13      LEU  27   4.417   3.418 -13.106
  206   1HD2  LEU  27          HD21      LEU  27   3.362   4.915 -10.625
  207   2HD2  LEU  27          HD22      LEU  27   3.776   5.564 -12.211
  208   3HD2  LEU  27          HD23      LEU  27   4.555   6.206 -10.761
  209    H    ASP  28           HN       ASP  28   8.499   1.807 -11.509
  210    HA   ASP  28           HA       ASP  28   6.834  -0.577 -11.607
  211   1HB   ASP  28          HB2       ASP  28   9.487  -0.051 -12.946
  212   2HB   ASP  28          HB1       ASP  28   8.304  -1.275 -13.375
  213    H    SER  29           HN       SER  29   9.447   0.590  -9.825
  214    HA   SER  29           HA       SER  29  10.996  -1.734  -9.624
  215   1HB   SER  29          HB2       SER  29  10.903   0.703  -7.859
  216   2HB   SER  29          HB1       SER  29  12.183  -0.513  -7.909
  217    HG   SER  29           HG       SER  29  12.941   0.880  -9.279
  218    H    SER  30           HN       SER  30  10.844  -3.379  -8.433
  219    HA   SER  30           HA       SER  30   8.633  -3.860  -6.679
  220   1HB   SER  30          HB2       SER  30  11.116  -5.421  -7.367
  221   2HB   SER  30          HB1       SER  30   9.826  -6.070  -6.376
  222    HG   SER  30           HG       SER  30   9.464  -5.088  -9.046
  223    H    LEU  31           HN       LEU  31   8.762  -4.127  -4.391
  224    HA   LEU  31           HA       LEU  31  10.542  -2.463  -3.061
  225   1HB   LEU  31          HB2       LEU  31   8.594  -4.475  -2.076
  226   2HB   LEU  31          HB1       LEU  31   9.785  -3.875  -0.948
  227    HG   LEU  31           HG       LEU  31   8.993  -1.581  -1.317
  228   1HD1  LEU  31          HD11      LEU  31   6.939  -1.167  -2.537
  229   2HD1  LEU  31          HD12      LEU  31   6.923  -2.864  -3.042
  230   3HD1  LEU  31          HD13      LEU  31   8.217  -1.797  -3.583
  231   1HD2  LEU  31          HD21      LEU  31   8.044  -2.867   0.492
  232   2HD2  LEU  31          HD22      LEU  31   6.821  -3.524  -0.593
  233   3HD2  LEU  31          HD23      LEU  31   6.827  -1.802  -0.213
  234    H    ALA  32           HN       ALA  32  10.974  -5.801  -3.832
  235    HA   ALA  32           HA       ALA  32  13.080  -6.139  -1.987
  236   1HB   ALA  32          HB1       ALA  32  12.603  -7.687  -4.540
  237   2HB   ALA  32          HB2       ALA  32  11.958  -8.090  -2.947
  238   3HB   ALA  32          HB3       ALA  32  13.696  -8.162  -3.241
  239    H    ASP  33           HN       ASP  33  12.870  -4.627  -5.061
  240    HA   ASP  33           HA       ASP  33  15.666  -4.671  -5.603
  241   1HB   ASP  33          HB2       ASP  33  14.141  -4.346  -7.473
  242   2HB   ASP  33          HB1       ASP  33  13.472  -2.909  -6.713
  243    H    LEU  34           HN       LEU  34  13.325  -2.494  -4.271
  244    HA   LEU  34           HA       LEU  34  14.836  -0.195  -3.793
  245   1HB   LEU  34          HB2       LEU  34  12.673  -1.260  -1.998
  246   2HB   LEU  34          HB1       LEU  34  13.132   0.410  -2.248
  247    HG   LEU  34           HG       LEU  34  11.806  -1.363  -4.287
  248   1HD1  LEU  34          HD11      LEU  34   9.848   0.013  -3.902
  249   2HD1  LEU  34          HD12      LEU  34  10.709   0.858  -2.602
  250   3HD1  LEU  34          HD13      LEU  34  10.370  -0.872  -2.469
  251   1HD2  LEU  34          HD21      LEU  34  12.448   1.586  -4.373
  252   2HD2  LEU  34          HD22      LEU  34  11.496   0.697  -5.564
  253   3HD2  LEU  34          HD23      LEU  34  13.202   0.313  -5.343
  254    H    GLY  35           HN       GLY  35  14.053  -2.894  -1.636
  255   1HA   GLY  35          HA2       GLY  35  16.320  -3.656  -0.560
  256   2HA   GLY  35          HA1       GLY  35  16.190  -2.075   0.187
  257    H    LEU  36           HN       LEU  36  13.500  -4.316  -0.462
  258    HA   LEU  36           HA       LEU  36  12.879  -4.067   2.271
  259   1HB   LEU  36          HB2       LEU  36  10.915  -3.924   1.350
  260   2HB   LEU  36          HB1       LEU  36  11.236  -4.900  -0.035
  261    HG   LEU  36           HG       LEU  36  10.902  -6.932   1.470
  262   1HD1  LEU  36          HD11      LEU  36   9.974  -4.888   3.469
  263   2HD1  LEU  36          HD12      LEU  36  11.396  -5.919   3.614
  264   3HD1  LEU  36          HD13      LEU  36   9.784  -6.634   3.605
  265   1HD2  LEU  36          HD21      LEU  36   8.608  -4.994   1.273
  266   2HD2  LEU  36          HD22      LEU  36   8.474  -6.728   1.570
  267   3HD2  LEU  36          HD23      LEU  36   9.124  -6.141   0.038
  268    H    ASP  37           HN       ASP  37  14.131  -4.883   3.422
  269    HA   ASP  37           HA       ASP  37  13.372  -7.312   4.498
  270   1HB   ASP  37          HB2       ASP  37  15.109  -8.278   2.945
  271   2HB   ASP  37          HB1       ASP  37  16.302  -7.182   3.648
  272    H    SER  38           HN       SER  38  12.714  -5.308   5.624
  273    HA   SER  38           HA       SER  38  14.153  -4.804   7.860
  274   1HB   SER  38          HB2       SER  38  14.619  -2.413   7.281
  275   2HB   SER  38          HB1       SER  38  15.602  -3.522   6.323
  276    HG   SER  38           HG       SER  38  14.830  -2.228   4.836
  277    H    LEU  39           HN       LEU  39  13.069  -2.260   7.760
  278    HA   LEU  39           HA       LEU  39  10.414  -2.467   8.701
  279   1HB   LEU  39          HB2       LEU  39  11.894  -0.623   9.266
  280   2HB   LEU  39          HB1       LEU  39  11.837  -0.054   7.607
  281    HG   LEU  39           HG       LEU  39   9.324   0.160   7.956
  282   1HD1  LEU  39          HD11      LEU  39   9.098  -1.096   9.975
  283   2HD1  LEU  39          HD12      LEU  39   8.600   0.578  10.244
  284   3HD1  LEU  39          HD13      LEU  39  10.170   0.021  10.826
  285   1HD2  LEU  39          HD21      LEU  39   9.572   2.389   8.928
  286   2HD2  LEU  39          HD22      LEU  39  10.781   2.037   7.693
  287   3HD2  LEU  39          HD23      LEU  39  11.229   1.986   9.403
  288    H    MET  40           HN       MET  40  11.709  -2.017   5.513
  289    HA   MET  40           HA       MET  40   9.566  -0.722   4.118
  290   1HB   MET  40          HB2       MET  40  11.852  -2.385   3.078
  291   2HB   MET  40          HB1       MET  40  10.764  -1.395   2.110
  292   1HG   MET  40          HG2       MET  40  11.516   0.602   3.255
  293   2HG   MET  40          HG1       MET  40  12.596  -0.365   4.254
  294   1HE   MET  40          HE1       MET  40  13.483   2.182   2.549
  295   2HE   MET  40          HE2       MET  40  15.021   1.613   1.890
  296   3HE   MET  40          HE3       MET  40  14.588   1.254   3.561
  297    H    GLY  41           HN       GLY  41   8.784  -3.119   5.558
  298   1HA   GLY  41          HA2       GLY  41   6.907  -4.126   3.661
  299   2HA   GLY  41          HA1       GLY  41   8.142  -5.329   4.044
  300    H    VAL  42           HN       VAL  42   8.603  -4.512   6.698
  301    HA   VAL  42           HA       VAL  42   6.560  -5.946   7.985
  302    HB   VAL  42           HB       VAL  42   8.754  -4.246   9.218
  303   1HG1  VAL  42          HG11      VAL  42   6.947  -4.666  10.816
  304   2HG1  VAL  42          HG12      VAL  42   8.396  -5.581  11.248
  305   3HG1  VAL  42          HG13      VAL  42   7.038  -6.394  10.471
  306   1HG2  VAL  42          HG21      VAL  42   9.633  -6.017   7.816
  307   2HG2  VAL  42          HG22      VAL  42   8.626  -7.203   8.644
  308   3HG2  VAL  42          HG23      VAL  42   9.926  -6.385   9.514
  309    H    GLU  43           HN       GLU  43   7.282  -2.447   7.864
  310    HA   GLU  43           HA       GLU  43   5.178  -1.761   9.643
  311   1HB   GLU  43          HB2       GLU  43   7.101  -0.244   9.108
  312   2HB   GLU  43          HB1       GLU  43   6.441  -0.032   7.490
  313   1HG   GLU  43          HG2       GLU  43   4.455   1.006   8.409
  314   2HG   GLU  43          HG1       GLU  43   5.044   0.739  10.046
  315    H    VAL  44           HN       VAL  44   5.429  -2.182   6.214
  316    HA   VAL  44           HA       VAL  44   2.987  -1.188   5.262
  317    HB   VAL  44           HB       VAL  44   4.330  -3.710   4.306
  318   1HG1  VAL  44          HG11      VAL  44   3.518  -3.058   2.107
  319   2HG1  VAL  44          HG12      VAL  44   2.696  -1.672   2.837
  320   3HG1  VAL  44          HG13      VAL  44   2.223  -3.318   3.276
  321   1HG2  VAL  44          HG21      VAL  44   5.698  -2.302   2.826
  322   2HG2  VAL  44          HG22      VAL  44   6.042  -2.107   4.540
  323   3HG2  VAL  44          HG23      VAL  44   5.105  -0.868   3.690
  324    H    ARG  45           HN       ARG  45   3.923  -4.445   6.154
  325    HA   ARG  45           HA       ARG  45   1.481  -5.696   5.972
  326   1HB   ARG  45          HB2       ARG  45   3.485  -6.960   6.027
  327   2HB   ARG  45          HB1       ARG  45   3.943  -6.297   7.583
  328   1HG   ARG  45          HG2       ARG  45   2.265  -7.557   8.691
  329   2HG   ARG  45          HG1       ARG  45   1.557  -8.063   7.152
  330   1HD   ARG  45          HD2       ARG  45   2.996  -9.775   8.288
  331   2HD   ARG  45          HD1       ARG  45   3.432  -9.400   6.623
  332    HE   ARG  45           HE       ARG  45   5.277  -8.146   7.425
  333   1HH1  ARG  45          HH11      ARG  45   3.614  -9.754  10.076
  334   2HH1  ARG  45          HH12      ARG  45   4.979 -10.240  10.934
  335   1HH2  ARG  45          HH21      ARG  45   7.310  -8.739   8.663
  336   2HH2  ARG  45          HH22      ARG  45   7.157  -9.584  10.129
  337    H    GLN  46           HN       GLN  46   2.923  -4.012   8.744
  338    HA   GLN  46           HA       GLN  46   0.901  -4.723  10.577
  339   1HB   GLN  46          HB2       GLN  46   2.783  -2.355  10.560
  340   2HB   GLN  46          HB1       GLN  46   1.694  -2.719  11.890
  341   1HG   GLN  46          HG2       GLN  46   2.799  -4.821  12.283
  342   2HG   GLN  46          HG1       GLN  46   3.818  -4.585  10.866
  343   1HE2  GLN  46          HE21      GLN  46   5.452  -3.119  10.955
  344   2HE2  GLN  46          HE22      GLN  46   6.112  -2.500  12.427
  345    H    ILE  47           HN       ILE  47   1.190  -2.010   8.351
  346    HA   ILE  47           HA       ILE  47  -1.048  -0.529   9.239
  347    HB   ILE  47           HB       ILE  47   0.177  -0.725   6.478
  348   1HG1  ILE  47          HG12      ILE  47   0.609   1.342   8.642
  349   2HG1  ILE  47          HG11      ILE  47   1.725   0.040   8.240
  350   1HG2  ILE  47          HG21      ILE  47  -0.872   1.461   6.013
  351   2HG2  ILE  47          HG22      ILE  47  -1.686   1.390   7.576
  352   3HG2  ILE  47          HG23      ILE  47  -2.073   0.205   6.326
  353   1HD1  ILE  47          HD11      ILE  47   2.443   2.151   7.276
  354   2HD1  ILE  47          HD12      ILE  47   0.908   2.291   6.417
  355   3HD1  ILE  47          HD13      ILE  47   2.029   0.987   6.015
  356    H    LEU  48           HN       LEU  48  -0.669  -3.162   7.059
  357    HA   LEU  48           HA       LEU  48  -3.405  -3.078   6.109
  358   1HB   LEU  48          HB2       LEU  48  -1.209  -5.075   5.657
  359   2HB   LEU  48          HB1       LEU  48  -2.766  -5.114   4.862
  360    HG   LEU  48           HG       LEU  48  -0.752  -2.887   4.606
  361   1HD1  LEU  48          HD11      LEU  48  -1.506  -5.089   2.701
  362   2HD1  LEU  48          HD12      LEU  48   0.033  -4.926   3.552
  363   3HD1  LEU  48          HD13      LEU  48  -0.432  -3.739   2.337
  364   1HD2  LEU  48          HD21      LEU  48  -2.204  -2.102   2.802
  365   2HD2  LEU  48          HD22      LEU  48  -3.048  -2.117   4.349
  366   3HD2  LEU  48          HD23      LEU  48  -3.357  -3.386   3.161
  367    H    GLU  49           HN       GLU  49  -1.502  -5.325   8.084
  368    HA   GLU  49           HA       GLU  49  -3.731  -7.038   8.523
  369   1HB   GLU  49          HB2       GLU  49  -1.417  -7.862   8.341
  370   2HB   GLU  49          HB1       GLU  49  -0.980  -6.993   9.790
  371   1HG   GLU  49          HG2       GLU  49  -3.050  -9.172   9.810
  372   2HG   GLU  49          HG1       GLU  49  -1.333  -9.519   9.931
  373    H    ARG  50           HN       ARG  50  -2.053  -4.602  10.514
  374    HA   ARG  50           HA       ARG  50  -3.591  -5.323  12.814
  375   1HB   ARG  50          HB2       ARG  50  -1.244  -4.524  12.985
  376   2HB   ARG  50          HB1       ARG  50  -1.745  -2.953  12.394
  377   1HG   ARG  50          HG2       ARG  50  -2.954  -2.510  14.392
  378   2HG   ARG  50          HG1       ARG  50  -2.752  -4.174  14.951
  379   1HD   ARG  50          HD2       ARG  50  -1.208  -2.693  16.114
  380   2HD   ARG  50          HD1       ARG  50  -0.333  -3.827  15.098
  381    HE   ARG  50           HE       ARG  50  -0.765  -1.392  13.709
  382   1HH1  ARG  50          HH11      ARG  50   1.289  -2.774  16.274
  383   2HH1  ARG  50          HH12      ARG  50   2.514  -1.605  16.089
  384   1HH2  ARG  50          HH21      ARG  50   0.967   0.200  13.480
  385   2HH2  ARG  50          HH22      ARG  50   2.342   0.094  14.472
  386    H    GLU  51           HN       GLU  51  -4.215  -3.430  10.152
  387    HA   GLU  51           HA       GLU  51  -6.366  -2.011  11.557
  388   1HB   GLU  51          HB2       GLU  51  -4.960  -1.428   8.985
  389   2HB   GLU  51          HB1       GLU  51  -6.583  -0.813   9.249
  390   1HG   GLU  51          HG2       GLU  51  -4.254  -0.294  11.077
  391   2HG   GLU  51          HG1       GLU  51  -4.786   0.795   9.792
  392    H    HIS  52           HN       HIS  52  -5.923  -3.842   8.476
  393    HA   HIS  52           HA       HIS  52  -8.819  -4.359   8.625
  394   1HB   HIS  52          HB2       HIS  52  -7.137  -3.646   6.264
  395   2HB   HIS  52          HB1       HIS  52  -8.610  -4.572   6.028
  396    HD1  HIS  52           HD1      HIS  52 -10.797  -3.260   6.106
  397    HD2  HIS  52           HD2      HIS  52  -7.530  -1.005   7.313
  398    HE1  HIS  52           HE1      HIS  52 -11.619  -0.905   6.247
  399    HE2  HIS  52           HE2      HIS  52  -9.753   0.319   7.337
  400    H    ASP  53           HN       ASP  53  -6.264  -5.964   9.326
  401    HA   ASP  53           HA       ASP  53  -5.711  -8.126   9.522
  402   1HB   ASP  53          HB2       ASP  53  -8.501  -8.598   8.480
  403   2HB   ASP  53          HB1       ASP  53  -7.419  -9.912   8.898
  404    H    LEU  54           HN       LEU  54  -5.332  -6.685   6.868
  405    HA   LEU  54           HA       LEU  54  -5.179  -8.934   5.066
  406   1HB   LEU  54          HB2       LEU  54  -4.506  -6.051   4.803
  407   2HB   LEU  54          HB1       LEU  54  -3.690  -7.168   3.731
  408    HG   LEU  54           HG       LEU  54  -5.950  -7.931   2.970
  409   1HD1  LEU  54          HD11      LEU  54  -6.884  -5.512   4.499
  410   2HD1  LEU  54          HD12      LEU  54  -7.290  -7.189   4.856
  411   3HD1  LEU  54          HD13      LEU  54  -7.854  -6.440   3.356
  412   1HD2  LEU  54          HD21      LEU  54  -4.609  -6.420   1.653
  413   2HD2  LEU  54          HD22      LEU  54  -5.229  -5.041   2.557
  414   3HD2  LEU  54          HD23      LEU  54  -6.315  -5.985   1.533
  415    H    VAL  55           HN       VAL  55  -3.837 -10.432   5.568
  416    HA   VAL  55           HA       VAL  55  -1.292  -9.747   6.763
  417    HB   VAL  55           HB       VAL  55  -2.349 -12.510   6.118
  418   1HG1  VAL  55          HG11      VAL  55   0.052 -12.436   6.466
  419   2HG1  VAL  55          HG12      VAL  55  -0.740 -13.266   7.806
  420   3HG1  VAL  55          HG13      VAL  55  -0.177 -11.606   8.007
  421   1HG2  VAL  55          HG21      VAL  55  -2.579 -10.983   8.711
  422   2HG2  VAL  55          HG22      VAL  55  -3.024 -12.672   8.476
  423   3HG2  VAL  55          HG23      VAL  55  -3.905 -11.399   7.627
  424    H    LEU  56           HN       LEU  56  -0.357  -8.749   5.018
  425    HA   LEU  56           HA       LEU  56   0.367 -10.563   2.837
  426   1HB   LEU  56          HB2       LEU  56   0.658  -7.563   2.891
  427   2HB   LEU  56          HB1       LEU  56   0.967  -8.609   1.529
  428    HG   LEU  56           HG       LEU  56  -1.733  -7.965   2.722
  429   1HD1  LEU  56          HD11      LEU  56  -2.192  -7.003   0.523
  430   2HD1  LEU  56          HD12      LEU  56  -0.543  -7.376   0.026
  431   3HD1  LEU  56          HD13      LEU  56  -0.830  -6.214   1.320
  432   1HD2  LEU  56          HD21      LEU  56  -2.711  -9.355   0.987
  433   2HD2  LEU  56          HD22      LEU  56  -1.663 -10.323   2.025
  434   3HD2  LEU  56          HD23      LEU  56  -1.106  -9.832   0.422
  435    HA   PRO  57           HA       PRO  57   4.099 -10.524   5.299
  436   1HB   PRO  57          HB2       PRO  57   4.740 -12.898   3.757
  437   2HB   PRO  57          HB1       PRO  57   4.424 -12.759   5.491
  438   1HG   PRO  57          HG2       PRO  57   2.717 -14.003   3.809
  439   2HG   PRO  57          HG1       PRO  57   2.148 -13.090   5.220
  440   1HD   PRO  57          HD2       PRO  57   2.304 -12.261   2.353
  441   2HD   PRO  57          HD1       PRO  57   0.962 -12.070   3.511
  442    H    ILE  58           HN       ILE  58   6.413 -10.773   4.731
  443    HA   ILE  58           HA       ILE  58   7.017  -8.826   2.817
  444    HB   ILE  58           HB       ILE  58   8.763 -10.558   4.536
  445   1HG1  ILE  58          HG12      ILE  58   9.574  -8.242   5.249
  446   2HG1  ILE  58          HG11      ILE  58   8.312  -7.656   4.158
  447   1HG2  ILE  58          HG21      ILE  58  10.801  -9.520   3.672
  448   2HG2  ILE  58          HG22      ILE  58   9.858  -8.755   2.389
  449   3HG2  ILE  58          HG23      ILE  58  10.002 -10.509   2.446
  450   1HD1  ILE  58          HD11      ILE  58   7.827  -9.349   6.593
  451   2HD1  ILE  58          HD12      ILE  58   6.607  -8.662   5.524
  452   3HD1  ILE  58          HD13      ILE  58   7.618  -7.599   6.508
  453    H    ARG  59           HN       ARG  59   7.427 -12.292   2.593
  454    HA   ARG  59           HA       ARG  59   8.672 -12.347   0.109
  455   1HB   ARG  59          HB2       ARG  59   7.944 -14.643  -0.210
  456   2HB   ARG  59          HB1       ARG  59   8.441 -14.395   1.451
  457   1HG   ARG  59          HG2       ARG  59   5.549 -14.348   0.612
  458   2HG   ARG  59          HG1       ARG  59   6.393 -15.835   1.036
  459   1HD   ARG  59          HD2       ARG  59   6.138 -13.427   2.816
  460   2HD   ARG  59          HD1       ARG  59   5.088 -14.847   2.915
  461    HE   ARG  59           HE       ARG  59   8.009 -14.908   3.368
  462   1HH1  ARG  59          HH11      ARG  59   4.749 -16.037   4.263
  463   2HH1  ARG  59          HH12      ARG  59   5.276 -16.938   5.582
  464   1HH2  ARG  59          HH21      ARG  59   8.734 -16.106   5.131
  465   2HH2  ARG  59          HH22      ARG  59   7.675 -17.010   6.105
  466    H    GLU  60           HN       GLU  60   5.437 -11.461   0.761
  467    HA   GLU  60           HA       GLU  60   4.590 -11.754  -2.034
  468   1HB   GLU  60          HB2       GLU  60   3.157 -10.698   0.416
  469   2HB   GLU  60          HB1       GLU  60   2.436 -10.892  -1.173
  470   1HG   GLU  60          HG2       GLU  60   3.537 -13.157   0.469
  471   2HG   GLU  60          HG1       GLU  60   1.848 -12.647   0.473
  472    H    VAL  61           HN       VAL  61   5.039  -9.320   0.484
  473    HA   VAL  61           HA       VAL  61   4.348  -7.086  -1.047
  474    HB   VAL  61           HB       VAL  61   6.123  -7.194   1.423
  475   1HG1  VAL  61          HG11      VAL  61   5.470  -4.866   1.788
  476   2HG1  VAL  61          HG12      VAL  61   4.584  -4.873   0.263
  477   3HG1  VAL  61          HG13      VAL  61   6.339  -5.049   0.264
  478   1HG2  VAL  61          HG21      VAL  61   3.156  -6.760   1.155
  479   2HG2  VAL  61          HG22      VAL  61   4.080  -6.636   2.653
  480   3HG2  VAL  61          HG23      VAL  61   3.950  -8.186   1.820
  481    H    ARG  62           HN       ARG  62   7.320  -8.830  -0.830
  482    HA   ARG  62           HA       ARG  62   9.098  -6.934  -1.784
  483   1HB   ARG  62          HB2       ARG  62   9.094  -9.895  -1.873
  484   2HB   ARG  62          HB1       ARG  62  10.298  -9.026  -2.809
  485   1HG   ARG  62          HG2       ARG  62  10.996  -7.867  -0.772
  486   2HG   ARG  62          HG1       ARG  62   9.833  -8.824   0.149
  487   1HD   ARG  62          HD2       ARG  62  10.943 -10.871  -0.428
  488   2HD   ARG  62          HD1       ARG  62  12.033 -10.025  -1.525
  489    HE   ARG  62           HE       ARG  62  12.662  -8.804   0.685
  490   1HH1  ARG  62          HH11      ARG  62  11.986 -12.308   0.339
  491   2HH1  ARG  62          HH12      ARG  62  13.061 -12.752   1.558
  492   1HH2  ARG  62          HH21      ARG  62  14.149  -9.451   2.302
  493   2HH2  ARG  62          HH22      ARG  62  14.380 -11.096   2.699
  494    H    GLN  63           HN       GLN  63   6.643  -8.616  -3.572
  495    HA   GLN  63           HA       GLN  63   7.955  -7.861  -6.069
  496   1HB   GLN  63          HB2       GLN  63   5.582  -9.682  -5.640
  497   2HB   GLN  63          HB1       GLN  63   6.161  -9.189  -7.218
  498   1HG   GLN  63          HG2       GLN  63   7.079 -11.302  -6.915
  499   2HG   GLN  63          HG1       GLN  63   8.388 -10.201  -6.508
  500   1HE2  GLN  63          HE21      GLN  63   5.673 -10.933  -4.448
  501   2HE2  GLN  63          HE22      GLN  63   6.609 -11.743  -3.237
  502    H    LEU  64           HN       LEU  64   5.983  -6.494  -3.952
  503    HA   LEU  64           HA       LEU  64   4.071  -5.403  -5.776
  504   1HB   LEU  64          HB2       LEU  64   4.890  -4.418  -3.036
  505   2HB   LEU  64          HB1       LEU  64   3.518  -3.823  -3.951
  506    HG   LEU  64           HG       LEU  64   3.834  -6.599  -2.800
  507   1HD1  LEU  64          HD11      LEU  64   1.965  -5.973  -1.372
  508   2HD1  LEU  64          HD12      LEU  64   1.979  -4.351  -2.068
  509   3HD1  LEU  64          HD13      LEU  64   3.357  -4.917  -1.127
  510   1HD2  LEU  64          HD21      LEU  64   2.616  -6.693  -4.912
  511   2HD2  LEU  64          HD22      LEU  64   1.539  -5.412  -4.359
  512   3HD2  LEU  64          HD23      LEU  64   1.531  -6.980  -3.552
  513    H    THR  65           HN       THR  65   4.259  -3.633  -7.030
  514    HA   THR  65           HA       THR  65   6.906  -2.515  -7.204
  515    HB   THR  65           HB       THR  65   6.018  -1.821  -9.465
  516    HG1  THR  65           HG1      THR  65   4.028  -2.776 -10.068
  517   1HG2  THR  65          HG21      THR  65   5.876  -4.678  -8.668
  518   2HG2  THR  65          HG22      THR  65   7.370  -3.795  -9.046
  519   3HG2  THR  65          HG23      THR  65   6.149  -4.097 -10.319
  520    H    LEU  66           HN       LEU  66   6.719  -1.049  -5.537
  521    HA   LEU  66           HA       LEU  66   6.115   0.817  -4.355
  522   1HB   LEU  66          HB2       LEU  66   7.767   1.360  -6.267
  523   2HB   LEU  66          HB1       LEU  66   6.429   2.198  -7.011
  524    HG   LEU  66           HG       LEU  66   7.956   3.725  -5.828
  525   1HD1  LEU  66          HD11      LEU  66   6.333   4.968  -4.502
  526   2HD1  LEU  66          HD12      LEU  66   5.257   3.569  -4.514
  527   3HD1  LEU  66          HD13      LEU  66   5.640   4.402  -6.022
  528   1HD2  LEU  66          HD21      LEU  66   8.732   2.223  -4.091
  529   2HD2  LEU  66          HD22      LEU  66   7.132   2.227  -3.348
  530   3HD2  LEU  66          HD23      LEU  66   8.090   3.707  -3.387
  531    H    ARG  67           HN       ARG  67   4.525   1.763  -7.389
  532    HA   ARG  67           HA       ARG  67   2.359   2.961  -5.974
  533   1HB   ARG  67          HB2       ARG  67   3.083   2.658  -8.822
  534   2HB   ARG  67          HB1       ARG  67   1.410   3.053  -8.434
  535   1HG   ARG  67          HG2       ARG  67   3.832   4.625  -7.551
  536   2HG   ARG  67          HG1       ARG  67   2.721   5.077  -8.852
  537   1HD   ARG  67          HD2       ARG  67   0.861   5.022  -7.184
  538   2HD   ARG  67          HD1       ARG  67   2.057   4.732  -5.948
  539    HE   ARG  67           HE       ARG  67   2.878   6.907  -6.176
  540   1HH1  ARG  67          HH11      ARG  67   0.181   6.388  -8.429
  541   2HH1  ARG  67          HH12      ARG  67  -0.318   8.015  -8.419
  542   1HH2  ARG  67          HH21      ARG  67   2.138   9.164  -6.127
  543   2HH2  ARG  67          HH22      ARG  67   0.777   9.594  -7.060
  544    H    LYS  68           HN       LYS  68   2.912  -0.210  -6.899
  545    HA   LYS  68           HA       LYS  68   0.164  -0.987  -7.155
  546   1HB   LYS  68          HB2       LYS  68   2.070  -2.366  -8.042
  547   2HB   LYS  68          HB1       LYS  68   2.551  -2.658  -6.374
  548   1HG   LYS  68          HG2       LYS  68   0.644  -3.954  -5.933
  549   2HG   LYS  68          HG1       LYS  68  -0.110  -3.496  -7.463
  550   1HD   LYS  68          HD2       LYS  68   1.573  -4.700  -8.703
  551   2HD   LYS  68          HD1       LYS  68   2.470  -5.030  -7.217
  552   1HE   LYS  68          HE2       LYS  68   0.726  -6.422  -6.387
  553   2HE   LYS  68          HE1       LYS  68  -0.350  -5.952  -7.698
  554   1HZ   LYS  68          HZ1       LYS  68   0.837  -7.162  -9.217
  555   2HZ   LYS  68          HZ2       LYS  68   0.824  -8.193  -7.844
  556   3HZ   LYS  68          HZ3       LYS  68   2.215  -7.313  -8.257
  557    H    LEU  69           HN       LEU  69   2.275  -0.280  -4.633
  558    HA   LEU  69           HA       LEU  69   1.081  -1.587  -2.444
  559   1HB   LEU  69          HB2       LEU  69   2.624   0.975  -2.598
  560   2HB   LEU  69          HB1       LEU  69   1.844   0.524  -1.099
  561    HG   LEU  69           HG       LEU  69   4.228  -0.050  -1.125
  562   1HD1  LEU  69          HD11      LEU  69   2.731  -1.360   0.243
  563   2HD1  LEU  69          HD12      LEU  69   4.025  -2.369  -0.409
  564   3HD1  LEU  69          HD13      LEU  69   2.411  -2.444  -1.111
  565   1HD2  LEU  69          HD21      LEU  69   5.054  -1.862  -2.546
  566   2HD2  LEU  69          HD22      LEU  69   4.503  -0.495  -3.509
  567   3HD2  LEU  69          HD23      LEU  69   3.491  -1.931  -3.360
  568    H    GLN  70           HN       GLN  70   0.218   1.566  -3.807
  569    HA   GLN  70           HA       GLN  70  -1.915   1.991  -1.934
  570   1HB   GLN  70          HB2       GLN  70  -2.578   3.886  -3.364
  571   2HB   GLN  70          HB1       GLN  70  -0.872   3.925  -2.937
  572   1HG   GLN  70          HG2       GLN  70  -0.184   3.364  -5.030
  573   2HG   GLN  70          HG1       GLN  70  -1.756   2.710  -5.528
  574   1HE2  GLN  70          HE21      GLN  70  -1.963   3.936  -7.301
  575   2HE2  GLN  70          HE22      GLN  70  -2.169   5.648  -7.297
  576    H    GLU  71           HN       GLU  71  -1.624   0.051  -4.606
  577    HA   GLU  71           HA       GLU  71  -4.409   0.133  -5.389
  578   1HB   GLU  71          HB2       GLU  71  -2.476  -0.285  -6.971
  579   2HB   GLU  71          HB1       GLU  71  -2.222  -1.822  -6.162
  580   1HG   GLU  71          HG2       GLU  71  -3.438  -2.054  -8.267
  581   2HG   GLU  71          HG1       GLU  71  -4.388  -2.588  -6.878
  582    H    MET  72           HN       MET  72  -2.336  -1.405  -3.178
  583    HA   MET  72           HA       MET  72  -4.345  -3.443  -2.483
  584   1HB   MET  72          HB2       MET  72  -1.367  -3.461  -1.927
  585   2HB   MET  72          HB1       MET  72  -2.507  -4.730  -1.525
  586   1HG   MET  72          HG2       MET  72  -1.654  -3.890  -4.300
  587   2HG   MET  72          HG1       MET  72  -1.184  -5.338  -3.436
  588   1HE   MET  72          HE1       MET  72  -4.544  -7.362  -3.239
  589   2HE   MET  72          HE2       MET  72  -3.895  -6.252  -2.032
  590   3HE   MET  72          HE3       MET  72  -2.821  -7.371  -2.869
  591    H    SER  73           HN       SER  73  -3.700  -0.446  -1.621
  592    HA   SER  73           HA       SER  73  -2.742  -0.768   1.002
  593   1HB   SER  73          HB2       SER  73  -3.100   1.708   1.191
  594   2HB   SER  73          HB1       SER  73  -2.074   1.186  -0.142
  595    HG   SER  73           HG       SER  73  -3.568   2.749  -0.790
  596    H    SER  74           HN       SER  74  -5.788  -1.011  -0.370
  597    HA   SER  74           HA       SER  74  -7.904  -1.160   0.330
  598   1HB   SER  74          HB2       SER  74  -6.607  -1.697   3.005
  599   2HB   SER  74          HB1       SER  74  -8.299  -2.016   2.614
  600    HG   SER  74           HG       SER  74  -6.138  -3.067   1.134
  601    H    LYS  75           HN       LYS  75  -8.618   0.915  -0.070
  602    HA   LYS  75           HA       LYS  75  -9.192   2.362   2.367
  603   1HB   LYS  75          HB2       LYS  75  -7.017   3.220   1.170
  604   2HB   LYS  75          HB1       LYS  75  -8.162   3.991   0.080
  605   1HG   LYS  75          HG2       LYS  75  -7.514   5.547   1.787
  606   2HG   LYS  75          HG1       LYS  75  -9.206   5.108   2.008
  607   1HD   LYS  75          HD2       LYS  75  -8.248   5.085   4.188
  608   2HD   LYS  75          HD1       LYS  75  -8.424   3.401   3.714
  609   1HE   LYS  75          HE2       LYS  75  -5.840   5.006   3.615
  610   2HE   LYS  75          HE1       LYS  75  -6.269   3.873   4.878
  611   1HZ   LYS  75          HZ1       LYS  75  -4.766   2.849   3.408
  612   2HZ   LYS  75          HZ2       LYS  75  -5.622   3.321   2.058
  613   3HZ   LYS  75          HZ3       LYS  75  -6.266   2.111   3.086
  614    H    ALA  76           HN       ALA  76 -11.269   1.777   2.065
  615    HA   ALA  76           HA       ALA  76 -12.639   3.104  -0.159
  616   1HB   ALA  76          HB1       ALA  76 -14.259   1.266  -0.159
  617   2HB   ALA  76          HB2       ALA  76 -13.320   0.438   1.084
  618   3HB   ALA  76          HB3       ALA  76 -12.633   0.689  -0.520
  619    H    GLY  77           HN       GLY  77 -14.170   4.442   0.474
  620   1HA   GLY  77          HA2       GLY  77 -14.848   4.492   3.337
  621   2HA   GLY  77          HA1       GLY  77 -14.980   5.856   2.229
  622    H    SER  78           HN       SER  78 -16.020   3.730   0.270
  623    HA   SER  78           HA       SER  78 -17.976   2.982  -0.533
  624   1HB   SER  78          HB2       SER  78 -18.005   1.634   1.600
  625   2HB   SER  78          HB1       SER  78 -18.889   2.940   2.383
  626    HG   SER  78           HG       SER  78 -20.053   1.022   1.411
  627    H    ASP  79           HN       ASP  79 -17.367   5.676  -0.415
  628    HA   ASP  79           HA       ASP  79 -19.749   7.159   0.272
  629   1HB   ASP  79          HB2       ASP  79 -17.223   8.115  -1.128
  630   2HB   ASP  79          HB1       ASP  79 -18.505   9.139  -0.491
  631    H    THR  80           HN       THR  80 -21.314   6.475  -1.033
  632    HA   THR  80           HA       THR  80 -20.893   6.783  -3.930
  633    HB   THR  80           HB       THR  80 -22.876   4.929  -2.557
  634    HG1  THR  80           HG1      THR  80 -21.277   3.637  -2.390
  635   1HG2  THR  80          HG21      THR  80 -22.011   5.124  -5.458
  636   2HG2  THR  80          HG22      THR  80 -23.570   5.649  -4.820
  637   3HG2  THR  80          HG23      THR  80 -23.138   3.941  -4.795
  638    H    GLU  81           HN       GLU  81 -22.875   7.606  -1.181
  639    HA   GLU  81           HA       GLU  81 -24.659   9.156  -2.953
  640   1HB   GLU  81          HB2       GLU  81 -25.239   7.981  -0.239
  641   2HB   GLU  81          HB1       GLU  81 -26.335   8.984  -1.173
  642   1HG   GLU  81          HG2       GLU  81 -26.522   7.322  -2.865
  643   2HG   GLU  81          HG1       GLU  81 -25.271   6.339  -2.099
  644    H    LEU  82           HN       LEU  82 -22.948   9.038   0.123
  645    HA   LEU  82           HA       LEU  82 -23.330  11.925   0.400
  646   1HB   LEU  82          HB2       LEU  82 -22.622   9.820   2.458
  647   2HB   LEU  82          HB1       LEU  82 -22.574  11.536   2.771
  648    HG   LEU  82           HG       LEU  82 -25.076  11.560   2.277
  649   1HD1  LEU  82          HD11      LEU  82 -24.776   8.583   2.604
  650   2HD1  LEU  82          HD12      LEU  82 -25.263   9.425   1.135
  651   3HD1  LEU  82          HD13      LEU  82 -26.296   9.478   2.560
  652   1HD2  LEU  82          HD21      LEU  82 -24.070   9.999   4.647
  653   2HD2  LEU  82          HD22      LEU  82 -25.646  10.785   4.525
  654   3HD2  LEU  82          HD23      LEU  82 -24.170  11.753   4.515
  655    H    ALA  83           HN       ALA  83 -21.630  13.184   0.089
  656    HA   ALA  83           HA       ALA  83 -19.544  13.934  -0.336
  657   1HB   ALA  83          HB1       ALA  83 -17.732  13.122   1.092
  658   2HB   ALA  83          HB2       ALA  83 -18.698  11.721   1.545
  659   3HB   ALA  83          HB3       ALA  83 -19.207  13.334   2.035
  660    H    ALA  84           HN       ALA  84 -20.653  12.024  -2.101
  661    HA   ALA  84           HA       ALA  84 -18.614  10.116  -2.808
  662   1HB   ALA  84          HB1       ALA  84 -20.977   9.558  -3.030
  663   2HB   ALA  84          HB2       ALA  84 -20.150   9.495  -4.588
  664   3HB   ALA  84          HB3       ALA  84 -21.178  10.869  -4.193
  665    HA   PRO  85           HA       PRO  85 -16.593  12.800  -5.758
  666   1HB   PRO  85          HB2       PRO  85 -15.729  10.342  -7.143
  667   2HB   PRO  85          HB1       PRO  85 -14.734  11.567  -6.352
  668   1HG   PRO  85          HG2       PRO  85 -15.052   9.100  -5.310
  669   2HG   PRO  85          HG1       PRO  85 -14.867  10.539  -4.289
  670   1HD   PRO  85          HD2       PRO  85 -17.351   9.019  -5.005
  671   2HD   PRO  85          HD1       PRO  85 -16.875   9.724  -3.446
  672    H    LYS  86           HN       LYS  86 -18.732  10.455  -6.341
  673    HA   LYS  86           HA       LYS  86 -19.236  11.012  -9.174
  674   1HB   LYS  86          HB2       LYS  86 -20.528   8.974  -7.319
  675   2HB   LYS  86          HB1       LYS  86 -21.002   9.192  -8.991
  676   1HG   LYS  86          HG2       LYS  86 -19.599   7.273  -8.906
  677   2HG   LYS  86          HG1       LYS  86 -18.644   8.558  -9.639
  678   1HD   LYS  86          HD2       LYS  86 -17.561   8.954  -7.449
  679   2HD   LYS  86          HD1       LYS  86 -18.493   7.622  -6.767
  680   1HE   LYS  86          HE2       LYS  86 -16.476   7.415  -9.006
  681   2HE   LYS  86          HE1       LYS  86 -16.201   6.948  -7.327
  682   1HZ   LYS  86          HZ1       LYS  86 -18.078   5.314  -7.640
  683   2HZ   LYS  86          HZ2       LYS  86 -16.672   5.005  -8.490
  684   3HZ   LYS  86          HZ3       LYS  86 -17.989   5.626  -9.313
  685    H    SER  87           HN       SER  87 -19.620  13.134  -7.581
  686    HA   SER  87           HA       SER  87 -22.219  13.965  -8.304
  687   1HB   SER  87          HB2       SER  87 -22.707  12.864  -6.066
  688   2HB   SER  87          HB1       SER  87 -21.544  13.962  -5.326
  689    HG   SER  87           HG       SER  87 -22.858  15.687  -5.788
  690    H    LYS  88           HN       LYS  88 -21.394  15.660  -9.366
  691    HA   LYS  88           HA       LYS  88 -19.392  17.288  -7.956
  692   1HB   LYS  88          HB2       LYS  88 -19.768  16.863 -10.926
  693   2HB   LYS  88          HB1       LYS  88 -18.609  17.970 -10.203
  694   1HG   LYS  88          HG2       LYS  88 -17.428  16.150  -9.167
  695   2HG   LYS  88          HG1       LYS  88 -18.651  15.002  -9.712
  696   1HD   LYS  88          HD2       LYS  88 -18.052  15.444 -12.028
  697   2HD   LYS  88          HD1       LYS  88 -16.873  16.646 -11.503
  698   1HE   LYS  88          HE2       LYS  88 -15.806  14.500 -12.047
  699   2HE   LYS  88          HE1       LYS  88 -15.592  14.944 -10.357
  700   1HZ   LYS  88          HZ1       LYS  88 -16.165  12.576 -10.728
  701   2HZ   LYS  88          HZ2       LYS  88 -17.711  13.040 -11.258
  702   3HZ   LYS  88          HZ3       LYS  88 -17.210  13.360  -9.697
  703    H    ASN  89           HN       ASN  89 -22.523  17.243  -8.563
  704    HA   ASN  89           HA       ASN  89 -22.724  20.147  -8.600
  705   1HB   ASN  89          HB2       ASN  89 -24.435  18.316 -10.326
  706   2HB   ASN  89          HB1       ASN  89 -24.662  20.046 -10.141
  707   1HD2  ASN  89          HD21      ASN  89 -23.279  21.441 -11.203
  708   2HD2  ASN  89          HD22      ASN  89 -22.211  20.903 -12.454
  Start of MODEL   23
    1   1H    GLY   1          HT1       GLY   1 -14.286   9.063   8.112
    2   2H    GLY   1          HT2       GLY   1 -15.276   8.810   9.432
    3   3H    GLY   1          HT3       GLY   1 -15.149   7.607   8.269
    4   1HA   GLY   1          HA1       GLY   1 -13.825   7.017  10.185
    5   2HA   GLY   1          HA2       GLY   1 -12.755   7.404   8.836
    6    H    ASP   2           HN       ASP   2 -14.091   8.485  11.844
    7    HA   ASP   2           HA       ASP   2 -12.445  10.890  11.782
    8   1HB   ASP   2          HB2       ASP   2 -13.697  11.688  13.639
    9   2HB   ASP   2          HB1       ASP   2 -14.875  10.949  12.566
   10    H    GLY   3           HN       GLY   3 -10.994  11.335  13.412
   11   1HA   GLY   3          HA2       GLY   3  -9.522  10.851  15.139
   12   2HA   GLY   3          HA1       GLY   3 -10.248   9.253  15.281
   13    H    GLU   4           HN       GLU   4  -9.395   7.618  14.289
   14    HA   GLU   4           HA       GLU   4  -6.766   7.916  13.154
   15   1HB   GLU   4          HB2       GLU   4  -8.464   5.509  13.690
   16   2HB   GLU   4          HB1       GLU   4  -6.881   5.434  12.949
   17   1HG   GLU   4          HG2       GLU   4  -5.934   6.434  14.992
   18   2HG   GLU   4          HG1       GLU   4  -7.544   6.371  15.720
   19    H    ALA   5           HN       ALA   5  -6.250   7.836  11.131
   20    HA   ALA   5           HA       ALA   5  -8.230   7.013   9.143
   21   1HB   ALA   5          HB1       ALA   5  -6.672   8.083   7.525
   22   2HB   ALA   5          HB2       ALA   5  -5.615   8.521   8.868
   23   3HB   ALA   5          HB3       ALA   5  -7.228   9.221   8.755
   24    H    GLN   6           HN       GLN   6  -7.185   5.638   7.354
   25    HA   GLN   6           HA       GLN   6  -6.012   3.380   8.619
   26   1HB   GLN   6          HB2       GLN   6  -7.483   3.075   6.732
   27   2HB   GLN   6          HB1       GLN   6  -6.423   4.031   5.705
   28   1HG   GLN   6          HG2       GLN   6  -4.648   2.317   6.061
   29   2HG   GLN   6          HG1       GLN   6  -5.845   1.332   6.899
   30   1HE2  GLN   6          HE21      GLN   6  -5.623  -0.281   5.364
   31   2HE2  GLN   6          HE22      GLN   6  -6.239  -0.129   3.759
   32    H    ARG   7           HN       ARG   7  -4.790   6.127   6.857
   33    HA   ARG   7           HA       ARG   7  -2.775   6.921   6.441
   34   1HB   ARG   7          HB2       ARG   7  -1.672   5.981   8.371
   35   2HB   ARG   7          HB1       ARG   7  -1.759   4.364   7.711
   36   1HG   ARG   7          HG2       ARG   7  -0.060   4.888   6.098
   37   2HG   ARG   7          HG1       ARG   7  -0.036   6.579   6.613
   38   1HD   ARG   7          HD2       ARG   7   0.675   5.934   8.837
   39   2HD   ARG   7          HD1       ARG   7   0.557   4.234   8.412
   40    HE   ARG   7           HE       ARG   7   2.503   4.419   7.158
   41   1HH1  ARG   7          HH11      ARG   7   1.699   7.579   8.487
   42   2HH1  ARG   7          HH12      ARG   7   3.315   8.079   8.677
   43   1HH2  ARG   7          HH21      ARG   7   4.707   5.067   7.407
   44   2HH2  ARG   7          HH22      ARG   7   5.081   6.615   8.036
   45    H    ASP   8           HN       ASP   8  -1.633   7.000   4.597
   46    HA   ASP   8           HA       ASP   8  -2.711   5.234   2.568
   47   1HB   ASP   8          HB2       ASP   8  -0.923   7.633   2.394
   48   2HB   ASP   8          HB1       ASP   8  -1.331   6.664   0.986
   49    H    LEU   9           HN       LEU   9  -1.585   3.829   1.370
   50    HA   LEU   9           HA       LEU   9   0.635   2.570   2.574
   51   1HB   LEU   9          HB2       LEU   9  -0.960   2.250   0.097
   52   2HB   LEU   9          HB1       LEU   9   0.608   1.491   0.112
   53    HG   LEU   9           HG       LEU   9  -1.303   0.003   0.712
   54   1HD1  LEU   9          HD11      LEU   9   0.940  -0.575   1.306
   55   2HD1  LEU   9          HD12      LEU   9  -0.164  -1.064   2.583
   56   3HD1  LEU   9          HD13      LEU   9   0.846   0.376   2.792
   57   1HD2  LEU   9          HD21      LEU   9  -2.236   0.160   2.985
   58   2HD2  LEU   9          HD22      LEU   9  -2.616   1.599   2.027
   59   3HD2  LEU   9          HD23      LEU   9  -1.332   1.659   3.230
   60    H    VAL  10           HN       VAL  10   0.297   4.811  -0.082
   61    HA   VAL  10           HA       VAL  10   3.059   4.597  -0.719
   62    HB   VAL  10           HB       VAL  10   0.881   6.406  -1.807
   63   1HG1  VAL  10          HG11      VAL  10   2.427   7.041  -3.589
   64   2HG1  VAL  10          HG12      VAL  10   3.732   6.159  -2.795
   65   3HG1  VAL  10          HG13      VAL  10   3.038   7.589  -2.026
   66   1HG2  VAL  10          HG21      VAL  10   0.691   4.067  -2.347
   67   2HG2  VAL  10          HG22      VAL  10   2.355   4.047  -2.933
   68   3HG2  VAL  10          HG23      VAL  10   1.131   4.996  -3.779
   69    H    LYS  11           HN       LYS  11   1.118   6.627   1.305
   70    HA   LYS  11           HA       LYS  11   3.291   8.513   1.662
   71   1HB   LYS  11          HB2       LYS  11   0.587   8.336   3.034
   72   2HB   LYS  11          HB1       LYS  11   1.852   9.455   3.484
   73   1HG   LYS  11          HG2       LYS  11   0.143  10.554   2.125
   74   2HG   LYS  11          HG1       LYS  11   1.710  10.574   1.331
   75   1HD   LYS  11          HD2       LYS  11   1.043   8.921  -0.225
   76   2HD   LYS  11          HD1       LYS  11  -0.403   8.514   0.697
   77   1HE   LYS  11          HE2       LYS  11   0.145  11.104  -0.733
   78   2HE   LYS  11          HE1       LYS  11  -0.946   9.832  -1.269
   79   1HZ   LYS  11          HZ1       LYS  11  -1.279  11.580   1.134
   80   2HZ   LYS  11          HZ2       LYS  11  -2.189  10.204   0.899
   81   3HZ   LYS  11          HZ3       LYS  11  -2.295  11.474  -0.208
   82    H    ALA  12           HN       ALA  12   2.889   5.520   2.519
   83    HA   ALA  12           HA       ALA  12   4.186   5.777   5.135
   84   1HB   ALA  12          HB1       ALA  12   3.606   3.404   5.448
   85   2HB   ALA  12          HB2       ALA  12   2.877   3.368   3.845
   86   3HB   ALA  12          HB3       ALA  12   2.166   4.361   5.110
   87    H    VAL  13           HN       VAL  13   4.256   3.574   2.354
   88    HA   VAL  13           HA       VAL  13   6.912   2.717   2.833
   89    HB   VAL  13           HB       VAL  13   5.208   2.387   0.351
   90   1HG1  VAL  13          HG11      VAL  13   6.646   0.471  -0.157
   91   2HG1  VAL  13          HG12      VAL  13   7.666   0.876   1.228
   92   3HG1  VAL  13          HG13      VAL  13   7.548   1.987  -0.139
   93   1HG2  VAL  13          HG21      VAL  13   4.133   1.472   2.328
   94   2HG2  VAL  13          HG22      VAL  13   5.593   0.561   2.718
   95   3HG2  VAL  13          HG23      VAL  13   4.678   0.181   1.259
   96    H    ALA  14           HN       ALA  14   5.546   4.682   0.177
   97    HA   ALA  14           HA       ALA  14   8.043   5.201  -1.016
   98   1HB   ALA  14          HB1       ALA  14   5.893   5.445  -2.229
   99   2HB   ALA  14          HB2       ALA  14   6.869   6.912  -2.351
  100   3HB   ALA  14          HB3       ALA  14   5.508   6.835  -1.226
  101    H    HIS  15           HN       HIS  15   6.362   6.673   1.577
  102    HA   HIS  15           HA       HIS  15   7.642   9.176   1.741
  103   1HB   HIS  15          HB2       HIS  15   5.592   8.508   2.990
  104   2HB   HIS  15          HB1       HIS  15   6.584   7.480   4.010
  105    HD1  HIS  15           HD1      HIS  15   5.344  10.874   3.619
  106    HD2  HIS  15           HD2      HIS  15   8.328   8.995   5.797
  107    HE1  HIS  15           HE1      HIS  15   5.985  12.504   5.431
  108    HE2  HIS  15           HE2      HIS  15   7.345  11.060   6.959
  109    H    ILE  16           HN       ILE  16   8.606   5.976   2.797
  110    HA   ILE  16           HA       ILE  16  10.754   6.881   4.442
  111    HB   ILE  16           HB       ILE  16  10.083   4.130   3.343
  112   1HG1  ILE  16          HG12      ILE  16   8.381   4.933   4.826
  113   2HG1  ILE  16          HG11      ILE  16   9.315   3.695   5.659
  114   1HG2  ILE  16          HG21      ILE  16  12.465   4.198   3.877
  115   2HG2  ILE  16          HG22      ILE  16  11.568   3.196   5.021
  116   3HG2  ILE  16          HG23      ILE  16  12.091   4.810   5.496
  117   1HD1  ILE  16          HD11      ILE  16   8.790   5.561   7.133
  118   2HD1  ILE  16          HD12      ILE  16   9.596   6.675   6.028
  119   3HD1  ILE  16          HD13      ILE  16  10.530   5.438   6.871
  120    H    LEU  17           HN       LEU  17  10.423   5.782   1.139
  121    HA   LEU  17           HA       LEU  17  13.231   5.928   0.571
  122   1HB   LEU  17          HB2       LEU  17  10.824   5.834  -1.241
  123   2HB   LEU  17          HB1       LEU  17  12.470   5.889  -1.842
  124    HG   LEU  17           HG       LEU  17  11.317   3.694  -0.125
  125   1HD1  LEU  17          HD11      LEU  17  11.433   2.339  -2.155
  126   2HD1  LEU  17          HD12      LEU  17  11.963   3.749  -3.072
  127   3HD1  LEU  17          HD13      LEU  17  10.345   3.709  -2.368
  128   1HD2  LEU  17          HD21      LEU  17  13.979   3.939  -1.528
  129   2HD2  LEU  17          HD22      LEU  17  13.395   2.513  -0.665
  130   3HD2  LEU  17          HD23      LEU  17  13.705   4.010   0.213
  131    H    GLY  18           HN       GLY  18  10.625   8.163   0.612
  132   1HA   GLY  18          HA2       GLY  18  11.053  10.512   0.830
  133   2HA   GLY  18          HA1       GLY  18  12.486  10.301  -0.174
  134    H    ILE  19           HN       ILE  19   9.601   8.700  -1.062
  135    HA   ILE  19           HA       ILE  19   9.232  10.642  -3.184
  136    HB   ILE  19           HB       ILE  19   8.228   8.588  -4.404
  137   1HG1  ILE  19          HG12      ILE  19  10.276   7.244  -2.638
  138   2HG1  ILE  19          HG11      ILE  19   8.541   6.958  -2.636
  139   1HG2  ILE  19          HG21      ILE  19  10.046   9.942  -5.276
  140   2HG2  ILE  19          HG22      ILE  19  10.405   8.233  -5.541
  141   3HG2  ILE  19          HG23      ILE  19  11.199   9.107  -4.232
  142   1HD1  ILE  19          HD11      ILE  19   9.721   5.176  -3.783
  143   2HD1  ILE  19          HD12      ILE  19  10.439   6.346  -4.892
  144   3HD1  ILE  19          HD13      ILE  19   8.698   6.066  -4.913
  145    H    ARG  20           HN       ARG  20   7.266  10.666  -4.143
  146    HA   ARG  20           HA       ARG  20   4.878   9.505  -3.290
  147   1HB   ARG  20          HB2       ARG  20   5.001  10.992  -1.321
  148   2HB   ARG  20          HB1       ARG  20   5.284  12.383  -2.368
  149   1HG   ARG  20          HG2       ARG  20   3.105  12.127  -3.349
  150   2HG   ARG  20          HG1       ARG  20   2.792  10.693  -2.385
  151   1HD   ARG  20          HD2       ARG  20   2.815  12.041  -0.364
  152   2HD   ARG  20          HD1       ARG  20   3.336  13.456  -1.281
  153    HE   ARG  20           HE       ARG  20   0.934  12.436  -2.334
  154   1HH1  ARG  20          HH11      ARG  20   2.060  14.142   0.591
  155   2HH1  ARG  20          HH12      ARG  20   0.669  15.128   0.695
  156   1HH2  ARG  20          HH21      ARG  20  -1.011  13.837  -2.102
  157   2HH2  ARG  20          HH22      ARG  20  -1.040  14.961  -0.808
  158    H    ASP  21           HN       ASP  21   6.743  11.907  -4.782
  159    HA   ASP  21           HA       ASP  21   5.082  12.990  -6.726
  160   1HB   ASP  21          HB2       ASP  21   7.927  12.256  -7.300
  161   2HB   ASP  21          HB1       ASP  21   7.079  13.752  -7.662
  162    H    LEU  22           HN       LEU  22   7.571  10.657  -7.514
  163    HA   LEU  22           HA       LEU  22   7.575   8.728  -8.686
  164   1HB   LEU  22          HB2       LEU  22   4.666   8.845  -8.040
  165   2HB   LEU  22          HB1       LEU  22   5.279   7.617  -9.122
  166    HG   LEU  22           HG       LEU  22   4.911   6.826  -6.937
  167   1HD1  LEU  22          HD11      LEU  22   7.842   6.996  -7.636
  168   2HD1  LEU  22          HD12      LEU  22   6.691   5.804  -8.223
  169   3HD1  LEU  22          HD13      LEU  22   7.165   5.811  -6.519
  170   1HD2  LEU  22          HD21      LEU  22   6.337   7.448  -5.019
  171   2HD2  LEU  22          HD22      LEU  22   5.257   8.726  -5.558
  172   3HD2  LEU  22          HD23      LEU  22   6.969   8.786  -5.975
  173    H    ALA  23           HN       ALA  23   6.990  11.455  -9.908
  174    HA   ALA  23           HA       ALA  23   5.583  10.754 -12.299
  175   1HB   ALA  23          HB1       ALA  23   5.431  13.039 -11.426
  176   2HB   ALA  23          HB2       ALA  23   6.079  13.025 -13.067
  177   3HB   ALA  23          HB3       ALA  23   7.161  13.254 -11.695
  178    H    GLY  24           HN       GLY  24   8.652  10.569 -11.154
  179   1HA   GLY  24          HA2       GLY  24   9.564   9.493 -13.695
  180   2HA   GLY  24          HA1       GLY  24  10.555  10.786 -12.994
  181    H    ILE  25           HN       ILE  25   8.895   7.888 -11.828
  182    HA   ILE  25           HA       ILE  25  11.418   6.942 -10.669
  183    HB   ILE  25           HB       ILE  25   8.715   6.836  -9.264
  184   1HG1  ILE  25          HG12      ILE  25   9.624   9.147  -9.245
  185   2HG1  ILE  25          HG11      ILE  25   9.544   8.442  -7.640
  186   1HG2  ILE  25          HG21      ILE  25   9.961   6.028  -7.317
  187   2HG2  ILE  25          HG22      ILE  25  11.439   6.021  -8.279
  188   3HG2  ILE  25          HG23      ILE  25  10.106   4.947  -8.703
  189   1HD1  ILE  25          HD11      ILE  25  12.018   8.725  -9.334
  190   2HD1  ILE  25          HD12      ILE  25  11.946   8.017  -7.717
  191   3HD1  ILE  25          HD13      ILE  25  11.572   9.725  -7.948
  192    H    ASN  26           HN       ASN  26  11.573   4.655 -10.730
  193    HA   ASN  26           HA       ASN  26  10.153   3.317 -12.787
  194   1HB   ASN  26          HB2       ASN  26  11.898   2.153 -10.595
  195   2HB   ASN  26          HB1       ASN  26  11.301   1.250 -11.975
  196   1HD2  ASN  26          HD21      ASN  26  13.998   1.551 -11.240
  197   2HD2  ASN  26          HD22      ASN  26  14.812   2.391 -12.495
  198    H    LEU  27           HN       LEU  27   8.217   2.303 -12.744
  199    HA   LEU  27           HA       LEU  27   7.191   1.494 -10.117
  200   1HB   LEU  27          HB2       LEU  27   5.647   2.658 -12.431
  201   2HB   LEU  27          HB1       LEU  27   4.903   1.941 -11.019
  202    HG   LEU  27           HG       LEU  27   6.622   4.420 -11.059
  203   1HD1  LEU  27          HD11      LEU  27   4.380   4.776 -11.985
  204   2HD1  LEU  27          HD12      LEU  27   4.555   5.573 -10.420
  205   3HD1  LEU  27          HD13      LEU  27   3.664   4.070 -10.536
  206   1HD2  LEU  27          HD21      LEU  27   6.976   3.183  -9.004
  207   2HD2  LEU  27          HD22      LEU  27   5.236   3.016  -8.782
  208   3HD2  LEU  27          HD23      LEU  27   5.985   4.608  -8.685
  209    H    ASP  28           HN       ASP  28   8.463   0.170 -12.738
  210    HA   ASP  28           HA       ASP  28   6.513  -2.036 -12.797
  211   1HB   ASP  28          HB2       ASP  28   8.844  -1.444 -14.647
  212   2HB   ASP  28          HB1       ASP  28   7.818  -2.866 -14.764
  213    H    SER  29           HN       SER  29   9.081  -1.042 -11.197
  214    HA   SER  29           HA       SER  29  10.519  -3.550 -11.086
  215   1HB   SER  29          HB2       SER  29  11.049  -0.905  -9.744
  216   2HB   SER  29          HB1       SER  29  12.140  -2.291  -9.796
  217    HG   SER  29           HG       SER  29  12.745  -0.912 -11.379
  218    H    SER  30           HN       SER  30  10.490  -4.882  -9.394
  219    HA   SER  30           HA       SER  30   8.435  -4.906  -7.494
  220   1HB   SER  30          HB2       SER  30  11.136  -6.241  -7.429
  221   2HB   SER  30          HB1       SER  30   9.710  -6.770  -6.553
  222    HG   SER  30           HG       SER  30   8.817  -6.781  -8.939
  223    H    LEU  31           HN       LEU  31   8.608  -4.564  -5.149
  224    HA   LEU  31           HA       LEU  31   9.888  -2.201  -4.349
  225   1HB   LEU  31          HB2       LEU  31   7.861  -3.317  -3.268
  226   2HB   LEU  31          HB1       LEU  31   8.977  -4.420  -2.502
  227    HG   LEU  31           HG       LEU  31  10.008  -2.438  -1.358
  228   1HD1  LEU  31          HD11      LEU  31   9.293  -0.738  -2.953
  229   2HD1  LEU  31          HD12      LEU  31   8.705  -0.365  -1.324
  230   3HD1  LEU  31          HD13      LEU  31   7.613  -1.063  -2.527
  231   1HD2  LEU  31          HD21      LEU  31   8.180  -2.172   0.240
  232   2HD2  LEU  31          HD22      LEU  31   8.361  -3.857  -0.244
  233   3HD2  LEU  31          HD23      LEU  31   7.059  -2.878  -0.923
  234    H    ALA  32           HN       ALA  32  10.891  -5.522  -4.242
  235    HA   ALA  32           HA       ALA  32  13.050  -5.164  -2.445
  236   1HB   ALA  32          HB1       ALA  32  12.617  -7.329  -4.496
  237   2HB   ALA  32          HB2       ALA  32  12.081  -7.356  -2.815
  238   3HB   ALA  32          HB3       ALA  32  13.802  -7.382  -3.191
  239    H    ASP  33           HN       ASP  33  12.612  -4.855  -5.862
  240    HA   ASP  33           HA       ASP  33  15.375  -4.786  -6.615
  241   1HB   ASP  33          HB2       ASP  33  13.483  -5.393  -8.168
  242   2HB   ASP  33          HB1       ASP  33  12.976  -3.709  -8.124
  243    H    LEU  34           HN       LEU  34  12.983  -2.613  -5.542
  244    HA   LEU  34           HA       LEU  34  14.358  -0.145  -6.064
  245   1HB   LEU  34          HB2       LEU  34  12.335  -0.643  -3.887
  246   2HB   LEU  34          HB1       LEU  34  12.682   0.866  -4.705
  247    HG   LEU  34           HG       LEU  34  11.291  -1.523  -5.896
  248   1HD1  LEU  34          HD11      LEU  34   9.318  -0.099  -5.877
  249   2HD1  LEU  34          HD12      LEU  34  10.236   1.135  -4.994
  250   3HD1  LEU  34          HD13      LEU  34   9.959  -0.456  -4.274
  251   1HD2  LEU  34          HD21      LEU  34  11.797   1.204  -7.066
  252   2HD2  LEU  34          HD22      LEU  34  10.795  -0.077  -7.763
  253   3HD2  LEU  34          HD23      LEU  34  12.537  -0.320  -7.583
  254    H    GLY  35           HN       GLY  35  13.786  -2.232  -3.278
  255   1HA   GLY  35          HA2       GLY  35  15.593  -2.853  -1.829
  256   2HA   GLY  35          HA1       GLY  35  16.260  -1.239  -2.057
  257    H    LEU  36           HN       LEU  36  13.711  -3.092  -0.558
  258    HA   LEU  36           HA       LEU  36  12.828  -0.775   0.897
  259   1HB   LEU  36          HB2       LEU  36  11.033  -2.135   1.750
  260   2HB   LEU  36          HB1       LEU  36  11.281  -2.639   0.121
  261    HG   LEU  36           HG       LEU  36  12.749  -4.533   1.261
  262   1HD1  LEU  36          HD11      LEU  36  10.736  -3.827   3.385
  263   2HD1  LEU  36          HD12      LEU  36  12.487  -3.679   3.539
  264   3HD1  LEU  36          HD13      LEU  36  11.743  -5.276   3.364
  265   1HD2  LEU  36          HD21      LEU  36  10.762  -5.963   1.212
  266   2HD2  LEU  36          HD22      LEU  36  10.825  -4.887  -0.184
  267   3HD2  LEU  36          HD23      LEU  36   9.738  -4.528   1.155
  268    H    ASP  37           HN       ASP  37  13.243  -0.368   3.057
  269    HA   ASP  37           HA       ASP  37  15.880  -1.078   3.790
  270   1HB   ASP  37          HB2       ASP  37  15.600   0.491   5.641
  271   2HB   ASP  37          HB1       ASP  37  14.919   1.187   4.180
  272    H    SER  38           HN       SER  38  12.868  -1.483   5.487
  273    HA   SER  38           HA       SER  38  12.998  -4.102   6.284
  274   1HB   SER  38          HB2       SER  38  15.047  -3.445   7.575
  275   2HB   SER  38          HB1       SER  38  14.115  -2.193   8.391
  276    HG   SER  38           HG       SER  38  13.787  -3.643   9.757
  277    H    LEU  39           HN       LEU  39  12.425  -0.763   7.400
  278    HA   LEU  39           HA       LEU  39  10.027  -1.263   8.781
  279   1HB   LEU  39          HB2       LEU  39  11.366   0.756   9.099
  280   2HB   LEU  39          HB1       LEU  39  11.046   1.242   7.447
  281    HG   LEU  39           HG       LEU  39   8.611   1.323   8.055
  282   1HD1  LEU  39          HD11      LEU  39   8.036   1.562  10.419
  283   2HD1  LEU  39          HD12      LEU  39   9.687   1.115  10.856
  284   3HD1  LEU  39          HD13      LEU  39   8.645  -0.049  10.040
  285   1HD2  LEU  39          HD21      LEU  39  10.516   3.174   9.468
  286   2HD2  LEU  39          HD22      LEU  39   8.811   3.508   9.110
  287   3HD2  LEU  39          HD23      LEU  39   9.963   3.271   7.794
  288    H    MET  40           HN       MET  40  10.810  -0.337   5.468
  289    HA   MET  40           HA       MET  40   8.118  -0.171   4.601
  290   1HB   MET  40          HB2       MET  40  10.671  -0.517   3.026
  291   2HB   MET  40          HB1       MET  40   9.076  -0.328   2.307
  292   1HG   MET  40          HG2       MET  40   8.821   1.834   3.334
  293   2HG   MET  40          HG1       MET  40  10.397   1.669   4.104
  294   1HE   MET  40          HE1       MET  40  12.683   1.819   2.846
  295   2HE   MET  40          HE2       MET  40  12.842   1.847   1.089
  296   3HE   MET  40          HE3       MET  40  12.214   0.410   1.897
  297    H    GLY  41           HN       GLY  41   9.447  -2.794   5.770
  298   1HA   GLY  41          HA2       GLY  41   7.793  -4.537   4.061
  299   2HA   GLY  41          HA1       GLY  41   9.217  -5.096   4.942
  300    H    VAL  42           HN       VAL  42   8.593  -3.420   7.263
  301    HA   VAL  42           HA       VAL  42   6.780  -5.272   8.599
  302    HB   VAL  42           HB       VAL  42   8.315  -2.927   9.774
  303   1HG1  VAL  42          HG11      VAL  42   6.994  -5.268  11.126
  304   2HG1  VAL  42          HG12      VAL  42   6.436  -3.596  11.143
  305   3HG1  VAL  42          HG13      VAL  42   7.955  -4.025  11.929
  306   1HG2  VAL  42          HG21      VAL  42   9.874  -4.547   8.852
  307   2HG2  VAL  42          HG22      VAL  42   9.068  -5.846   9.734
  308   3HG2  VAL  42          HG23      VAL  42   9.923  -4.574  10.615
  309    H    GLU  43           HN       GLU  43   6.978  -1.755   7.984
  310    HA   GLU  43           HA       GLU  43   4.665  -1.164   9.453
  311   1HB   GLU  43          HB2       GLU  43   6.384   0.515   8.899
  312   2HB   GLU  43          HB1       GLU  43   5.918   0.417   7.205
  313   1HG   GLU  43          HG2       GLU  43   3.777   1.350   7.665
  314   2HG   GLU  43          HG1       GLU  43   4.050   1.256   9.404
  315    H    VAL  44           HN       VAL  44   5.171  -2.110   6.167
  316    HA   VAL  44           HA       VAL  44   2.650  -1.607   5.050
  317    HB   VAL  44           HB       VAL  44   4.330  -4.082   4.574
  318   1HG1  VAL  44          HG11      VAL  44   2.143  -4.226   3.612
  319   2HG1  VAL  44          HG12      VAL  44   3.345  -4.033   2.325
  320   3HG1  VAL  44          HG13      VAL  44   2.346  -2.659   2.827
  321   1HG2  VAL  44          HG21      VAL  44   5.744  -2.116   4.338
  322   2HG2  VAL  44          HG22      VAL  44   4.588  -1.389   3.221
  323   3HG2  VAL  44          HG23      VAL  44   5.452  -2.860   2.778
  324    H    ARG  45           HN       ARG  45   3.923  -4.424   6.713
  325    HA   ARG  45           HA       ARG  45   1.584  -5.930   6.788
  326   1HB   ARG  45          HB2       ARG  45   4.113  -5.972   8.383
  327   2HB   ARG  45          HB1       ARG  45   2.840  -7.120   8.731
  328   1HG   ARG  45          HG2       ARG  45   2.950  -7.895   6.390
  329   2HG   ARG  45          HG1       ARG  45   4.265  -6.758   6.104
  330   1HD   ARG  45          HD2       ARG  45   4.350  -8.919   8.193
  331   2HD   ARG  45          HD1       ARG  45   4.946  -9.130   6.550
  332    HE   ARG  45           HE       ARG  45   6.408  -7.152   7.100
  333   1HH1  ARG  45          HH11      ARG  45   5.347  -9.446   9.642
  334   2HH1  ARG  45          HH12      ARG  45   6.792  -9.322  10.524
  335   1HH2  ARG  45          HH21      ARG  45   8.495  -7.159   8.288
  336   2HH2  ARG  45          HH22      ARG  45   8.612  -8.049   9.726
  337    H    GLN  46           HN       GLN  46   2.939  -3.665   9.123
  338    HA   GLN  46           HA       GLN  46   1.135  -3.993  11.234
  339   1HB   GLN  46          HB2       GLN  46   2.381  -1.409  10.301
  340   2HB   GLN  46          HB1       GLN  46   1.628  -1.663  11.862
  341   1HG   GLN  46          HG2       GLN  46   3.341  -3.271  12.448
  342   2HG   GLN  46          HG1       GLN  46   4.067  -3.098  10.849
  343   1HE2  GLN  46          HE21      GLN  46   3.513  -0.200  10.836
  344   2HE2  GLN  46          HE22      GLN  46   4.700   0.522  11.837
  345    H    ILE  47           HN       ILE  47   0.795  -2.042   8.282
  346    HA   ILE  47           HA       ILE  47  -1.599  -0.742   9.133
  347    HB   ILE  47           HB       ILE  47  -0.552  -1.096   6.302
  348   1HG1  ILE  47          HG12      ILE  47  -0.208   1.214   8.219
  349   2HG1  ILE  47          HG11      ILE  47   1.056   0.072   7.746
  350   1HG2  ILE  47          HG21      ILE  47  -2.582   0.834   7.433
  351   2HG2  ILE  47          HG22      ILE  47  -2.923  -0.540   6.385
  352   3HG2  ILE  47          HG23      ILE  47  -1.991   0.832   5.767
  353   1HD1  ILE  47          HD11      ILE  47   1.289   2.188   6.562
  354   2HD1  ILE  47          HD12      ILE  47  -0.345   2.018   5.920
  355   3HD1  ILE  47          HD13      ILE  47   0.911   0.878   5.440
  356    H    LEU  48           HN       LEU  48  -0.891  -3.187   6.729
  357    HA   LEU  48           HA       LEU  48  -3.605  -3.596   6.125
  358   1HB   LEU  48          HB2       LEU  48  -1.153  -5.135   5.413
  359   2HB   LEU  48          HB1       LEU  48  -2.727  -5.772   5.009
  360    HG   LEU  48           HG       LEU  48  -1.935  -4.715   3.071
  361   1HD1  LEU  48          HD11      LEU  48  -3.796  -2.796   4.413
  362   2HD1  LEU  48          HD12      LEU  48  -4.254  -4.242   3.510
  363   3HD1  LEU  48          HD13      LEU  48  -3.490  -2.880   2.680
  364   1HD2  LEU  48          HD21      LEU  48  -1.293  -2.280   4.727
  365   2HD2  LEU  48          HD22      LEU  48  -1.132  -2.402   2.975
  366   3HD2  LEU  48          HD23      LEU  48  -0.126  -3.398   4.024
  367    H    GLU  49           HN       GLU  49  -1.532  -5.283   8.380
  368    HA   GLU  49           HA       GLU  49  -3.267  -7.396   9.000
  369   1HB   GLU  49          HB2       GLU  49  -0.966  -7.430   9.713
  370   2HB   GLU  49          HB1       GLU  49  -1.184  -5.963  10.648
  371   1HG   GLU  49          HG2       GLU  49  -2.734  -7.204  12.132
  372   2HG   GLU  49          HG1       GLU  49  -2.358  -8.671  11.231
  373    H    ARG  50           HN       ARG  50  -2.867  -4.218  10.579
  374    HA   ARG  50           HA       ARG  50  -4.940  -4.978  12.448
  375   1HB   ARG  50          HB2       ARG  50  -3.213  -2.521  12.422
  376   2HB   ARG  50          HB1       ARG  50  -4.199  -3.108  13.763
  377   1HG   ARG  50          HG2       ARG  50  -2.873  -5.083  13.966
  378   2HG   ARG  50          HG1       ARG  50  -1.970  -4.681  12.513
  379   1HD   ARG  50          HD2       ARG  50  -1.242  -2.590  13.736
  380   2HD   ARG  50          HD1       ARG  50  -1.905  -3.345  15.190
  381    HE   ARG  50           HE       ARG  50  -0.290  -5.207  13.937
  382   1HH1  ARG  50          HH11      ARG  50   0.059  -2.147  15.756
  383   2HH1  ARG  50          HH12      ARG  50   1.698  -2.398  16.086
  384   1HH2  ARG  50          HH21      ARG  50   1.966  -5.552  14.496
  385   2HH2  ARG  50          HH22      ARG  50   2.796  -4.376  15.418
  386    H    GLU  51           HN       GLU  51  -4.769  -3.144   9.601
  387    HA   GLU  51           HA       GLU  51  -7.130  -1.623  10.317
  388   1HB   GLU  51          HB2       GLU  51  -5.464  -1.648   7.816
  389   2HB   GLU  51          HB1       GLU  51  -6.966  -0.749   7.954
  390   1HG   GLU  51          HG2       GLU  51  -4.514  -0.368   9.653
  391   2HG   GLU  51          HG1       GLU  51  -5.038   0.673   8.330
  392    H    HIS  52           HN       HIS  52  -6.317  -4.249   8.031
  393    HA   HIS  52           HA       HIS  52  -9.219  -4.692   7.810
  394   1HB   HIS  52          HB2       HIS  52  -7.330  -4.214   5.571
  395   2HB   HIS  52          HB1       HIS  52  -8.682  -5.292   5.310
  396    HD1  HIS  52           HD1      HIS  52 -10.931  -4.239   4.976
  397    HD2  HIS  52           HD2      HIS  52  -8.013  -1.492   6.012
  398    HE1  HIS  52           HE1      HIS  52 -11.968  -1.970   4.597
  399    HE2  HIS  52           HE2      HIS  52  -9.959  -0.490   4.713
  400    H    ASP  53           HN       ASP  53  -6.469  -6.061   8.701
  401    HA   ASP  53           HA       ASP  53  -5.594  -8.057   8.880
  402   1HB   ASP  53          HB2       ASP  53  -7.636  -8.680  10.047
  403   2HB   ASP  53          HB1       ASP  53  -8.434  -9.056   8.522
  404    H    LEU  54           HN       LEU  54  -4.582  -7.403   6.954
  405    HA   LEU  54           HA       LEU  54  -4.704  -9.624   5.064
  406   1HB   LEU  54          HB2       LEU  54  -4.346  -6.700   4.411
  407   2HB   LEU  54          HB1       LEU  54  -3.621  -7.912   3.385
  408    HG   LEU  54           HG       LEU  54  -5.989  -8.758   3.000
  409   1HD1  LEU  54          HD11      LEU  54  -7.802  -7.173   3.360
  410   2HD1  LEU  54          HD12      LEU  54  -6.700  -6.109   4.237
  411   3HD1  LEU  54          HD13      LEU  54  -7.091  -7.700   4.886
  412   1HD2  LEU  54          HD21      LEU  54  -6.461  -7.024   1.339
  413   2HD2  LEU  54          HD22      LEU  54  -4.764  -7.497   1.342
  414   3HD2  LEU  54          HD23      LEU  54  -5.258  -5.982   2.096
  415    H    VAL  55           HN       VAL  55  -3.135 -10.609   6.410
  416    HA   VAL  55           HA       VAL  55  -0.652  -9.227   6.785
  417    HB   VAL  55           HB       VAL  55  -1.226 -12.189   7.191
  418   1HG1  VAL  55          HG11      VAL  55   1.157 -11.735   6.854
  419   2HG1  VAL  55          HG12      VAL  55   0.839 -12.189   8.528
  420   3HG1  VAL  55          HG13      VAL  55   1.109 -10.498   8.109
  421   1HG2  VAL  55          HG21      VAL  55  -1.326 -11.634   9.581
  422   2HG2  VAL  55          HG22      VAL  55  -2.569 -10.775   8.672
  423   3HG2  VAL  55          HG23      VAL  55  -1.113  -9.926   9.193
  424    H    LEU  56           HN       LEU  56   0.038  -8.602   4.906
  425    HA   LEU  56           HA       LEU  56   0.586 -10.494   2.774
  426   1HB   LEU  56          HB2       LEU  56   1.294  -7.564   2.985
  427   2HB   LEU  56          HB1       LEU  56   1.343  -8.543   1.539
  428    HG   LEU  56           HG       LEU  56  -1.164  -7.721   3.015
  429   1HD1  LEU  56          HD11      LEU  56  -0.114  -5.859   1.878
  430   2HD1  LEU  56          HD12      LEU  56  -1.594  -6.337   1.045
  431   3HD1  LEU  56          HD13      LEU  56  -0.023  -6.797   0.387
  432   1HD2  LEU  56          HD21      LEU  56  -2.371  -8.672   1.117
  433   2HD2  LEU  56          HD22      LEU  56  -1.405  -9.904   1.926
  434   3HD2  LEU  56          HD23      LEU  56  -0.847  -9.209   0.403
  435    HA   PRO  57           HA       PRO  57   4.522 -10.988   4.934
  436   1HB   PRO  57          HB2       PRO  57   4.937 -13.166   3.023
  437   2HB   PRO  57          HB1       PRO  57   4.804 -13.246   4.782
  438   1HG   PRO  57          HG2       PRO  57   2.871 -14.217   3.191
  439   2HG   PRO  57          HG1       PRO  57   2.488 -13.405   4.726
  440   1HD   PRO  57          HD2       PRO  57   2.432 -12.292   1.945
  441   2HD   PRO  57          HD1       PRO  57   1.202 -12.173   3.230
  442    H    ILE  58           HN       ILE  58   6.837 -11.266   4.137
  443    HA   ILE  58           HA       ILE  58   7.354  -9.093   2.436
  444    HB   ILE  58           HB       ILE  58   9.211 -11.097   3.721
  445   1HG1  ILE  58          HG12      ILE  58  10.090  -8.910   4.743
  446   2HG1  ILE  58          HG11      ILE  58   8.683  -8.192   3.949
  447   1HG2  ILE  58          HG21      ILE  58  11.159  -9.867   2.892
  448   2HG2  ILE  58          HG22      ILE  58  10.113  -8.894   1.866
  449   3HG2  ILE  58          HG23      ILE  58  10.264 -10.623   1.576
  450   1HD1  ILE  58          HD11      ILE  58   8.560 -10.340   6.045
  451   2HD1  ILE  58          HD12      ILE  58   7.192  -9.518   5.296
  452   3HD1  ILE  58          HD13      ILE  58   8.301  -8.621   6.337
  453    H    ARG  59           HN       ARG  59   7.409 -12.486   1.773
  454    HA   ARG  59           HA       ARG  59   8.488 -12.195  -0.829
  455   1HB   ARG  59          HB2       ARG  59   7.900 -14.509  -1.291
  456   2HB   ARG  59          HB1       ARG  59   8.614 -14.372   0.298
  457   1HG   ARG  59          HG2       ARG  59   5.671 -14.673  -0.273
  458   2HG   ARG  59          HG1       ARG  59   6.763 -15.972   0.188
  459   1HD   ARG  59          HD2       ARG  59   6.085 -13.545   1.839
  460   2HD   ARG  59          HD1       ARG  59   5.454 -15.175   2.097
  461    HE   ARG  59           HE       ARG  59   8.328 -14.563   2.288
  462   1HH1  ARG  59          HH11      ARG  59   5.377 -15.986   3.695
  463   2HH1  ARG  59          HH12      ARG  59   6.133 -16.440   5.141
  464   1HH2  ARG  59          HH21      ARG  59   9.352 -15.244   4.281
  465   2HH2  ARG  59          HH22      ARG  59   8.433 -15.995   5.492
  466    H    GLU  60           HN       GLU  60   5.669 -11.090   0.215
  467    HA   GLU  60           HA       GLU  60   4.445 -11.138  -2.469
  468   1HB   GLU  60          HB2       GLU  60   3.301 -10.431   0.256
  469   2HB   GLU  60          HB1       GLU  60   2.436 -10.227  -1.257
  470   1HG   GLU  60          HG2       GLU  60   3.436 -12.866  -0.233
  471   2HG   GLU  60          HG1       GLU  60   1.813 -12.242   0.056
  472    H    VAL  61           HN       VAL  61   5.068  -9.097   0.353
  473    HA   VAL  61           HA       VAL  61   4.585  -6.609  -0.727
  474    HB   VAL  61           HB       VAL  61   6.551  -7.333   1.472
  475   1HG1  VAL  61          HG11      VAL  61   6.293  -5.027   2.253
  476   2HG1  VAL  61          HG12      VAL  61   5.302  -4.661   0.840
  477   3HG1  VAL  61          HG13      VAL  61   7.003  -5.082   0.639
  478   1HG2  VAL  61          HG21      VAL  61   4.727  -6.724   2.984
  479   2HG2  VAL  61          HG22      VAL  61   4.292  -8.073   1.938
  480   3HG2  VAL  61          HG23      VAL  61   3.673  -6.455   1.596
  481    H    ARG  62           HN       ARG  62   7.573  -8.480  -0.859
  482    HA   ARG  62           HA       ARG  62   9.197  -6.435  -1.801
  483   1HB   ARG  62          HB2       ARG  62   9.451  -9.381  -1.792
  484   2HB   ARG  62          HB1       ARG  62  10.519  -8.481  -2.857
  485   1HG   ARG  62          HG2       ARG  62  11.241  -7.135  -0.906
  486   2HG   ARG  62          HG1       ARG  62  10.253  -8.174   0.124
  487   1HD   ARG  62          HD2       ARG  62  11.582 -10.072  -0.358
  488   2HD   ARG  62          HD1       ARG  62  12.393  -9.255  -1.693
  489    HE   ARG  62           HE       ARG  62  13.199  -7.705   0.189
  490   1HH1  ARG  62          HH11      ARG  62  12.756 -11.221   0.550
  491   2HH1  ARG  62          HH12      ARG  62  14.069 -11.413   1.614
  492   1HH2  ARG  62          HH21      ARG  62  15.022  -7.984   1.688
  493   2HH2  ARG  62          HH22      ARG  62  15.364  -9.525   2.289
  494    H    GLN  63           HN       GLN  63   6.672  -7.887  -3.507
  495    HA   GLN  63           HA       GLN  63   7.946  -7.128  -6.035
  496   1HB   GLN  63          HB2       GLN  63   5.683  -9.084  -5.597
  497   2HB   GLN  63          HB1       GLN  63   6.176  -8.504  -7.177
  498   1HG   GLN  63          HG2       GLN  63   7.187 -10.616  -6.928
  499   2HG   GLN  63          HG1       GLN  63   8.464  -9.435  -6.662
  500   1HE2  GLN  63          HE21      GLN  63   6.024 -10.203  -4.333
  501   2HE2  GLN  63          HE22      GLN  63   7.050 -11.008  -3.215
  502    H    LEU  64           HN       LEU  64   6.174  -5.743  -3.851
  503    HA   LEU  64           HA       LEU  64   4.097  -4.695  -5.537
  504   1HB   LEU  64          HB2       LEU  64   5.047  -3.681  -2.851
  505   2HB   LEU  64          HB1       LEU  64   3.554  -3.239  -3.656
  506    HG   LEU  64           HG       LEU  64   4.264  -5.924  -2.521
  507   1HD1  LEU  64          HD11      LEU  64   3.706  -4.313  -0.823
  508   2HD1  LEU  64          HD12      LEU  64   2.414  -5.506  -0.972
  509   3HD1  LEU  64          HD13      LEU  64   2.215  -3.896  -1.666
  510   1HD2  LEU  64          HD21      LEU  64   1.733  -5.074  -3.930
  511   2HD2  LEU  64          HD22      LEU  64   1.967  -6.610  -3.095
  512   3HD2  LEU  64          HD23      LEU  64   2.922  -6.228  -4.529
  513    H    THR  65           HN       THR  65   4.436  -3.235  -7.028
  514    HA   THR  65           HA       THR  65   6.994  -2.084  -7.446
  515    HB   THR  65           HB       THR  65   5.826  -1.322  -9.528
  516    HG1  THR  65           HG1      THR  65   3.693  -1.945  -9.773
  517   1HG2  THR  65          HG21      THR  65   5.538  -3.597 -10.390
  518   2HG2  THR  65          HG22      THR  65   5.443  -4.189  -8.725
  519   3HG2  THR  65          HG23      THR  65   6.956  -3.511  -9.327
  520    H    LEU  66           HN       LEU  66   6.073  -0.962  -5.145
  521    HA   LEU  66           HA       LEU  66   5.871   0.975  -4.006
  522   1HB   LEU  66          HB2       LEU  66   7.687   1.608  -5.716
  523   2HB   LEU  66          HB1       LEU  66   6.430   2.449  -6.590
  524    HG   LEU  66           HG       LEU  66   7.827   3.966  -5.255
  525   1HD1  LEU  66          HD11      LEU  66   5.025   3.769  -4.232
  526   2HD1  LEU  66          HD12      LEU  66   5.548   4.621  -5.683
  527   3HD1  LEU  66          HD13      LEU  66   6.066   5.191  -4.088
  528   1HD2  LEU  66          HD21      LEU  66   8.442   2.462  -3.457
  529   2HD2  LEU  66          HD22      LEU  66   6.776   2.440  -2.879
  530   3HD2  LEU  66          HD23      LEU  66   7.714   3.931  -2.808
  531    H    ARG  67           HN       ARG  67   4.395   1.770  -7.154
  532    HA   ARG  67           HA       ARG  67   2.192   2.988  -5.737
  533   1HB   ARG  67          HB2       ARG  67   2.713   2.652  -8.687
  534   2HB   ARG  67          HB1       ARG  67   1.210   3.306  -8.067
  535   1HG   ARG  67          HG2       ARG  67   3.954   4.489  -7.644
  536   2HG   ARG  67          HG1       ARG  67   2.743   5.066  -8.787
  537   1HD   ARG  67          HD2       ARG  67   1.222   5.341  -6.734
  538   2HD   ARG  67          HD1       ARG  67   2.670   5.107  -5.790
  539    HE   ARG  67           HE       ARG  67   3.613   7.049  -7.164
  540   1HH1  ARG  67          HH11      ARG  67   0.272   6.873  -6.090
  541   2HH1  ARG  67          HH12      ARG  67   0.006   8.550  -6.150
  542   1HH2  ARG  67          HH21      ARG  67   3.235   9.412  -7.270
  543   2HH2  ARG  67          HH22      ARG  67   1.730   9.996  -6.797
  544    H    LYS  68           HN       LYS  68   2.982  -0.086  -6.444
  545    HA   LYS  68           HA       LYS  68   0.299  -1.034  -6.909
  546   1HB   LYS  68          HB2       LYS  68   2.350  -2.264  -7.668
  547   2HB   LYS  68          HB1       LYS  68   2.691  -2.624  -5.984
  548   1HG   LYS  68          HG2       LYS  68   0.638  -3.865  -5.799
  549   2HG   LYS  68          HG1       LYS  68   0.211  -3.445  -7.457
  550   1HD   LYS  68          HD2       LYS  68   2.239  -4.611  -8.232
  551   2HD   LYS  68          HD1       LYS  68   2.558  -5.077  -6.552
  552   1HE   LYS  68          HE2       LYS  68   0.500  -6.240  -6.430
  553   2HE   LYS  68          HE1       LYS  68   0.046  -5.713  -8.051
  554   1HZ   LYS  68          HZ1       LYS  68   2.170  -7.679  -7.307
  555   2HZ   LYS  68          HZ2       LYS  68   2.158  -6.904  -8.783
  556   3HZ   LYS  68          HZ3       LYS  68   0.852  -7.876  -8.365
  557    H    LEU  69           HN       LEU  69   2.204  -0.143  -4.328
  558    HA   LEU  69           HA       LEU  69   1.047  -1.500  -2.138
  559   1HB   LEU  69          HB2       LEU  69   2.293   1.227  -2.348
  560   2HB   LEU  69          HB1       LEU  69   1.476   0.779  -0.872
  561    HG   LEU  69           HG       LEU  69   3.858   0.513  -0.644
  562   1HD1  LEU  69          HD11      LEU  69   3.972  -1.792   0.108
  563   2HD1  LEU  69          HD12      LEU  69   2.459  -2.133  -0.736
  564   3HD1  LEU  69          HD13      LEU  69   2.483  -0.990   0.607
  565   1HD2  LEU  69          HD21      LEU  69   5.129  -1.151  -1.915
  566   2HD2  LEU  69          HD22      LEU  69   4.483   0.109  -2.967
  567   3HD2  LEU  69          HD23      LEU  69   3.707  -1.473  -2.907
  568    H    GLN  70           HN       GLN  70   0.036   1.431  -3.767
  569    HA   GLN  70           HA       GLN  70  -2.314   1.759  -2.164
  570   1HB   GLN  70          HB2       GLN  70  -2.895   3.524  -3.933
  571   2HB   GLN  70          HB1       GLN  70  -1.480   3.798  -2.923
  572   1HG   GLN  70          HG2       GLN  70  -0.016   3.168  -4.648
  573   2HG   GLN  70          HG1       GLN  70  -1.342   2.593  -5.672
  574   1HE2  GLN  70          HE21      GLN  70  -2.510   4.145  -6.822
  575   2HE2  GLN  70          HE22      GLN  70  -1.918   5.760  -6.959
  576    H    GLU  71           HN       GLU  71  -1.647  -0.436  -4.488
  577    HA   GLU  71           HA       GLU  71  -4.358  -0.538  -5.579
  578   1HB   GLU  71          HB2       GLU  71  -1.942  -2.317  -6.061
  579   2HB   GLU  71          HB1       GLU  71  -3.491  -2.487  -6.864
  580   1HG   GLU  71          HG2       GLU  71  -1.631  -0.130  -7.118
  581   2HG   GLU  71          HG1       GLU  71  -1.806  -1.436  -8.285
  582    H    MET  72           HN       MET  72  -2.246  -1.902  -3.224
  583    HA   MET  72           HA       MET  72  -4.090  -4.126  -2.586
  584   1HB   MET  72          HB2       MET  72  -1.247  -3.660  -1.652
  585   2HB   MET  72          HB1       MET  72  -2.209  -5.102  -1.386
  586   1HG   MET  72          HG2       MET  72  -1.190  -4.092  -4.011
  587   2HG   MET  72          HG1       MET  72  -0.516  -5.424  -3.086
  588   1HE   MET  72          HE1       MET  72  -3.360  -8.117  -3.246
  589   2HE   MET  72          HE2       MET  72  -3.108  -6.896  -2.000
  590   3HE   MET  72          HE3       MET  72  -1.726  -7.750  -2.687
  591    H    SER  73           HN       SER  73  -4.153  -1.156  -1.897
  592    HA   SER  73           HA       SER  73  -3.264  -0.899   0.731
  593   1HB   SER  73          HB2       SER  73  -4.386   1.340   0.538
  594   2HB   SER  73          HB1       SER  73  -3.167   0.959  -0.668
  595    HG   SER  73           HG       SER  73  -5.093   1.848  -1.578
  596    H    SER  74           HN       SER  74  -6.365  -1.822  -0.691
  597    HA   SER  74           HA       SER  74  -8.396  -2.368   0.204
  598   1HB   SER  74          HB2       SER  74  -6.890  -3.929   1.524
  599   2HB   SER  74          HB1       SER  74  -6.760  -2.695   2.769
  600    HG   SER  74           HG       SER  74  -9.138  -4.026   1.943
  601    H    LYS  75           HN       LYS  75  -7.836   0.258  -0.095
  602    HA   LYS  75           HA       LYS  75  -8.493   1.647   2.391
  603   1HB   LYS  75          HB2       LYS  75  -6.406   2.291   1.381
  604   2HB   LYS  75          HB1       LYS  75  -7.200   2.594  -0.153
  605   1HG   LYS  75          HG2       LYS  75  -8.364   4.489   0.759
  606   2HG   LYS  75          HG1       LYS  75  -7.751   4.130   2.376
  607   1HD   LYS  75          HD2       LYS  75  -6.009   4.777   0.000
  608   2HD   LYS  75          HD1       LYS  75  -6.523   5.958   1.208
  609   1HE   LYS  75          HE2       LYS  75  -4.900   3.461   1.773
  610   2HE   LYS  75          HE1       LYS  75  -4.255   5.095   1.673
  611   1HZ   LYS  75          HZ1       LYS  75  -4.586   4.521   3.936
  612   2HZ   LYS  75          HZ2       LYS  75  -6.183   4.059   3.662
  613   3HZ   LYS  75          HZ3       LYS  75  -5.733   5.704   3.508
  614    H    ALA  76           HN       ALA  76  -9.255   1.722  -1.082
  615    HA   ALA  76           HA       ALA  76 -11.863   2.817  -0.406
  616   1HB   ALA  76          HB1       ALA  76 -11.596   4.645  -2.011
  617   2HB   ALA  76          HB2       ALA  76  -9.931   4.148  -2.304
  618   3HB   ALA  76          HB3       ALA  76 -10.400   4.756  -0.717
  619    H    GLY  77           HN       GLY  77 -12.661   3.396  -2.996
  620   1HA   GLY  77          HA2       GLY  77 -11.960   1.398  -4.848
  621   2HA   GLY  77          HA1       GLY  77 -13.445   0.970  -3.999
  622    H    SER  78           HN       SER  78 -13.695   1.356  -6.620
  623    HA   SER  78           HA       SER  78 -14.270   4.045  -7.277
  624   1HB   SER  78          HB2       SER  78 -15.448   2.908  -9.246
  625   2HB   SER  78          HB1       SER  78 -13.715   2.632  -9.071
  626    HG   SER  78           HG       SER  78 -14.163   0.648  -9.048
  627    H    ASP  79           HN       ASP  79 -16.146   1.340  -6.068
  628    HA   ASP  79           HA       ASP  79 -18.426   3.158  -5.818
  629   1HB   ASP  79          HB2       ASP  79 -18.955   1.069  -7.013
  630   2HB   ASP  79          HB1       ASP  79 -18.386   0.133  -5.633
  631    H    THR  80           HN       THR  80 -18.451   4.131  -3.967
  632    HA   THR  80           HA       THR  80 -18.066   2.563  -1.551
  633    HB   THR  80           HB       THR  80 -16.708   5.236  -2.024
  634    HG1  THR  80           HG1      THR  80 -16.004   2.762  -2.680
  635   1HG2  THR  80          HG21      THR  80 -15.616   4.775   0.132
  636   2HG2  THR  80          HG22      THR  80 -16.549   3.284   0.288
  637   3HG2  THR  80          HG23      THR  80 -17.369   4.841   0.314
  638    H    GLU  81           HN       GLU  81 -20.061   2.718  -0.833
  639    HA   GLU  81           HA       GLU  81 -21.178   5.405  -0.523
  640   1HB   GLU  81          HB2       GLU  81 -22.748   2.838  -0.839
  641   2HB   GLU  81          HB1       GLU  81 -23.399   4.466  -0.739
  642   1HG   GLU  81          HG2       GLU  81 -22.369   5.028  -2.863
  643   2HG   GLU  81          HG1       GLU  81 -21.666   3.414  -2.960
  644    H    LEU  82           HN       LEU  82 -22.155   2.254   0.747
  645    HA   LEU  82           HA       LEU  82 -21.477   3.198   3.451
  646   1HB   LEU  82          HB2       LEU  82 -23.992   1.768   2.592
  647   2HB   LEU  82          HB1       LEU  82 -23.554   2.123   4.247
  648    HG   LEU  82           HG       LEU  82 -24.126   4.207   2.136
  649   1HD1  LEU  82          HD11      LEU  82 -25.826   3.216   4.419
  650   2HD1  LEU  82          HD12      LEU  82 -26.121   2.932   2.702
  651   3HD1  LEU  82          HD13      LEU  82 -26.209   4.569   3.355
  652   1HD2  LEU  82          HD21      LEU  82 -24.166   5.757   4.039
  653   2HD2  LEU  82          HD22      LEU  82 -22.589   4.986   3.869
  654   3HD2  LEU  82          HD23      LEU  82 -23.710   4.438   5.117
  655    H    ALA  83           HN       ALA  83 -21.996   0.508   1.250
  656    HA   ALA  83           HA       ALA  83 -21.212  -1.474   3.183
  657   1HB   ALA  83          HB1       ALA  83 -21.768  -1.748   0.239
  658   2HB   ALA  83          HB2       ALA  83 -22.948  -1.945   1.536
  659   3HB   ALA  83          HB3       ALA  83 -21.593  -3.067   1.400
  660    H    ALA  84           HN       ALA  84 -19.147  -1.574   3.695
  661    HA   ALA  84           HA       ALA  84 -17.135  -1.348   1.601
  662   1HB   ALA  84          HB1       ALA  84 -16.863  -1.569   4.610
  663   2HB   ALA  84          HB2       ALA  84 -16.722  -0.084   3.667
  664   3HB   ALA  84          HB3       ALA  84 -15.528  -1.368   3.477
  665    HA   PRO  85           HA       PRO  85 -17.289  -5.804   1.697
  666   1HB   PRO  85          HB2       PRO  85 -15.374  -5.835  -0.460
  667   2HB   PRO  85          HB1       PRO  85 -17.106  -6.169  -0.539
  668   1HG   PRO  85          HG2       PRO  85 -15.910  -3.972  -1.686
  669   2HG   PRO  85          HG1       PRO  85 -17.610  -4.041  -1.197
  670   1HD   PRO  85          HD2       PRO  85 -15.274  -2.829   0.225
  671   2HD   PRO  85          HD1       PRO  85 -16.935  -2.218   0.061
  672    H    LYS  86           HN       LYS  86 -16.181  -6.282   3.562
  673    HA   LYS  86           HA       LYS  86 -13.262  -6.001   3.483
  674   1HB   LYS  86          HB2       LYS  86 -14.939  -6.721   5.890
  675   2HB   LYS  86          HB1       LYS  86 -13.267  -6.187   5.871
  676   1HG   LYS  86          HG2       LYS  86 -14.102  -3.981   4.991
  677   2HG   LYS  86          HG1       LYS  86 -15.735  -4.553   5.342
  678   1HD   LYS  86          HD2       LYS  86 -14.893  -5.010   7.702
  679   2HD   LYS  86          HD1       LYS  86 -13.477  -4.054   7.262
  680   1HE   LYS  86          HE2       LYS  86 -14.955  -2.560   8.328
  681   2HE   LYS  86          HE1       LYS  86 -15.101  -2.222   6.600
  682   1HZ   LYS  86          HZ1       LYS  86 -17.122  -3.704   6.622
  683   2HZ   LYS  86          HZ2       LYS  86 -17.285  -2.305   7.523
  684   3HZ   LYS  86          HZ3       LYS  86 -16.958  -3.785   8.291
  685    H    SER  87           HN       SER  87 -15.674  -8.231   4.741
  686    HA   SER  87           HA       SER  87 -13.852 -10.467   4.429
  687   1HB   SER  87          HB2       SER  87 -16.708 -10.440   5.425
  688   2HB   SER  87          HB1       SER  87 -15.499 -11.696   5.676
  689    HG   SER  87           HG       SER  87 -15.658 -10.500   7.488
  690    H    LYS  88           HN       LYS  88 -17.067  -9.375   3.391
  691    HA   LYS  88           HA       LYS  88 -18.490  -9.887   1.725
  692   1HB   LYS  88          HB2       LYS  88 -16.158 -11.305   0.389
  693   2HB   LYS  88          HB1       LYS  88 -17.672 -10.860  -0.383
  694   1HG   LYS  88          HG2       LYS  88 -17.143  -8.506  -0.116
  695   2HG   LYS  88          HG1       LYS  88 -15.657  -8.922   0.739
  696   1HD   LYS  88          HD2       LYS  88 -16.325  -9.549  -2.138
  697   2HD   LYS  88          HD1       LYS  88 -15.158  -8.360  -1.564
  698   1HE   LYS  88          HE2       LYS  88 -15.001 -11.359  -1.238
  699   2HE   LYS  88          HE1       LYS  88 -13.999 -10.359  -2.288
  700   1HZ   LYS  88          HZ1       LYS  88 -12.790 -10.911  -0.317
  701   2HZ   LYS  88          HZ2       LYS  88 -14.025 -10.399   0.675
  702   3HZ   LYS  88          HZ3       LYS  88 -13.156  -9.251  -0.240
  703    H    ASN  89           HN       ASN  89 -18.120 -11.475   4.003
  704    HA   ASN  89           HA       ASN  89 -18.554 -14.216   3.177
  705   1HB   ASN  89          HB2       ASN  89 -17.172 -13.974   5.134
  706   2HB   ASN  89          HB1       ASN  89 -18.362 -12.939   5.914
  707   1HD2  ASN  89          HD21      ASN  89 -17.677 -16.228   4.891
  708   2HD2  ASN  89          HD22      ASN  89 -18.813 -16.992   5.927
  Start of MODEL   24
    1   1H    GLY   1          HT1       GLY   1 -12.544  -3.405  15.010
    2   2H    GLY   1          HT2       GLY   1 -11.254  -4.259  14.255
    3   3H    GLY   1          HT3       GLY   1 -12.845  -4.515  13.768
    4   1HA   GLY   1          HA1       GLY   1 -11.381  -1.988  13.454
    5   2HA   GLY   1          HA2       GLY   1 -11.670  -3.184  12.191
    6    H    ASP   2           HN       ASP   2 -13.065  -0.794  14.259
    7    HA   ASP   2           HA       ASP   2 -15.625  -1.020  12.840
    8   1HB   ASP   2          HB2       ASP   2 -16.654   0.157  14.746
    9   2HB   ASP   2          HB1       ASP   2 -15.940  -1.376  15.209
   10    H    GLY   3           HN       GLY   3 -13.006   1.126  13.687
   11   1HA   GLY   3          HA2       GLY   3 -13.699   2.913  11.620
   12   2HA   GLY   3          HA1       GLY   3 -14.251   3.547  13.164
   13    H    GLU   4           HN       GLU   4 -11.388   1.686  12.339
   14    HA   GLU   4           HA       GLU   4  -9.749   3.716  13.654
   15   1HB   GLU   4          HB2       GLU   4  -9.504   1.261  14.158
   16   2HB   GLU   4          HB1       GLU   4  -8.969   1.023  12.504
   17   1HG   GLU   4          HG2       GLU   4  -7.085   1.075  14.003
   18   2HG   GLU   4          HG1       GLU   4  -7.046   2.481  12.939
   19    H    ALA   5           HN       ALA   5 -10.859   2.714  10.635
   20    HA   ALA   5           HA       ALA   5 -10.452   3.159   8.497
   21   1HB   ALA   5          HB1       ALA   5  -9.461   5.325   7.913
   22   2HB   ALA   5          HB2       ALA   5  -8.865   5.506   9.563
   23   3HB   ALA   5          HB3       ALA   5 -10.601   5.502   9.248
   24    H    GLN   6           HN       GLN   6  -8.189   4.123   7.140
   25    HA   GLN   6           HA       GLN   6  -6.020   2.405   8.011
   26   1HB   GLN   6          HB2       GLN   6  -7.514   1.058   6.534
   27   2HB   GLN   6          HB1       GLN   6  -7.290   2.250   5.269
   28   1HG   GLN   6          HG2       GLN   6  -4.935   1.701   5.129
   29   2HG   GLN   6          HG1       GLN   6  -5.102   0.579   6.475
   30   1HE2  GLN   6          HE21      GLN   6  -4.260   0.094   3.775
   31   2HE2  GLN   6          HE22      GLN   6  -5.325  -1.078   3.077
   32    H    ARG   7           HN       ARG   7  -4.161   3.428   7.715
   33    HA   ARG   7           HA       ARG   7  -4.044   6.075   6.641
   34   1HB   ARG   7          HB2       ARG   7  -1.674   5.997   7.129
   35   2HB   ARG   7          HB1       ARG   7  -2.542   5.234   8.455
   36   1HG   ARG   7          HG2       ARG   7  -2.019   3.026   7.434
   37   2HG   ARG   7          HG1       ARG   7  -1.055   3.881   6.234
   38   1HD   ARG   7          HD2       ARG   7  -0.575   3.949   9.218
   39   2HD   ARG   7          HD1       ARG   7   0.330   2.969   8.073
   40    HE   ARG   7           HE       ARG   7   0.366   5.746   7.405
   41   1HH1  ARG   7          HH11      ARG   7   1.940   3.253   9.365
   42   2HH1  ARG   7          HH12      ARG   7   3.405   4.093   9.558
   43   1HH2  ARG   7          HH21      ARG   7   2.368   6.980   7.742
   44   2HH2  ARG   7          HH22      ARG   7   3.612   6.313   8.687
   45    H    ASP   8           HN       ASP   8  -2.744   6.797   4.765
   46    HA   ASP   8           HA       ASP   8  -3.253   5.079   2.551
   47   1HB   ASP   8          HB2       ASP   8  -3.473   7.500   2.229
   48   2HB   ASP   8          HB1       ASP   8  -1.758   7.711   2.563
   49    H    LEU   9           HN       LEU   9  -2.081   3.834   1.539
   50    HA   LEU   9           HA       LEU   9   0.120   2.553   2.574
   51   1HB   LEU   9          HB2       LEU   9  -1.204   2.645  -0.081
   52   2HB   LEU   9          HB1       LEU   9   0.291   1.767   0.072
   53    HG   LEU   9           HG       LEU   9  -1.711   0.369   0.188
   54   1HD1  LEU   9          HD11      LEU   9  -1.031  -0.919   2.157
   55   2HD1  LEU   9          HD12      LEU   9  -0.081   0.460   2.715
   56   3HD1  LEU   9          HD13      LEU   9   0.354  -0.364   1.219
   57   1HD2  LEU   9          HD21      LEU   9  -2.237   1.743   2.810
   58   2HD2  LEU   9          HD22      LEU   9  -3.098   0.339   2.146
   59   3HD2  LEU   9          HD23      LEU   9  -3.206   1.902   1.341
   60    H    VAL  10           HN       VAL  10   0.016   4.893  -0.088
   61    HA   VAL  10           HA       VAL  10   2.820   4.576  -0.489
   62    HB   VAL  10           HB       VAL  10   0.816   6.388  -1.868
   63   1HG1  VAL  10          HG11      VAL  10   3.063   7.383  -1.998
   64   2HG1  VAL  10          HG12      VAL  10   2.543   6.773  -3.568
   65   3HG1  VAL  10          HG13      VAL  10   3.705   5.856  -2.604
   66   1HG2  VAL  10          HG21      VAL  10   2.172   3.835  -2.715
   67   2HG2  VAL  10          HG22      VAL  10   1.089   4.803  -3.712
   68   3HG2  VAL  10          HG23      VAL  10   0.479   4.016  -2.260
   69    H    LYS  11           HN       LYS  11   0.732   6.929   1.052
   70    HA   LYS  11           HA       LYS  11   2.810   8.864   1.378
   71   1HB   LYS  11          HB2       LYS  11   0.423   8.592   3.219
   72   2HB   LYS  11          HB1       LYS  11   1.402  10.020   2.915
   73   1HG   LYS  11          HG2       LYS  11  -0.521   8.698   1.028
   74   2HG   LYS  11          HG1       LYS  11  -0.712  10.253   1.826
   75   1HD   LYS  11          HD2       LYS  11   1.074  11.197   0.521
   76   2HD   LYS  11          HD1       LYS  11   1.472   9.613  -0.155
   77   1HE   LYS  11          HE2       LYS  11  -1.146  11.073  -0.541
   78   2HE   LYS  11          HE1       LYS  11   0.162  10.984  -1.719
   79   1HZ   LYS  11          HZ1       LYS  11  -1.766   9.364  -1.959
   80   2HZ   LYS  11          HZ2       LYS  11  -1.049   8.452  -0.699
   81   3HZ   LYS  11          HZ3       LYS  11  -0.219   8.778  -2.125
   82    H    ALA  12           HN       ALA  12   2.242   5.887   2.806
   83    HA   ALA  12           HA       ALA  12   3.845   6.490   5.160
   84   1HB   ALA  12          HB1       ALA  12   3.255   4.230   5.878
   85   2HB   ALA  12          HB2       ALA  12   2.421   3.960   4.346
   86   3HB   ALA  12          HB3       ALA  12   1.817   5.165   5.476
   87    H    VAL  13           HN       VAL  13   3.746   3.982   2.616
   88    HA   VAL  13           HA       VAL  13   6.314   2.963   3.220
   89    HB   VAL  13           HB       VAL  13   4.600   2.515   0.765
   90   1HG1  VAL  13          HG11      VAL  13   7.008   0.955   1.733
   91   2HG1  VAL  13          HG12      VAL  13   6.939   1.969   0.294
   92   3HG1  VAL  13          HG13      VAL  13   5.961   0.502   0.383
   93   1HG2  VAL  13          HG21      VAL  13   4.005   0.411   1.879
   94   2HG2  VAL  13          HG22      VAL  13   3.534   1.824   2.830
   95   3HG2  VAL  13          HG23      VAL  13   4.971   0.898   3.274
   96    H    ALA  14           HN       ALA  14   5.207   5.008   0.509
   97    HA   ALA  14           HA       ALA  14   7.764   5.021  -0.715
   98   1HB   ALA  14          HB1       ALA  14   5.712   5.479  -1.991
   99   2HB   ALA  14          HB2       ALA  14   6.872   6.798  -2.164
  100   3HB   ALA  14          HB3       ALA  14   5.484   6.972  -1.088
  101    H    HIS  15           HN       HIS  15   6.210   6.911   1.675
  102    HA   HIS  15           HA       HIS  15   7.965   9.116   1.758
  103   1HB   HIS  15          HB2       HIS  15   5.801   9.192   2.862
  104   2HB   HIS  15          HB1       HIS  15   6.274   7.899   3.949
  105    HD1  HIS  15           HD1      HIS  15   7.000   8.657   6.172
  106    HD2  HIS  15           HD2      HIS  15   7.537  11.611   3.302
  107    HE1  HIS  15           HE1      HIS  15   7.833  10.676   7.419
  108    HE2  HIS  15           HE2      HIS  15   7.920  12.498   5.696
  109    H    ILE  16           HN       ILE  16   8.255   5.869   3.025
  110    HA   ILE  16           HA       ILE  16  10.344   6.358   4.871
  111    HB   ILE  16           HB       ILE  16   9.791   3.803   3.305
  112   1HG1  ILE  16          HG12      ILE  16   7.817   4.491   4.588
  113   2HG1  ILE  16          HG11      ILE  16   8.533   3.038   5.268
  114   1HG2  ILE  16          HG21      ILE  16  11.323   4.224   5.867
  115   2HG2  ILE  16          HG22      ILE  16  12.007   3.803   4.298
  116   3HG2  ILE  16          HG23      ILE  16  10.957   2.658   5.138
  117   1HD1  ILE  16          HD11      ILE  16   7.815   4.558   7.011
  118   2HD1  ILE  16          HD12      ILE  16   8.829   5.836   6.340
  119   3HD1  ILE  16          HD13      ILE  16   9.570   4.391   7.029
  120    H    LEU  17           HN       LEU  17  10.236   5.657   1.446
  121    HA   LEU  17           HA       LEU  17  13.115   5.693   1.169
  122   1HB   LEU  17          HB2       LEU  17  10.917   5.684  -0.903
  123   2HB   LEU  17          HB1       LEU  17  12.623   5.653  -1.286
  124    HG   LEU  17           HG       LEU  17  11.141   3.507   0.237
  125   1HD1  LEU  17          HD11      LEU  17  12.227   3.550  -2.575
  126   2HD1  LEU  17          HD12      LEU  17  10.524   3.606  -2.126
  127   3HD1  LEU  17          HD13      LEU  17  11.480   2.169  -1.771
  128   1HD2  LEU  17          HD21      LEU  17  13.483   3.715   0.924
  129   2HD2  LEU  17          HD22      LEU  17  13.987   3.633  -0.764
  130   3HD2  LEU  17          HD23      LEU  17  13.220   2.238  -0.005
  131    H    GLY  18           HN       GLY  18  10.466   7.900   0.776
  132   1HA   GLY  18          HA2       GLY  18  10.929  10.272   1.125
  133   2HA   GLY  18          HA1       GLY  18  12.419  10.046   0.217
  134    H    ILE  19           HN       ILE  19   9.814   8.322  -1.036
  135    HA   ILE  19           HA       ILE  19   9.547  10.288  -3.170
  136    HB   ILE  19           HB       ILE  19   8.357   8.217  -4.275
  137   1HG1  ILE  19          HG12      ILE  19  10.361   6.884  -2.444
  138   2HG1  ILE  19          HG11      ILE  19   8.615   6.688  -2.415
  139   1HG2  ILE  19          HG21      ILE  19  10.156   9.403  -5.306
  140   2HG2  ILE  19          HG22      ILE  19  10.445   7.684  -5.461
  141   3HG2  ILE  19          HG23      ILE  19  11.345   8.624  -4.259
  142   1HD1  ILE  19          HD11      ILE  19  10.446   5.840  -4.649
  143   2HD1  ILE  19          HD12      ILE  19   8.696   5.619  -4.607
  144   3HD1  ILE  19          HD13      ILE  19   9.719   4.780  -3.441
  145    H    ARG  20           HN       ARG  20   7.508  10.487  -4.168
  146    HA   ARG  20           HA       ARG  20   5.132   9.588  -2.842
  147   1HB   ARG  20          HB2       ARG  20   5.843  11.532  -1.438
  148   2HB   ARG  20          HB1       ARG  20   5.745  12.544  -2.873
  149   1HG   ARG  20          HG2       ARG  20   3.374  12.080  -3.057
  150   2HG   ARG  20          HG1       ARG  20   3.450  11.038  -1.636
  151   1HD   ARG  20          HD2       ARG  20   3.956  14.009  -1.787
  152   2HD   ARG  20          HD1       ARG  20   2.640  13.190  -0.950
  153    HE   ARG  20           HE       ARG  20   5.431  12.774  -0.156
  154   1HH1  ARG  20          HH11      ARG  20   2.114  13.704   0.720
  155   2HH1  ARG  20          HH12      ARG  20   2.474  13.926   2.367
  156   1HH2  ARG  20          HH21      ARG  20   5.927  13.078   1.996
  157   2HH2  ARG  20          HH22      ARG  20   4.757  13.547   3.158
  158    H    ASP  21           HN       ASP  21   6.623  11.924  -4.985
  159    HA   ASP  21           HA       ASP  21   4.421  12.189  -6.826
  160   1HB   ASP  21          HB2       ASP  21   7.368  12.666  -7.335
  161   2HB   ASP  21          HB1       ASP  21   6.039  13.221  -8.336
  162    H    LEU  22           HN       LEU  22   7.393  10.378  -6.987
  163    HA   LEU  22           HA       LEU  22   7.923   8.496  -8.044
  164   1HB   LEU  22          HB2       LEU  22   4.959   8.211  -8.062
  165   2HB   LEU  22          HB1       LEU  22   5.909   7.131  -9.056
  166    HG   LEU  22           HG       LEU  22   5.285   6.150  -6.970
  167   1HD1  LEU  22          HD11      LEU  22   7.355   5.417  -7.993
  168   2HD1  LEU  22          HD12      LEU  22   7.578   5.425  -6.240
  169   3HD1  LEU  22          HD13      LEU  22   8.238   6.733  -7.231
  170   1HD2  LEU  22          HD21      LEU  22   6.923   8.301  -5.641
  171   2HD2  LEU  22          HD22      LEU  22   6.262   6.881  -4.830
  172   3HD2  LEU  22          HD23      LEU  22   5.178   8.088  -5.522
  173    H    ALA  23           HN       ALA  23   7.004  11.120  -9.409
  174    HA   ALA  23           HA       ALA  23   6.790  10.206 -12.084
  175   1HB   ALA  23          HB1       ALA  23   5.583  12.230 -11.478
  176   2HB   ALA  23          HB2       ALA  23   6.807  12.626 -12.687
  177   3HB   ALA  23          HB3       ALA  23   7.086  13.012 -10.988
  178    H    GLY  24           HN       GLY  24   8.746   9.046 -12.167
  179   1HA   GLY  24          HA2       GLY  24  10.940   9.776 -13.355
  180   2HA   GLY  24          HA1       GLY  24  11.197  10.562 -11.793
  181    H    ILE  25           HN       ILE  25   9.508   8.097 -10.835
  182    HA   ILE  25           HA       ILE  25  11.832   6.353 -10.591
  183    HB   ILE  25           HB       ILE  25   9.659   6.874  -8.501
  184   1HG1  ILE  25          HG12      ILE  25  11.664   7.518  -7.035
  185   2HG1  ILE  25          HG11      ILE  25  12.610   7.557  -8.511
  186   1HG2  ILE  25          HG21      ILE  25  10.254   4.536  -8.461
  187   2HG2  ILE  25          HG22      ILE  25  10.876   5.347  -7.023
  188   3HG2  ILE  25          HG23      ILE  25  11.967   4.942  -8.346
  189   1HD1  ILE  25          HD11      ILE  25  11.179   9.351  -9.367
  190   2HD1  ILE  25          HD12      ILE  25  11.916   9.787  -7.822
  191   3HD1  ILE  25          HD13      ILE  25  10.226   9.292  -7.884
  192    H    ASN  26           HN       ASN  26  11.484   4.252 -10.923
  193    HA   ASN  26           HA       ASN  26   9.480   3.411 -12.660
  194   1HB   ASN  26          HB2       ASN  26  11.363   1.853 -10.926
  195   2HB   ASN  26          HB1       ASN  26  10.185   1.064 -11.966
  196   1HD2  ASN  26          HD21      ASN  26  10.483   1.070 -14.126
  197   2HD2  ASN  26          HD22      ASN  26  11.944   1.579 -14.887
  198    H    LEU  27           HN       LEU  27   7.549   2.606 -12.491
  199    HA   LEU  27           HA       LEU  27   6.375   2.160  -9.826
  200   1HB   LEU  27          HB2       LEU  27   5.032   2.451 -12.524
  201   2HB   LEU  27          HB1       LEU  27   4.261   2.478 -10.953
  202    HG   LEU  27           HG       LEU  27   6.142   4.613 -11.979
  203   1HD1  LEU  27          HD11      LEU  27   4.066   4.573 -13.245
  204   2HD1  LEU  27          HD12      LEU  27   4.143   5.990 -12.197
  205   3HD1  LEU  27          HD13      LEU  27   3.143   4.610 -11.744
  206   1HD2  LEU  27          HD21      LEU  27   5.367   5.906 -10.092
  207   2HD2  LEU  27          HD22      LEU  27   6.077   4.394  -9.516
  208   3HD2  LEU  27          HD23      LEU  27   4.323   4.592  -9.588
  209    H    ASP  28           HN       ASP  28   7.921   0.547 -12.165
  210    HA   ASP  28           HA       ASP  28   6.151  -1.809 -12.194
  211   1HB   ASP  28          HB2       ASP  28   7.312  -2.467 -14.250
  212   2HB   ASP  28          HB1       ASP  28   6.615  -0.859 -14.403
  213    H    SER  29           HN       SER  29   8.823  -0.689 -10.656
  214    HA   SER  29           HA       SER  29  10.347  -3.140 -10.793
  215   1HB   SER  29          HB2       SER  29  10.826  -0.569  -9.301
  216   2HB   SER  29          HB1       SER  29  11.956  -1.914  -9.368
  217    HG   SER  29           HG       SER  29  12.448  -0.338 -10.868
  218    H    SER  30           HN       SER  30  10.188  -4.698  -9.399
  219    HA   SER  30           HA       SER  30   8.425  -4.928  -7.271
  220   1HB   SER  30          HB2       SER  30  11.084  -6.263  -7.775
  221   2HB   SER  30          HB1       SER  30   9.941  -6.831  -6.575
  222    HG   SER  30           HG       SER  30   9.537  -6.637  -9.399
  223    H    LEU  31           HN       LEU  31   8.656  -4.613  -5.010
  224    HA   LEU  31           HA       LEU  31  10.112  -2.472  -4.026
  225   1HB   LEU  31          HB2       LEU  31   8.118  -3.739  -2.961
  226   2HB   LEU  31          HB1       LEU  31   9.325  -4.834  -2.323
  227    HG   LEU  31           HG       LEU  31  10.314  -2.959  -1.069
  228   1HD1  LEU  31          HD11      LEU  31   7.981  -1.424  -2.206
  229   2HD1  LEU  31          HD12      LEU  31   9.680  -1.163  -2.615
  230   3HD1  LEU  31          HD13      LEU  31   9.104  -0.832  -0.981
  231   1HD2  LEU  31          HD21      LEU  31   8.490  -2.690   0.518
  232   2HD2  LEU  31          HD22      LEU  31   8.567  -4.356  -0.059
  233   3HD2  LEU  31          HD23      LEU  31   7.338  -3.259  -0.689
  234    H    ALA  32           HN       ALA  32  11.022  -5.778  -4.369
  235    HA   ALA  32           HA       ALA  32  13.222  -5.858  -2.743
  236   1HB   ALA  32          HB1       ALA  32  12.200  -7.829  -3.690
  237   2HB   ALA  32          HB2       ALA  32  13.929  -7.801  -4.041
  238   3HB   ALA  32          HB3       ALA  32  12.766  -7.374  -5.297
  239    H    ASP  33           HN       ASP  33  12.827  -4.730  -6.061
  240    HA   ASP  33           HA       ASP  33  15.596  -4.702  -6.732
  241   1HB   ASP  33          HB2       ASP  33  13.962  -4.851  -8.529
  242   2HB   ASP  33          HB1       ASP  33  13.243  -3.318  -8.045
  243    H    LEU  34           HN       LEU  34  13.314  -2.560  -5.424
  244    HA   LEU  34           HA       LEU  34  14.857  -0.158  -5.321
  245   1HB   LEU  34          HB2       LEU  34  12.531  -1.219  -3.718
  246   2HB   LEU  34          HB1       LEU  34  13.245   0.337  -3.406
  247    HG   LEU  34           HG       LEU  34  12.282   1.283  -5.378
  248   1HD1  LEU  34          HD11      LEU  34  11.552  -1.507  -6.278
  249   2HD1  LEU  34          HD12      LEU  34  12.847  -0.532  -6.970
  250   3HD1  LEU  34          HD13      LEU  34  11.171   0.000  -7.113
  251   1HD2  LEU  34          HD21      LEU  34  10.728   0.902  -3.606
  252   2HD2  LEU  34          HD22      LEU  34  10.495  -0.746  -4.168
  253   3HD2  LEU  34          HD23      LEU  34   9.912   0.606  -5.161
  254    H    GLY  35           HN       GLY  35  14.018  -2.722  -3.069
  255   1HA   GLY  35          HA2       GLY  35  15.517  -3.791  -1.628
  256   2HA   GLY  35          HA1       GLY  35  16.541  -2.353  -1.669
  257    H    LEU  36           HN       LEU  36  13.685  -3.799  -0.330
  258    HA   LEU  36           HA       LEU  36  13.094  -1.460   1.203
  259   1HB   LEU  36          HB2       LEU  36  11.247  -2.725   2.147
  260   2HB   LEU  36          HB1       LEU  36  11.348  -3.164   0.500
  261    HG   LEU  36           HG       LEU  36  12.778  -5.195   1.492
  262   1HD1  LEU  36          HD11      LEU  36  10.877  -4.457   3.696
  263   2HD1  LEU  36          HD12      LEU  36  12.640  -4.432   3.793
  264   3HD1  LEU  36          HD13      LEU  36  11.784  -5.968   3.589
  265   1HD2  LEU  36          HD21      LEU  36   9.766  -5.046   1.487
  266   2HD2  LEU  36          HD22      LEU  36  10.731  -6.523   1.410
  267   3HD2  LEU  36          HD23      LEU  36  10.785  -5.354   0.086
  268    H    ASP  37           HN       ASP  37  13.880  -0.946   3.153
  269    HA   ASP  37           HA       ASP  37  16.375  -2.069   3.803
  270   1HB   ASP  37          HB2       ASP  37  16.550  -0.426   5.563
  271   2HB   ASP  37          HB1       ASP  37  15.765   0.340   4.195
  272    H    SER  38           HN       SER  38  13.477  -1.987   5.728
  273    HA   SER  38           HA       SER  38  13.236  -4.601   6.519
  274   1HB   SER  38          HB2       SER  38  15.490  -4.252   7.641
  275   2HB   SER  38          HB1       SER  38  14.763  -2.970   8.601
  276    HG   SER  38           HG       SER  38  13.330  -5.319   8.760
  277    H    LEU  39           HN       LEU  39  13.277  -1.218   7.597
  278    HA   LEU  39           HA       LEU  39  10.987  -1.386   9.242
  279   1HB   LEU  39          HB2       LEU  39  12.791   0.379   9.353
  280   2HB   LEU  39          HB1       LEU  39  12.171   1.037   7.861
  281    HG   LEU  39           HG       LEU  39  11.573   2.291   9.965
  282   1HD1  LEU  39          HD11      LEU  39  10.311   2.670   7.937
  283   2HD1  LEU  39          HD12      LEU  39   9.265   2.750   9.356
  284   3HD1  LEU  39          HD13      LEU  39   9.249   1.318   8.327
  285   1HD2  LEU  39          HD21      LEU  39  11.172   0.400  11.424
  286   2HD2  LEU  39          HD22      LEU  39   9.795  -0.094  10.441
  287   3HD2  LEU  39          HD23      LEU  39   9.738   1.423  11.334
  288    H    MET  40           HN       MET  40  11.604  -0.586   5.896
  289    HA   MET  40           HA       MET  40   9.021   0.113   5.022
  290   1HB   MET  40          HB2       MET  40  11.081  -1.550   3.579
  291   2HB   MET  40          HB1       MET  40   9.671  -0.811   2.834
  292   1HG   MET  40          HG2       MET  40  10.508   1.395   3.384
  293   2HG   MET  40          HG1       MET  40  11.899   0.675   4.191
  294   1HE   MET  40          HE1       MET  40  10.068   1.283   0.786
  295   2HE   MET  40          HE2       MET  40  10.162  -0.475   0.851
  296   3HE   MET  40          HE3       MET  40  11.110   0.415  -0.341
  297    H    GLY  41           HN       GLY  41  10.370  -3.139   5.390
  298   1HA   GLY  41          HA2       GLY  41   8.030  -4.452   4.472
  299   2HA   GLY  41          HA1       GLY  41   9.314  -5.179   5.433
  300    H    VAL  42           HN       VAL  42   9.101  -3.392   7.624
  301    HA   VAL  42           HA       VAL  42   7.026  -4.615   9.119
  302    HB   VAL  42           HB       VAL  42   8.645  -2.141   9.815
  303   1HG1  VAL  42          HG11      VAL  42   6.661  -2.265  11.163
  304   2HG1  VAL  42          HG12      VAL  42   8.079  -2.622  12.149
  305   3HG1  VAL  42          HG13      VAL  42   7.019  -3.932  11.616
  306   1HG2  VAL  42          HG21      VAL  42   9.133  -5.020  10.559
  307   2HG2  VAL  42          HG22      VAL  42  10.050  -3.637  11.156
  308   3HG2  VAL  42          HG23      VAL  42  10.093  -4.050   9.442
  309    H    GLU  43           HN       GLU  43   7.455  -1.359   7.849
  310    HA   GLU  43           HA       GLU  43   5.053  -0.343   8.868
  311   1HB   GLU  43          HB2       GLU  43   7.043   0.948   7.979
  312   2HB   GLU  43          HB1       GLU  43   6.426   0.599   6.368
  313   1HG   GLU  43          HG2       GLU  43   5.755   2.765   7.073
  314   2HG   GLU  43          HG1       GLU  43   4.324   1.731   6.940
  315    H    VAL  44           HN       VAL  44   5.866  -1.956   5.863
  316    HA   VAL  44           HA       VAL  44   3.369  -1.623   4.567
  317    HB   VAL  44           HB       VAL  44   5.380  -3.897   4.265
  318   1HG1  VAL  44          HG11      VAL  44   3.191  -4.578   3.542
  319   2HG1  VAL  44          HG12      VAL  44   4.282  -4.365   2.162
  320   3HG1  VAL  44          HG13      VAL  44   3.055  -3.135   2.524
  321   1HG2  VAL  44          HG21      VAL  44   6.280  -1.723   3.617
  322   2HG2  VAL  44          HG22      VAL  44   4.915  -1.468   2.522
  323   3HG2  VAL  44          HG23      VAL  44   6.069  -2.776   2.226
  324    H    ARG  45           HN       ARG  45   4.632  -4.209   6.627
  325    HA   ARG  45           HA       ARG  45   2.279  -5.740   6.610
  326   1HB   ARG  45          HB2       ARG  45   4.639  -5.667   8.447
  327   2HB   ARG  45          HB1       ARG  45   3.266  -6.706   8.798
  328   1HG   ARG  45          HG2       ARG  45   3.564  -7.832   6.653
  329   2HG   ARG  45          HG1       ARG  45   4.925  -6.768   6.286
  330   1HD   ARG  45          HD2       ARG  45   4.818  -8.543   8.710
  331   2HD   ARG  45          HD1       ARG  45   5.507  -9.054   7.170
  332    HE   ARG  45           HE       ARG  45   7.047  -7.136   7.423
  333   1HH1  ARG  45          HH11      ARG  45   5.557  -8.459  10.363
  334   2HH1  ARG  45          HH12      ARG  45   6.874  -8.089  11.363
  335   1HH2  ARG  45          HH21      ARG  45   8.911  -6.773   8.768
  336   2HH2  ARG  45          HH22      ARG  45   8.852  -7.149  10.432
  337    H    GLN  46           HN       GLN  46   3.345  -3.166   8.763
  338    HA   GLN  46           HA       GLN  46   1.077  -3.517  10.416
  339   1HB   GLN  46          HB2       GLN  46   3.017  -1.213  10.272
  340   2HB   GLN  46          HB1       GLN  46   1.690  -1.294  11.423
  341   1HG   GLN  46          HG2       GLN  46   2.603  -3.397  12.298
  342   2HG   GLN  46          HG1       GLN  46   3.966  -3.248  11.195
  343   1HE2  GLN  46          HE21      GLN  46   3.910  -3.384  14.069
  344   2HE2  GLN  46          HE22      GLN  46   4.704  -1.975  14.660
  345    H    ILE  47           HN       ILE  47   1.311  -2.198   7.364
  346    HA   ILE  47           HA       ILE  47  -1.134  -0.695   7.819
  347    HB   ILE  47           HB       ILE  47   0.278  -1.155   5.168
  348   1HG1  ILE  47          HG12      ILE  47   0.195   1.328   6.909
  349   2HG1  ILE  47          HG11      ILE  47   1.579   0.249   6.767
  350   1HG2  ILE  47          HG21      ILE  47  -2.132  -0.783   4.952
  351   2HG2  ILE  47          HG22      ILE  47  -1.247   0.619   4.348
  352   3HG2  ILE  47          HG23      ILE  47  -2.011   0.669   5.941
  353   1HD1  ILE  47          HD11      ILE  47   1.854   2.245   5.409
  354   2HD1  ILE  47          HD12      ILE  47   0.370   1.867   4.534
  355   3HD1  ILE  47          HD13      ILE  47   1.768   0.801   4.404
  356    H    LEU  48           HN       LEU  48  -0.107  -3.302   5.624
  357    HA   LEU  48           HA       LEU  48  -2.797  -3.881   4.991
  358   1HB   LEU  48          HB2       LEU  48  -0.305  -5.500   4.511
  359   2HB   LEU  48          HB1       LEU  48  -1.887  -6.026   3.989
  360    HG   LEU  48           HG       LEU  48  -0.845  -5.131   2.103
  361   1HD1  LEU  48          HD11      LEU  48  -2.710  -3.034   3.148
  362   2HD1  LEU  48          HD12      LEU  48  -3.131  -4.490   2.246
  363   3HD1  LEU  48          HD13      LEU  48  -2.204  -3.210   1.467
  364   1HD2  LEU  48          HD21      LEU  48  -0.148  -2.672   3.694
  365   2HD2  LEU  48          HD22      LEU  48   0.141  -2.888   1.967
  366   3HD2  LEU  48          HD23      LEU  48   0.976  -3.911   3.136
  367    H    GLU  49           HN       GLU  49  -0.512  -5.645   7.034
  368    HA   GLU  49           HA       GLU  49  -2.451  -7.600   7.730
  369   1HB   GLU  49          HB2       GLU  49  -0.046  -8.099   7.673
  370   2HB   GLU  49          HB1       GLU  49   0.220  -6.986   9.008
  371   1HG   GLU  49          HG2       GLU  49  -1.277  -8.433  10.387
  372   2HG   GLU  49          HG1       GLU  49  -1.290  -9.579   9.048
  373    H    ARG  50           HN       ARG  50  -1.210  -4.717   9.299
  374    HA   ARG  50           HA       ARG  50  -2.757  -5.309  11.662
  375   1HB   ARG  50          HB2       ARG  50  -0.547  -4.353  11.925
  376   2HB   ARG  50          HB1       ARG  50  -1.031  -2.927  11.029
  377   1HG   ARG  50          HG2       ARG  50  -0.944  -2.442  13.384
  378   2HG   ARG  50          HG1       ARG  50  -2.610  -2.363  12.820
  379   1HD   ARG  50          HD2       ARG  50  -3.074  -4.533  13.771
  380   2HD   ARG  50          HD1       ARG  50  -1.373  -4.729  14.212
  381    HE   ARG  50           HE       ARG  50  -1.784  -2.630  15.582
  382   1HH1  ARG  50          HH11      ARG  50  -4.295  -5.086  15.062
  383   2HH1  ARG  50          HH12      ARG  50  -5.059  -4.823  16.562
  384   1HH2  ARG  50          HH21      ARG  50  -2.788  -2.361  17.704
  385   2HH2  ARG  50          HH22      ARG  50  -4.185  -3.252  18.107
  386    H    GLU  51           HN       GLU  51  -2.852  -2.578   9.298
  387    HA   GLU  51           HA       GLU  51  -5.016  -1.237  10.508
  388   1HB   GLU  51          HB2       GLU  51  -4.171  -1.228   7.612
  389   2HB   GLU  51          HB1       GLU  51  -5.301  -0.102   8.334
  390   1HG   GLU  51          HG2       GLU  51  -2.456  -0.361   9.258
  391   2HG   GLU  51          HG1       GLU  51  -2.968   0.761   7.994
  392    H    HIS  52           HN       HIS  52  -4.956  -3.378   7.693
  393    HA   HIS  52           HA       HIS  52  -7.892  -3.288   7.653
  394   1HB   HIS  52          HB2       HIS  52  -6.494  -2.773   5.606
  395   2HB   HIS  52          HB1       HIS  52  -6.054  -4.474   5.573
  396    HD1  HIS  52           HD1      HIS  52  -8.588  -2.114   4.452
  397    HD2  HIS  52           HD2      HIS  52  -8.348  -6.224   5.017
  398    HE1  HIS  52           HE1      HIS  52 -10.570  -3.084   3.267
  399    HE2  HIS  52           HE2      HIS  52 -10.558  -5.495   3.906
  400    H    ASP  53           HN       ASP  53  -5.367  -5.305   8.627
  401    HA   ASP  53           HA       ASP  53  -5.077  -7.458   9.126
  402   1HB   ASP  53          HB2       ASP  53  -7.051  -7.304  10.606
  403   2HB   ASP  53          HB1       ASP  53  -8.113  -7.626   9.243
  404    H    LEU  54           HN       LEU  54  -4.174  -7.545   7.226
  405    HA   LEU  54           HA       LEU  54  -5.320  -9.399   5.296
  406   1HB   LEU  54          HB2       LEU  54  -5.871  -7.117   4.596
  407   2HB   LEU  54          HB1       LEU  54  -4.190  -6.668   4.746
  408    HG   LEU  54           HG       LEU  54  -3.634  -8.130   2.866
  409   1HD1  LEU  54          HD11      LEU  54  -6.626  -8.577   2.731
  410   2HD1  LEU  54          HD12      LEU  54  -5.432  -9.793   3.182
  411   3HD1  LEU  54          HD13      LEU  54  -5.442  -9.134   1.546
  412   1HD2  LEU  54          HD21      LEU  54  -4.195  -5.796   2.610
  413   2HD2  LEU  54          HD22      LEU  54  -5.888  -6.225   2.444
  414   3HD2  LEU  54          HD23      LEU  54  -4.726  -6.729   1.193
  415    H    VAL  55           HN       VAL  55  -3.765 -10.889   5.962
  416    HA   VAL  55           HA       VAL  55  -1.136 -10.056   6.632
  417    HB   VAL  55           HB       VAL  55  -2.159 -12.877   6.244
  418   1HG1  VAL  55          HG11      VAL  55   0.325 -11.881   7.643
  419   2HG1  VAL  55          HG12      VAL  55   0.275 -12.771   6.121
  420   3HG1  VAL  55          HG13      VAL  55  -0.240 -13.552   7.616
  421   1HG2  VAL  55          HG21      VAL  55  -2.354 -12.914   8.688
  422   2HG2  VAL  55          HG22      VAL  55  -3.404 -11.696   7.963
  423   3HG2  VAL  55          HG23      VAL  55  -1.899 -11.211   8.745
  424    H    LEU  56           HN       LEU  56  -0.321  -9.057   4.847
  425    HA   LEU  56           HA       LEU  56   0.430 -10.819   2.647
  426   1HB   LEU  56          HB2       LEU  56   0.848  -7.847   2.967
  427   2HB   LEU  56          HB1       LEU  56   1.299  -8.779   1.564
  428    HG   LEU  56           HG       LEU  56  -1.521  -8.240   2.504
  429   1HD1  LEU  56          HD11      LEU  56  -1.702  -6.993   0.415
  430   2HD1  LEU  56          HD12      LEU  56  -0.002  -7.316   0.075
  431   3HD1  LEU  56          HD13      LEU  56  -0.451  -6.328   1.464
  432   1HD2  LEU  56          HD21      LEU  56  -2.224  -9.384   0.457
  433   2HD2  LEU  56          HD22      LEU  56  -1.346 -10.470   1.533
  434   3HD2  LEU  56          HD23      LEU  56  -0.547  -9.801   0.111
  435    HA   PRO  57           HA       PRO  57   4.245 -11.226   5.006
  436   1HB   PRO  57          HB2       PRO  57   4.740 -13.322   3.056
  437   2HB   PRO  57          HB1       PRO  57   4.580 -13.462   4.806
  438   1HG   PRO  57          HG2       PRO  57   2.705 -14.434   3.151
  439   2HG   PRO  57          HG1       PRO  57   2.234 -13.632   4.667
  440   1HD   PRO  57          HD2       PRO  57   2.339 -12.499   1.890
  441   2HD   PRO  57          HD1       PRO  57   1.020 -12.420   3.087
  442    H    ILE  58           HN       ILE  58   6.594 -11.388   4.336
  443    HA   ILE  58           HA       ILE  58   7.153  -9.328   2.502
  444    HB   ILE  58           HB       ILE  58   9.109 -11.304   3.762
  445   1HG1  ILE  58          HG12      ILE  58   9.876  -9.229   5.023
  446   2HG1  ILE  58          HG11      ILE  58   8.479  -8.404   4.353
  447   1HG2  ILE  58          HG21      ILE  58  10.058 -10.552   1.656
  448   2HG2  ILE  58          HG22      ILE  58  10.950  -9.839   2.993
  449   3HG2  ILE  58          HG23      ILE  58   9.795  -8.871   2.084
  450   1HD1  ILE  58          HD11      ILE  58   7.010  -9.948   5.538
  451   2HD1  ILE  58          HD12      ILE  58   8.099  -9.105   6.642
  452   3HD1  ILE  58          HD13      ILE  58   8.420 -10.780   6.196
  453    H    ARG  59           HN       ARG  59   7.178 -12.775   2.130
  454    HA   ARG  59           HA       ARG  59   8.338 -12.863  -0.405
  455   1HB   ARG  59          HB2       ARG  59   7.156 -15.055  -0.785
  456   2HB   ARG  59          HB1       ARG  59   8.094 -14.973   0.694
  457   1HG   ARG  59          HG2       ARG  59   5.188 -14.352   0.808
  458   2HG   ARG  59          HG1       ARG  59   5.691 -16.030   0.615
  459   1HD   ARG  59          HD2       ARG  59   6.812 -14.276   2.789
  460   2HD   ARG  59          HD1       ARG  59   5.295 -15.146   2.986
  461    HE   ARG  59           HE       ARG  59   6.918 -17.077   2.200
  462   1HH1  ARG  59          HH11      ARG  59   7.369 -14.598   4.730
  463   2HH1  ARG  59          HH12      ARG  59   8.289 -15.630   5.725
  464   1HH2  ARG  59          HH21      ARG  59   8.120 -18.479   3.679
  465   2HH2  ARG  59          HH22      ARG  59   8.616 -17.855   5.187
  466    H    GLU  60           HN       GLU  60   5.337 -11.495   0.372
  467    HA   GLU  60           HA       GLU  60   4.771 -11.319  -2.498
  468   1HB   GLU  60          HB2       GLU  60   2.852 -11.198  -0.190
  469   2HB   GLU  60          HB1       GLU  60   2.421 -10.646  -1.804
  470   1HG   GLU  60          HG2       GLU  60   3.001 -12.892  -2.659
  471   2HG   GLU  60          HG1       GLU  60   3.263 -13.415  -0.997
  472    H    VAL  61           HN       VAL  61   5.358  -9.584   0.382
  473    HA   VAL  61           HA       VAL  61   4.679  -7.016  -0.571
  474    HB   VAL  61           HB       VAL  61   6.428  -7.945   1.724
  475   1HG1  VAL  61          HG11      VAL  61   5.606  -5.111   1.095
  476   2HG1  VAL  61          HG12      VAL  61   7.247  -5.755   1.013
  477   3HG1  VAL  61          HG13      VAL  61   6.418  -5.649   2.566
  478   1HG2  VAL  61          HG21      VAL  61   4.567  -7.163   3.093
  479   2HG2  VAL  61          HG22      VAL  61   4.051  -8.389   1.929
  480   3HG2  VAL  61          HG23      VAL  61   3.695  -6.690   1.635
  481    H    ARG  62           HN       ARG  62   7.540  -8.963  -0.738
  482    HA   ARG  62           HA       ARG  62   9.328  -6.875  -1.353
  483   1HB   ARG  62          HB2       ARG  62   9.862  -9.110  -0.321
  484   2HB   ARG  62          HB1       ARG  62   9.668  -9.826  -1.909
  485   1HG   ARG  62          HG2       ARG  62  11.523  -8.543  -2.742
  486   2HG   ARG  62          HG1       ARG  62  11.675  -7.713  -1.198
  487   1HD   ARG  62          HD2       ARG  62  12.216  -9.827  -0.099
  488   2HD   ARG  62          HD1       ARG  62  12.004 -10.681  -1.630
  489    HE   ARG  62           HE       ARG  62  13.851  -8.945  -2.321
  490   1HH1  ARG  62          HH11      ARG  62  13.735 -10.909   0.640
  491   2HH1  ARG  62          HH12      ARG  62  15.414 -11.008   0.795
  492   1HH2  ARG  62          HH21      ARG  62  16.134  -9.101  -2.101
  493   2HH2  ARG  62          HH22      ARG  62  16.828  -9.984  -0.808
  494    H    GLN  63           HN       GLN  63   6.890  -8.174  -3.272
  495    HA   GLN  63           HA       GLN  63   8.352  -7.302  -5.661
  496   1HB   GLN  63          HB2       GLN  63   6.867  -8.613  -7.112
  497   2HB   GLN  63          HB1       GLN  63   7.721  -9.640  -5.981
  498   1HG   GLN  63          HG2       GLN  63   5.018  -8.747  -5.188
  499   2HG   GLN  63          HG1       GLN  63   5.118  -9.863  -6.544
  500   1HE2  GLN  63          HE21      GLN  63   7.482  -9.984  -4.014
  501   2HE2  GLN  63          HE22      GLN  63   6.889 -11.442  -3.285
  502    H    LEU  64           HN       LEU  64   6.420  -6.034  -3.544
  503    HA   LEU  64           HA       LEU  64   4.316  -4.996  -5.138
  504   1HB   LEU  64          HB2       LEU  64   5.501  -3.931  -2.569
  505   2HB   LEU  64          HB1       LEU  64   4.005  -3.381  -3.292
  506    HG   LEU  64           HG       LEU  64   4.519  -6.139  -2.192
  507   1HD1  LEU  64          HD11      LEU  64   2.844  -3.877  -1.141
  508   2HD1  LEU  64          HD12      LEU  64   4.355  -4.473  -0.451
  509   3HD1  LEU  64          HD13      LEU  64   2.923  -5.502  -0.461
  510   1HD2  LEU  64          HD21      LEU  64   2.129  -6.502  -2.537
  511   2HD2  LEU  64          HD22      LEU  64   2.966  -6.202  -4.059
  512   3HD2  LEU  64          HD23      LEU  64   2.003  -4.924  -3.318
  513    H    THR  65           HN       THR  65   4.436  -3.423  -6.644
  514    HA   THR  65           HA       THR  65   6.978  -2.291  -7.296
  515    HB   THR  65           HB       THR  65   5.645  -1.501  -9.265
  516    HG1  THR  65           HG1      THR  65   3.526  -1.498  -8.941
  517   1HG2  THR  65          HG21      THR  65   5.352  -4.382  -8.481
  518   2HG2  THR  65          HG22      THR  65   6.803  -3.681  -9.209
  519   3HG2  THR  65          HG23      THR  65   5.290  -3.767 -10.135
  520    H    LEU  66           HN       LEU  66   5.872  -1.263  -4.889
  521    HA   LEU  66           HA       LEU  66   5.640   0.646  -3.703
  522   1HB   LEU  66          HB2       LEU  66   7.632   1.252  -5.214
  523   2HB   LEU  66          HB1       LEU  66   6.500   2.154  -6.188
  524    HG   LEU  66           HG       LEU  66   7.818   3.593  -4.710
  525   1HD1  LEU  66          HD11      LEU  66   6.003   4.875  -3.690
  526   2HD1  LEU  66          HD12      LEU  66   4.929   3.487  -3.963
  527   3HD1  LEU  66          HD13      LEU  66   5.619   4.342  -5.337
  528   1HD2  LEU  66          HD21      LEU  66   7.478   3.545  -2.285
  529   2HD2  LEU  66          HD22      LEU  66   8.204   2.052  -2.881
  530   3HD2  LEU  66          HD23      LEU  66   6.492   2.092  -2.457
  531    H    ARG  67           HN       ARG  67   4.416   1.411  -6.954
  532    HA   ARG  67           HA       ARG  67   2.255   2.864  -5.728
  533   1HB   ARG  67          HB2       ARG  67   3.116   2.528  -8.563
  534   2HB   ARG  67          HB1       ARG  67   1.510   3.148  -8.197
  535   1HG   ARG  67          HG2       ARG  67   4.097   4.332  -7.213
  536   2HG   ARG  67          HG1       ARG  67   3.121   4.948  -8.551
  537   1HD   ARG  67          HD2       ARG  67   1.214   5.136  -6.955
  538   2HD   ARG  67          HD1       ARG  67   2.328   4.709  -5.672
  539    HE   ARG  67           HE       ARG  67   3.396   6.767  -5.892
  540   1HH1  ARG  67          HH11      ARG  67   0.722   6.483  -8.247
  541   2HH1  ARG  67          HH12      ARG  67   0.438   8.153  -8.336
  542   1HH2  ARG  67          HH21      ARG  67   2.953   9.148  -6.016
  543   2HH2  ARG  67          HH22      ARG  67   1.695   9.664  -7.013
  544    H    LYS  68           HN       LYS  68   2.741  -0.289  -6.690
  545    HA   LYS  68           HA       LYS  68   0.121  -1.132  -7.263
  546   1HB   LYS  68          HB2       LYS  68   2.177  -2.563  -7.413
  547   2HB   LYS  68          HB1       LYS  68   2.209  -2.630  -5.660
  548   1HG   LYS  68          HG2       LYS  68   0.028  -3.758  -5.682
  549   2HG   LYS  68          HG1       LYS  68   0.044  -3.712  -7.448
  550   1HD   LYS  68          HD2       LYS  68   2.109  -5.043  -7.448
  551   2HD   LYS  68          HD1       LYS  68   2.058  -5.103  -5.685
  552   1HE   LYS  68          HE2       LYS  68  -0.112  -6.245  -5.802
  553   2HE   LYS  68          HE1       LYS  68  -0.027  -6.206  -7.560
  554   1HZ   LYS  68          HZ1       LYS  68   1.802  -7.693  -5.737
  555   2HZ   LYS  68          HZ2       LYS  68   2.053  -7.524  -7.379
  556   3HZ   LYS  68          HZ3       LYS  68   0.667  -8.324  -6.804
  557    H    LEU  69           HN       LEU  69   1.754  -0.274  -4.379
  558    HA   LEU  69           HA       LEU  69   0.129  -1.292  -2.369
  559   1HB   LEU  69          HB2       LEU  69   1.847   1.160  -2.455
  560   2HB   LEU  69          HB1       LEU  69   0.840   0.846  -1.063
  561    HG   LEU  69           HG       LEU  69   3.074   0.135  -0.600
  562   1HD1  LEU  69          HD11      LEU  69   1.283  -2.223  -1.037
  563   2HD1  LEU  69          HD12      LEU  69   1.337  -1.176   0.383
  564   3HD1  LEU  69          HD13      LEU  69   2.718  -2.200  -0.012
  565   1HD2  LEU  69          HD21      LEU  69   4.197  -1.641  -1.858
  566   2HD2  LEU  69          HD22      LEU  69   3.893  -0.228  -2.865
  567   3HD2  LEU  69          HD23      LEU  69   2.868  -1.656  -3.017
  568    H    GLN  70           HN       GLN  70  -0.396   1.630  -4.290
  569    HA   GLN  70           HA       GLN  70  -2.727   2.245  -2.660
  570   1HB   GLN  70          HB2       GLN  70  -2.970   4.213  -4.283
  571   2HB   GLN  70          HB1       GLN  70  -1.635   4.231  -3.137
  572   1HG   GLN  70          HG2       GLN  70  -0.080   3.671  -4.798
  573   2HG   GLN  70          HG1       GLN  70  -1.349   3.260  -5.954
  574   1HE2  GLN  70          HE21      GLN  70  -2.205   4.820  -7.141
  575   2HE2  GLN  70          HE22      GLN  70  -1.651   6.453  -7.158
  576    H    GLU  71           HN       GLU  71  -2.265   0.148  -5.047
  577    HA   GLU  71           HA       GLU  71  -4.935   0.685  -6.135
  578   1HB   GLU  71          HB2       GLU  71  -2.967   0.468  -7.738
  579   2HB   GLU  71          HB1       GLU  71  -2.905  -1.233  -7.293
  580   1HG   GLU  71          HG2       GLU  71  -4.115  -0.881  -9.380
  581   2HG   GLU  71          HG1       GLU  71  -5.156  -1.561  -8.128
  582    H    MET  72           HN       MET  72  -2.966  -1.498  -4.374
  583    HA   MET  72           HA       MET  72  -5.295  -3.264  -3.991
  584   1HB   MET  72          HB2       MET  72  -3.745  -5.014  -3.304
  585   2HB   MET  72          HB1       MET  72  -3.259  -4.405  -4.877
  586   1HG   MET  72          HG2       MET  72  -1.512  -3.062  -3.787
  587   2HG   MET  72          HG1       MET  72  -1.997  -3.730  -2.228
  588   1HE   MET  72          HE1       MET  72  -1.802  -6.354  -1.637
  589   2HE   MET  72          HE2       MET  72  -1.165  -7.551  -2.761
  590   3HE   MET  72          HE3       MET  72  -2.696  -6.744  -3.106
  591    H    SER  73           HN       SER  73  -4.705  -0.656  -2.815
  592    HA   SER  73           HA       SER  73  -3.688  -0.898  -0.220
  593   1HB   SER  73          HB2       SER  73  -4.751   1.409  -0.004
  594   2HB   SER  73          HB1       SER  73  -3.591   1.189  -1.299
  595    HG   SER  73           HG       SER  73  -5.463   2.237  -2.116
  596    H    SER  74           HN       SER  74  -6.974  -0.665  -1.510
  597    HA   SER  74           HA       SER  74  -9.001  -1.388  -0.759
  598   1HB   SER  74          HB2       SER  74  -7.635  -3.539  -0.622
  599   2HB   SER  74          HB1       SER  74  -7.372  -3.173   1.079
  600    HG   SER  74           HG       SER  74  -9.191  -4.616   0.282
  601    H    LYS  75           HN       LYS  75  -7.931   0.951   0.403
  602    HA   LYS  75           HA       LYS  75  -7.942   0.735   3.246
  603   1HB   LYS  75          HB2       LYS  75  -8.144   3.310   1.694
  604   2HB   LYS  75          HB1       LYS  75  -7.565   3.091   3.343
  605   1HG   LYS  75          HG2       LYS  75  -5.788   1.565   2.275
  606   2HG   LYS  75          HG1       LYS  75  -6.242   2.354   0.769
  607   1HD   LYS  75          HD2       LYS  75  -5.140   3.641   3.254
  608   2HD   LYS  75          HD1       LYS  75  -4.327   3.443   1.711
  609   1HE   LYS  75          HE2       LYS  75  -6.683   5.210   2.332
  610   2HE   LYS  75          HE1       LYS  75  -5.008   5.667   2.009
  611   1HZ   LYS  75          HZ1       LYS  75  -5.299   4.744  -0.275
  612   2HZ   LYS  75          HZ2       LYS  75  -6.263   6.077   0.074
  613   3HZ   LYS  75          HZ3       LYS  75  -6.971   4.568   0.039
  614    H    ALA  76           HN       ALA  76 -10.319   1.540   0.865
  615    HA   ALA  76           HA       ALA  76 -12.224   1.813   3.055
  616   1HB   ALA  76          HB1       ALA  76 -12.029   3.885   1.751
  617   2HB   ALA  76          HB2       ALA  76 -13.628   3.156   1.582
  618   3HB   ALA  76          HB3       ALA  76 -12.445   2.996   0.285
  619    H    GLY  77           HN       GLY  77 -12.616  -0.364   3.241
  620   1HA   GLY  77          HA2       GLY  77 -13.338  -1.990   0.960
  621   2HA   GLY  77          HA1       GLY  77 -13.341  -2.482   2.649
  622    H    SER  78           HN       SER  78 -14.912   0.393   2.095
  623    HA   SER  78           HA       SER  78 -17.519  -0.641   2.645
  624   1HB   SER  78          HB2       SER  78 -17.946   1.872   2.554
  625   2HB   SER  78          HB1       SER  78 -16.823   1.302   3.794
  626    HG   SER  78           HG       SER  78 -15.703   2.911   2.877
  627    H    ASP  79           HN       ASP  79 -15.599  -0.163  -0.038
  628    HA   ASP  79           HA       ASP  79 -15.796   0.192  -2.226
  629   1HB   ASP  79          HB2       ASP  79 -17.222  -1.907  -2.028
  630   2HB   ASP  79          HB1       ASP  79 -18.638  -0.860  -1.993
  631    H    THR  80           HN       THR  80 -15.835   2.369  -1.078
  632    HA   THR  80           HA       THR  80 -18.150   3.899  -1.823
  633    HB   THR  80           HB       THR  80 -16.643   5.739  -0.722
  634    HG1  THR  80           HG1      THR  80 -15.612   3.697   0.825
  635   1HG2  THR  80          HG21      THR  80 -17.841   3.457   0.861
  636   2HG2  THR  80          HG22      THR  80 -18.727   4.840   0.223
  637   3HG2  THR  80          HG23      THR  80 -17.509   5.075   1.477
  638    H    GLU  81           HN       GLU  81 -15.594   2.740  -3.320
  639    HA   GLU  81           HA       GLU  81 -14.783   4.954  -4.950
  640   1HB   GLU  81          HB2       GLU  81 -14.640   1.989  -5.594
  641   2HB   GLU  81          HB1       GLU  81 -13.642   3.269  -6.258
  642   1HG   GLU  81          HG2       GLU  81 -13.564   2.252  -3.422
  643   2HG   GLU  81          HG1       GLU  81 -12.411   1.863  -4.693
  644    H    LEU  82           HN       LEU  82 -16.714   5.824  -5.775
  645    HA   LEU  82           HA       LEU  82 -18.443   3.965  -7.272
  646   1HB   LEU  82          HB2       LEU  82 -19.557   4.749  -5.277
  647   2HB   LEU  82          HB1       LEU  82 -19.197   6.412  -5.686
  648    HG   LEU  82           HG       LEU  82 -20.686   6.203  -7.669
  649   1HD1  LEU  82          HD11      LEU  82 -20.560   3.818  -8.010
  650   2HD1  LEU  82          HD12      LEU  82 -22.234   4.330  -7.794
  651   3HD1  LEU  82          HD13      LEU  82 -21.377   3.537  -6.473
  652   1HD2  LEU  82          HD21      LEU  82 -21.963   5.566  -5.015
  653   2HD2  LEU  82          HD22      LEU  82 -22.779   6.267  -6.414
  654   3HD2  LEU  82          HD23      LEU  82 -21.509   7.170  -5.589
  655    H    ALA  83           HN       ALA  83 -18.782   4.389  -9.332
  656    HA   ALA  83           HA       ALA  83 -17.827   6.866 -10.472
  657   1HB   ALA  83          HB1       ALA  83 -18.507   5.830 -12.607
  658   2HB   ALA  83          HB2       ALA  83 -19.189   4.466 -11.721
  659   3HB   ALA  83          HB3       ALA  83 -17.449   4.764 -11.681
  660    H    ALA  84           HN       ALA  84 -19.117   8.521 -10.817
  661    HA   ALA  84           HA       ALA  84 -21.945   8.200 -10.115
  662   1HB   ALA  84          HB1       ALA  84 -21.918  10.595  -9.622
  663   2HB   ALA  84          HB2       ALA  84 -20.231  10.687 -10.133
  664   3HB   ALA  84          HB3       ALA  84 -20.670   9.747  -8.706
  665    HA   PRO  85           HA       PRO  85 -22.947   9.419 -14.288
  666   1HB   PRO  85          HB2       PRO  85 -25.633  10.061 -13.638
  667   2HB   PRO  85          HB1       PRO  85 -25.035   8.506 -14.217
  668   1HG   PRO  85          HG2       PRO  85 -26.096   9.012 -11.678
  669   2HG   PRO  85          HG1       PRO  85 -25.159   7.585 -12.150
  670   1HD   PRO  85          HD2       PRO  85 -24.302  10.030 -10.690
  671   2HD   PRO  85          HD1       PRO  85 -23.742   8.352 -10.515
  672    H    LYS  86           HN       LYS  86 -22.246  11.426 -12.036
  673    HA   LYS  86           HA       LYS  86 -22.866  13.765 -13.596
  674   1HB   LYS  86          HB2       LYS  86 -24.698  13.603 -11.879
  675   2HB   LYS  86          HB1       LYS  86 -23.475  13.677 -10.620
  676   1HG   LYS  86          HG2       LYS  86 -22.837  15.907 -11.345
  677   2HG   LYS  86          HG1       LYS  86 -24.019  15.833 -12.651
  678   1HD   LYS  86          HD2       LYS  86 -25.825  15.670 -11.019
  679   2HD   LYS  86          HD1       LYS  86 -24.648  15.704  -9.699
  680   1HE   LYS  86          HE2       LYS  86 -23.915  17.922 -10.397
  681   2HE   LYS  86          HE1       LYS  86 -25.055  17.886 -11.741
  682   1HZ   LYS  86          HZ1       LYS  86 -26.875  17.877 -10.175
  683   2HZ   LYS  86          HZ2       LYS  86 -25.829  19.163  -9.826
  684   3HZ   LYS  86          HZ3       LYS  86 -25.799  17.771  -8.872
  685    H    SER  87           HN       SER  87 -20.572  12.765 -13.786
  686    HA   SER  87           HA       SER  87 -18.819  14.174 -11.910
  687   1HB   SER  87          HB2       SER  87 -18.243  11.795 -13.709
  688   2HB   SER  87          HB1       SER  87 -17.066  12.593 -12.663
  689    HG   SER  87           HG       SER  87 -18.728  12.094 -10.954
  690    H    LYS  88           HN       LYS  88 -17.137  15.419 -12.881
  691    HA   LYS  88           HA       LYS  88 -17.716  15.939 -15.687
  692   1HB   LYS  88          HB2       LYS  88 -17.086  18.284 -15.403
  693   2HB   LYS  88          HB1       LYS  88 -18.476  17.837 -14.438
  694   1HG   LYS  88          HG2       LYS  88 -17.147  17.844 -12.433
  695   2HG   LYS  88          HG1       LYS  88 -15.673  18.113 -13.374
  696   1HD   LYS  88          HD2       LYS  88 -18.029  19.990 -13.219
  697   2HD   LYS  88          HD1       LYS  88 -16.485  20.201 -12.386
  698   1HE   LYS  88          HE2       LYS  88 -15.322  20.346 -14.515
  699   2HE   LYS  88          HE1       LYS  88 -16.818  20.026 -15.383
  700   1HZ   LYS  88          HZ1       LYS  88 -16.265  22.363 -15.384
  701   2HZ   LYS  88          HZ2       LYS  88 -16.295  22.397 -13.679
  702   3HZ   LYS  88          HZ3       LYS  88 -17.708  22.098 -14.528
  703    H    ASN  89           HN       ASN  89 -16.251  15.501 -17.015
  704    HA   ASN  89           HA       ASN  89 -13.452  15.652 -16.170
  705   1HB   ASN  89          HB2       ASN  89 -14.440  13.288 -16.528
  706   2HB   ASN  89          HB1       ASN  89 -14.524  13.728 -18.233
  707   1HD2  ASN  89          HD21      ASN  89 -12.529  12.896 -15.607
  708   2HD2  ASN  89          HD22      ASN  89 -11.047  12.677 -16.476
  Start of MODEL   25
    1   1H    GLY   1          HT1       GLY   1 -11.718   6.086  10.527
    2   2H    GLY   1          HT2       GLY   1 -12.087   4.545   9.931
    3   3H    GLY   1          HT3       GLY   1 -11.948   4.784  11.606
    4   1HA   GLY   1          HA1       GLY   1 -14.240   4.649  11.022
    5   2HA   GLY   1          HA2       GLY   1 -13.847   6.295  11.522
    6    H    ASP   2           HN       ASP   2 -15.590   7.096  10.310
    7    HA   ASP   2           HA       ASP   2 -15.515   6.662   7.416
    8   1HB   ASP   2          HB2       ASP   2 -17.715   6.586   8.685
    9   2HB   ASP   2          HB1       ASP   2 -17.527   8.302   9.004
   10    H    GLY   3           HN       GLY   3 -15.165   8.349   5.933
   11   1HA   GLY   3          HA2       GLY   3 -14.681  10.632   5.463
   12   2HA   GLY   3          HA1       GLY   3 -14.050  10.794   7.107
   13    H    GLU   4           HN       GLU   4 -12.354   9.054   7.581
   14    HA   GLU   4           HA       GLU   4 -10.511   8.834   5.311
   15   1HB   GLU   4          HB2       GLU   4  -9.882   9.036   8.263
   16   2HB   GLU   4          HB1       GLU   4  -8.699   8.762   6.996
   17   1HG   GLU   4          HG2       GLU   4  -9.153  10.951   6.072
   18   2HG   GLU   4          HG1       GLU   4 -10.401  11.220   7.289
   19    H    ALA   5           HN       ALA   5 -10.788   6.839   4.622
   20    HA   ALA   5           HA       ALA   5 -11.674   4.704   6.320
   21   1HB   ALA   5          HB1       ALA   5 -12.264   4.768   3.944
   22   2HB   ALA   5          HB2       ALA   5 -11.369   3.297   4.325
   23   3HB   ALA   5          HB3       ALA   5 -10.560   4.638   3.512
   24    H    GLN   6           HN       GLN   6  -8.716   5.803   4.926
   25    HA   GLN   6           HA       GLN   6  -6.948   4.939   6.888
   26   1HB   GLN   6          HB2       GLN   6  -7.599   2.683   5.877
   27   2HB   GLN   6          HB1       GLN   6  -6.885   3.245   4.377
   28   1HG   GLN   6          HG2       GLN   6  -4.738   3.541   5.640
   29   2HG   GLN   6          HG1       GLN   6  -5.508   2.696   6.985
   30   1HE2  GLN   6          HE21      GLN   6  -6.226   0.580   6.619
   31   2HE2  GLN   6          HE22      GLN   6  -5.417  -0.425   5.449
   32    H    ARG   7           HN       ARG   7  -4.747   5.571   6.106
   33    HA   ARG   7           HA       ARG   7  -4.951   7.350   3.846
   34   1HB   ARG   7          HB2       ARG   7  -2.640   8.001   4.320
   35   2HB   ARG   7          HB1       ARG   7  -3.603   8.077   5.778
   36   1HG   ARG   7          HG2       ARG   7  -2.628   5.934   6.503
   37   2HG   ARG   7          HG1       ARG   7  -1.620   5.928   5.049
   38   1HD   ARG   7          HD2       ARG   7  -0.673   8.089   5.714
   39   2HD   ARG   7          HD1       ARG   7  -1.661   8.062   7.166
   40    HE   ARG   7           HE       ARG   7  -0.118   5.737   7.155
   41   1HH1  ARG   7          HH11      ARG   7   0.347   9.251   7.391
   42   2HH1  ARG   7          HH12      ARG   7   1.787   9.141   8.290
   43   1HH2  ARG   7          HH21      ARG   7   1.806   5.571   8.332
   44   2HH2  ARG   7          HH22      ARG   7   2.686   6.956   8.833
   45    H    ASP   8           HN       ASP   8  -3.547   7.149   1.994
   46    HA   ASP   8           HA       ASP   8  -3.590   4.427   1.101
   47   1HB   ASP   8          HB2       ASP   8  -4.184   6.274  -0.420
   48   2HB   ASP   8          HB1       ASP   8  -2.531   6.872  -0.327
   49    H    LEU   9           HN       LEU   9  -1.722   3.374   0.053
   50    HA   LEU   9           HA       LEU   9   0.345   3.300   2.006
   51   1HB   LEU   9          HB2       LEU   9  -0.033   1.670  -0.488
   52   2HB   LEU   9          HB1       LEU   9   1.264   1.427   0.663
   53    HG   LEU   9           HG       LEU   9  -1.684   1.065   1.180
   54   1HD1  LEU   9          HD11      LEU   9  -1.069  -1.278   1.513
   55   2HD1  LEU   9          HD12      LEU   9   0.597  -0.896   1.063
   56   3HD1  LEU   9          HD13      LEU   9  -0.699  -0.724  -0.120
   57   1HD2  LEU   9          HD21      LEU   9  -0.585   1.969   3.155
   58   2HD2  LEU   9          HD22      LEU   9   0.657   0.719   3.045
   59   3HD2  LEU   9          HD23      LEU   9  -1.013   0.271   3.394
   60    H    VAL  10           HN       VAL  10   0.062   4.813  -1.128
   61    HA   VAL  10           HA       VAL  10   2.928   5.017  -1.336
   62    HB   VAL  10           HB       VAL  10   0.751   6.504  -2.883
   63   1HG1  VAL  10          HG11      VAL  10   2.513   7.052  -4.501
   64   2HG1  VAL  10          HG12      VAL  10   3.719   6.301  -3.453
   65   3HG1  VAL  10          HG13      VAL  10   2.871   7.752  -2.923
   66   1HG2  VAL  10          HG21      VAL  10   2.447   4.130  -3.620
   67   2HG2  VAL  10          HG22      VAL  10   1.296   4.944  -4.679
   68   3HG2  VAL  10          HG23      VAL  10   0.727   4.104  -3.235
   69    H    LYS  11           HN       LYS  11   0.550   6.500   0.413
   70    HA   LYS  11           HA       LYS  11   2.016   8.981   0.842
   71   1HB   LYS  11          HB2       LYS  11  -0.576   7.935   1.903
   72   2HB   LYS  11          HB1       LYS  11   0.039   9.554   2.247
   73   1HG   LYS  11          HG2       LYS  11  -0.763   8.455  -0.451
   74   2HG   LYS  11          HG1       LYS  11  -1.680   9.611   0.519
   75   1HD   LYS  11          HD2       LYS  11   0.177  11.208   0.339
   76   2HD   LYS  11          HD1       LYS  11   1.064  10.051  -0.653
   77   1HE   LYS  11          HE2       LYS  11  -0.010  11.734  -2.043
   78   2HE   LYS  11          HE1       LYS  11  -0.703  10.143  -2.341
   79   1HZ   LYS  11          HZ1       LYS  11  -2.343  11.990  -2.137
   80   2HZ   LYS  11          HZ2       LYS  11  -1.926  12.126  -0.506
   81   3HZ   LYS  11          HZ3       LYS  11  -2.602  10.685  -1.108
   82    H    ALA  12           HN       ALA  12   2.365   5.972   1.831
   83    HA   ALA  12           HA       ALA  12   3.332   6.735   4.500
   84   1HB   ALA  12          HB1       ALA  12   1.178   5.587   4.793
   85   2HB   ALA  12          HB2       ALA  12   2.512   4.646   5.464
   86   3HB   ALA  12          HB3       ALA  12   1.808   4.192   3.914
   87    H    VAL  13           HN       VAL  13   3.304   3.925   2.294
   88    HA   VAL  13           HA       VAL  13   5.792   2.901   3.157
   89    HB   VAL  13           HB       VAL  13   4.199   2.356   0.634
   90   1HG1  VAL  13          HG11      VAL  13   6.512   1.793   0.256
   91   2HG1  VAL  13          HG12      VAL  13   5.554   0.319   0.387
   92   3HG1  VAL  13          HG13      VAL  13   6.568   0.841   1.741
   93   1HG2  VAL  13          HG21      VAL  13   3.041   1.743   2.685
   94   2HG2  VAL  13          HG22      VAL  13   4.440   0.808   3.213
   95   3HG2  VAL  13          HG23      VAL  13   3.527   0.300   1.794
   96    H    ALA  14           HN       ALA  14   4.848   4.728   0.265
   97    HA   ALA  14           HA       ALA  14   7.457   4.900  -0.805
   98   1HB   ALA  14          HB1       ALA  14   5.114   6.780  -1.222
   99   2HB   ALA  14          HB2       ALA  14   5.438   5.330  -2.150
  100   3HB   ALA  14          HB3       ALA  14   6.552   6.706  -2.254
  101    H    HIS  15           HN       HIS  15   5.774   6.614   1.622
  102    HA   HIS  15           HA       HIS  15   7.479   8.883   1.771
  103   1HB   HIS  15          HB2       HIS  15   5.164   8.945   2.611
  104   2HB   HIS  15          HB1       HIS  15   5.565   7.745   3.831
  105    HD1  HIS  15           HD1      HIS  15   6.051   8.713   6.071
  106    HD2  HIS  15           HD2      HIS  15   6.806  11.421   3.005
  107    HE1  HIS  15           HE1      HIS  15   6.745  10.833   7.191
  108    HE2  HIS  15           HE2      HIS  15   7.429  12.358   5.324
  109    H    ILE  16           HN       ILE  16   7.728   5.631   2.943
  110    HA   ILE  16           HA       ILE  16   9.657   6.146   4.985
  111    HB   ILE  16           HB       ILE  16   9.133   3.588   3.420
  112   1HG1  ILE  16          HG12      ILE  16   7.154   4.279   4.660
  113   2HG1  ILE  16          HG11      ILE  16   7.864   2.857   5.413
  114   1HG2  ILE  16          HG21      ILE  16  11.348   3.524   4.419
  115   2HG2  ILE  16          HG22      ILE  16  10.266   2.403   5.247
  116   3HG2  ILE  16          HG23      ILE  16  10.671   3.947   5.991
  117   1HD1  ILE  16          HD11      ILE  16   7.103   4.459   7.074
  118   2HD1  ILE  16          HD12      ILE  16   8.149   5.698   6.378
  119   3HD1  ILE  16          HD13      ILE  16   8.856   4.271   7.140
  120    H    LEU  17           HN       LEU  17   9.764   5.433   1.583
  121    HA   LEU  17           HA       LEU  17  12.622   5.335   1.350
  122   1HB   LEU  17          HB2       LEU  17  10.463   5.777  -0.714
  123   2HB   LEU  17          HB1       LEU  17  12.159   5.586  -1.092
  124    HG   LEU  17           HG       LEU  17  10.467   3.483   0.244
  125   1HD1  LEU  17          HD11      LEU  17  10.559   2.347  -1.915
  126   2HD1  LEU  17          HD12      LEU  17  11.408   3.732  -2.605
  127   3HD1  LEU  17          HD13      LEU  17   9.741   3.903  -2.048
  128   1HD2  LEU  17          HD21      LEU  17  13.225   3.409  -0.944
  129   2HD2  LEU  17          HD22      LEU  17  12.341   2.034  -0.274
  130   3HD2  LEU  17          HD23      LEU  17  12.828   3.369   0.773
  131    H    GLY  18           HN       GLY  18  10.139   7.689   0.651
  132   1HA   GLY  18          HA2       GLY  18  10.651  10.058   1.223
  133   2HA   GLY  18          HA1       GLY  18  12.226   9.781   0.477
  134    H    ILE  19           HN       ILE  19   9.101   8.629  -0.643
  135    HA   ILE  19           HA       ILE  19   9.174  10.470  -2.865
  136    HB   ILE  19           HB       ILE  19   8.160   8.429  -4.126
  137   1HG1  ILE  19          HG12      ILE  19  10.128   7.040  -2.311
  138   2HG1  ILE  19          HG11      ILE  19   8.385   6.787  -2.374
  139   1HG2  ILE  19          HG21      ILE  19  11.119   8.962  -3.882
  140   2HG2  ILE  19          HG22      ILE  19   9.942   9.721  -4.978
  141   3HG2  ILE  19          HG23      ILE  19  10.368   8.025  -5.184
  142   1HD1  ILE  19          HD11      ILE  19   9.588   5.007  -3.512
  143   2HD1  ILE  19          HD12      ILE  19  10.337   6.188  -4.590
  144   3HD1  ILE  19          HD13      ILE  19   8.593   5.925  -4.643
  145    H    ARG  20           HN       ARG  20   7.128  10.365  -4.061
  146    HA   ARG  20           HA       ARG  20   4.818   9.232  -2.992
  147   1HB   ARG  20          HB2       ARG  20   5.164  10.866  -1.169
  148   2HB   ARG  20          HB1       ARG  20   5.163  12.180  -2.333
  149   1HG   ARG  20          HG2       ARG  20   2.774  10.384  -2.095
  150   2HG   ARG  20          HG1       ARG  20   3.037  11.667  -0.916
  151   1HD   ARG  20          HD2       ARG  20   2.893  12.083  -3.907
  152   2HD   ARG  20          HD1       ARG  20   1.544  12.322  -2.790
  153    HE   ARG  20           HE       ARG  20   3.600  13.801  -1.772
  154   1HH1  ARG  20          HH11      ARG  20   2.002  13.802  -4.964
  155   2HH1  ARG  20          HH12      ARG  20   2.021  15.497  -5.081
  156   1HH2  ARG  20          HH21      ARG  20   3.645  16.071  -1.991
  157   2HH2  ARG  20          HH22      ARG  20   3.003  16.851  -3.361
  158    H    ASP  21           HN       ASP  21   6.159  11.967  -4.749
  159    HA   ASP  21           HA       ASP  21   3.947  12.187  -6.512
  160   1HB   ASP  21          HB2       ASP  21   5.290  13.682  -7.917
  161   2HB   ASP  21          HB1       ASP  21   5.479  14.112  -6.225
  162    H    LEU  22           HN       LEU  22   6.949  10.451  -6.826
  163    HA   LEU  22           HA       LEU  22   7.582   8.750  -8.163
  164   1HB   LEU  22          HB2       LEU  22   4.611   8.429  -8.198
  165   2HB   LEU  22          HB1       LEU  22   5.585   7.445  -9.267
  166    HG   LEU  22           HG       LEU  22   4.974   6.283  -7.221
  167   1HD1  LEU  22          HD11      LEU  22   6.993   5.658  -8.358
  168   2HD1  LEU  22          HD12      LEU  22   7.244   5.516  -6.615
  169   3HD1  LEU  22          HD13      LEU  22   7.901   6.896  -7.503
  170   1HD2  LEU  22          HD21      LEU  22   6.643   8.356  -5.796
  171   2HD2  LEU  22          HD22      LEU  22   5.995   6.889  -5.068
  172   3HD2  LEU  22          HD23      LEU  22   4.902   8.144  -5.642
  173    H    ALA  23           HN       ALA  23   7.230  11.449  -9.300
  174    HA   ALA  23           HA       ALA  23   6.324  11.029 -11.947
  175   1HB   ALA  23          HB1       ALA  23   6.025  13.181 -10.840
  176   2HB   ALA  23          HB2       ALA  23   6.940  13.348 -12.341
  177   3HB   ALA  23          HB3       ALA  23   7.775  13.393 -10.790
  178    H    GLY  24           HN       GLY  24   9.169  10.430 -10.397
  179   1HA   GLY  24          HA2       GLY  24  10.446   9.969 -12.988
  180   2HA   GLY  24          HA1       GLY  24  11.347  10.931 -11.811
  181    H    ILE  25           HN       ILE  25   9.345   8.320 -10.840
  182    HA   ILE  25           HA       ILE  25  11.761   6.760 -10.197
  183    HB   ILE  25           HB       ILE  25   9.024   6.580  -8.869
  184   1HG1  ILE  25          HG12      ILE  25  10.025   8.765  -8.386
  185   2HG1  ILE  25          HG11      ILE  25   9.969   7.760  -6.946
  186   1HG2  ILE  25          HG21      ILE  25  10.165   5.308  -7.108
  187   2HG2  ILE  25          HG22      ILE  25  11.673   5.406  -8.018
  188   3HG2  ILE  25          HG23      ILE  25  10.303   4.515  -8.679
  189   1HD1  ILE  25          HD11      ILE  25  12.400   8.285  -8.652
  190   2HD1  ILE  25          HD12      ILE  25  12.354   7.283  -7.200
  191   3HD1  ILE  25          HD13      ILE  25  12.041   9.014  -7.084
  192    H    ASN  26           HN       ASN  26  11.486   4.384 -10.508
  193    HA   ASN  26           HA       ASN  26   9.855   3.914 -12.867
  194   1HB   ASN  26          HB2       ASN  26  12.245   3.141 -12.753
  195   2HB   ASN  26          HB1       ASN  26  11.785   2.044 -11.464
  196   1HD2  ASN  26          HD21      ASN  26  12.929   1.595 -14.119
  197   2HD2  ASN  26          HD22      ASN  26  11.887   0.426 -14.884
  198    H    LEU  27           HN       LEU  27   7.978   2.882 -12.826
  199    HA   LEU  27           HA       LEU  27   6.868   2.297 -10.196
  200   1HB   LEU  27          HB2       LEU  27   5.491   2.310 -12.880
  201   2HB   LEU  27          HB1       LEU  27   4.731   2.313 -11.305
  202    HG   LEU  27           HG       LEU  27   6.276   4.561 -12.582
  203   1HD1  LEU  27          HD11      LEU  27   4.043   4.295 -13.450
  204   2HD1  LEU  27          HD12      LEU  27   4.151   5.755 -12.468
  205   3HD1  LEU  27          HD13      LEU  27   3.377   4.309 -11.817
  206   1HD2  LEU  27          HD21      LEU  27   5.712   5.880 -10.594
  207   2HD2  LEU  27          HD22      LEU  27   6.759   4.518 -10.201
  208   3HD2  LEU  27          HD23      LEU  27   5.035   4.439  -9.837
  209    H    ASP  28           HN       ASP  28   8.551   0.571 -12.357
  210    HA   ASP  28           HA       ASP  28   7.084  -1.838 -11.605
  211   1HB   ASP  28          HB2       ASP  28   8.631  -1.281 -14.124
  212   2HB   ASP  28          HB1       ASP  28   8.296  -2.927 -13.589
  213    H    SER  29           HN       SER  29   9.367  -0.215 -10.389
  214    HA   SER  29           HA       SER  29  11.414  -2.223 -10.218
  215   1HB   SER  29          HB2       SER  29  10.984   0.327  -8.636
  216   2HB   SER  29          HB1       SER  29  12.421  -0.688  -8.565
  217    HG   SER  29           HG       SER  29  12.525  -0.347 -10.892
  218    H    SER  30           HN       SER  30  11.474  -3.814  -8.755
  219    HA   SER  30           HA       SER  30   9.229  -4.421  -7.143
  220   1HB   SER  30          HB2       SER  30  12.042  -5.502  -7.104
  221   2HB   SER  30          HB1       SER  30  10.705  -6.211  -6.209
  222    HG   SER  30           HG       SER  30  10.060  -5.881  -8.861
  223    H    LEU  31           HN       LEU  31   9.125  -4.517  -4.815
  224    HA   LEU  31           HA       LEU  31   9.911  -2.129  -3.604
  225   1HB   LEU  31          HB2       LEU  31   7.937  -3.463  -2.959
  226   2HB   LEU  31          HB1       LEU  31   8.997  -4.689  -2.290
  227    HG   LEU  31           HG       LEU  31   9.776  -3.066  -0.602
  228   1HD1  LEU  31          HD11      LEU  31   7.680  -1.324  -1.835
  229   2HD1  LEU  31          HD12      LEU  31   9.431  -1.070  -1.909
  230   3HD1  LEU  31          HD13      LEU  31   8.583  -0.967  -0.350
  231   1HD2  LEU  31          HD21      LEU  31   7.727  -2.978   0.685
  232   2HD2  LEU  31          HD22      LEU  31   7.913  -4.540  -0.116
  233   3HD2  LEU  31          HD23      LEU  31   6.795  -3.340  -0.766
  234    H    ALA  32           HN       ALA  32  11.319  -5.288  -3.636
  235    HA   ALA  32           HA       ALA  32  13.164  -4.902  -1.574
  236   1HB   ALA  32          HB1       ALA  32  13.433  -6.698  -3.982
  237   2HB   ALA  32          HB2       ALA  32  12.640  -7.116  -2.466
  238   3HB   ALA  32          HB3       ALA  32  14.381  -6.815  -2.499
  239    H    ASP  33           HN       ASP  33  13.170  -4.004  -4.927
  240    HA   ASP  33           HA       ASP  33  15.961  -3.458  -5.135
  241   1HB   ASP  33          HB2       ASP  33  14.510  -3.991  -7.104
  242   2HB   ASP  33          HB1       ASP  33  13.669  -2.474  -6.845
  243    H    LEU  34           HN       LEU  34  13.036  -1.710  -4.521
  244    HA   LEU  34           HA       LEU  34  13.886   0.954  -4.518
  245   1HB   LEU  34          HB2       LEU  34  11.850  -0.238  -2.660
  246   2HB   LEU  34          HB1       LEU  34  11.935   1.414  -3.226
  247    HG   LEU  34           HG       LEU  34  11.286  -0.987  -4.912
  248   1HD1  LEU  34          HD11      LEU  34   9.594  -0.478  -3.327
  249   2HD1  LEU  34          HD12      LEU  34   9.048  -0.106  -4.964
  250   3HD1  LEU  34          HD13      LEU  34   9.526   1.202  -3.863
  251   1HD2  LEU  34          HD21      LEU  34  11.267   1.944  -5.592
  252   2HD2  LEU  34          HD22      LEU  34  10.659   0.616  -6.597
  253   3HD2  LEU  34          HD23      LEU  34  12.380   0.709  -6.212
  254    H    GLY  35           HN       GLY  35  13.856  -1.462  -1.950
  255   1HA   GLY  35          HA2       GLY  35  16.111  -0.724  -0.634
  256   2HA   GLY  35          HA1       GLY  35  14.911   0.393  -0.014
  257    H    LEU  36           HN       LEU  36  13.138  -2.326  -0.585
  258    HA   LEU  36           HA       LEU  36  13.060  -2.974   2.128
  259   1HB   LEU  36          HB2       LEU  36  11.077  -3.424   1.154
  260   2HB   LEU  36          HB1       LEU  36  11.731  -4.117  -0.294
  261    HG   LEU  36           HG       LEU  36  12.288  -6.181   1.055
  262   1HD1  LEU  36          HD11      LEU  36  10.676  -4.820   3.190
  263   2HD1  LEU  36          HD12      LEU  36  12.404  -5.174   3.255
  264   3HD1  LEU  36          HD13      LEU  36  11.233  -6.493   3.224
  265   1HD2  LEU  36          HD21      LEU  36   9.986  -6.993   1.191
  266   2HD2  LEU  36          HD22      LEU  36  10.281  -6.092  -0.296
  267   3HD2  LEU  36          HD23      LEU  36   9.397  -5.339   1.030
  268    H    ASP  37           HN       ASP  37  14.561  -3.737   3.167
  269    HA   ASP  37           HA       ASP  37  15.713  -6.311   2.384
  270   1HB   ASP  37          HB2       ASP  37  17.881  -5.703   3.206
  271   2HB   ASP  37          HB1       ASP  37  17.384  -4.410   2.130
  272    H    SER  38           HN       SER  38  14.239  -4.252   4.715
  273    HA   SER  38           HA       SER  38  13.709  -6.470   6.448
  274   1HB   SER  38          HB2       SER  38  15.271  -4.100   7.555
  275   2HB   SER  38          HB1       SER  38  14.590  -5.412   8.515
  276    HG   SER  38           HG       SER  38  16.058  -6.421   6.550
  277    H    LEU  39           HN       LEU  39  13.759  -2.923   6.958
  278    HA   LEU  39           HA       LEU  39  11.357  -2.856   8.387
  279   1HB   LEU  39          HB2       LEU  39  13.072  -1.158   8.606
  280   2HB   LEU  39          HB1       LEU  39  12.785  -0.631   6.959
  281    HG   LEU  39           HG       LEU  39  10.472   0.023   7.640
  282   1HD1  LEU  39          HD11      LEU  39  11.483  -0.525  10.422
  283   2HD1  LEU  39          HD12      LEU  39  10.207  -1.403   9.573
  284   3HD1  LEU  39          HD13      LEU  39   9.970   0.287  10.011
  285   1HD2  LEU  39          HD21      LEU  39  12.739   1.330   9.127
  286   2HD2  LEU  39          HD22      LEU  39  11.162   2.060   8.805
  287   3HD2  LEU  39          HD23      LEU  39  12.243   1.668   7.468
  288    H    MET  40           HN       MET  40  11.945  -2.398   4.963
  289    HA   MET  40           HA       MET  40   9.387  -1.147   4.492
  290   1HB   MET  40          HB2       MET  40  11.457  -2.122   2.546
  291   2HB   MET  40          HB1       MET  40  10.060  -1.115   2.156
  292   1HG   MET  40          HG2       MET  40  10.858   0.650   3.557
  293   2HG   MET  40          HG1       MET  40  12.176  -0.354   4.141
  294   1HE   MET  40          HE1       MET  40  14.185   2.244   2.202
  295   2HE   MET  40          HE2       MET  40  14.047   1.295   3.682
  296   3HE   MET  40          HE3       MET  40  12.803   2.477   3.273
  297    H    GLY  41           HN       GLY  41   9.950  -4.164   5.211
  298   1HA   GLY  41          HA2       GLY  41   7.601  -5.023   3.648
  299   2HA   GLY  41          HA1       GLY  41   8.785  -6.132   4.353
  300    H    VAL  42           HN       VAL  42   9.052  -4.609   6.776
  301    HA   VAL  42           HA       VAL  42   6.957  -5.856   8.268
  302    HB   VAL  42           HB       VAL  42   9.085  -3.910   9.209
  303   1HG1  VAL  42          HG11      VAL  42   7.372  -5.833  10.770
  304   2HG1  VAL  42          HG12      VAL  42   7.250  -4.071  10.750
  305   3HG1  VAL  42          HG13      VAL  42   8.686  -4.846  11.431
  306   1HG2  VAL  42          HG21      VAL  42   9.122  -6.928   9.210
  307   2HG2  VAL  42          HG22      VAL  42  10.339  -5.888   9.946
  308   3HG2  VAL  42          HG23      VAL  42  10.112  -5.876   8.197
  309    H    GLU  43           HN       GLU  43   7.882  -2.519   7.552
  310    HA   GLU  43           HA       GLU  43   5.974  -1.120   8.989
  311   1HB   GLU  43          HB2       GLU  43   7.868  -0.113   7.752
  312   2HB   GLU  43          HB1       GLU  43   7.071  -0.503   6.236
  313   1HG   GLU  43          HG2       GLU  43   6.620   1.801   6.615
  314   2HG   GLU  43          HG1       GLU  43   5.175   0.880   7.011
  315    H    VAL  44           HN       VAL  44   5.827  -2.510   5.776
  316    HA   VAL  44           HA       VAL  44   3.299  -1.605   4.968
  317    HB   VAL  44           HB       VAL  44   4.639  -4.209   4.213
  318   1HG1  VAL  44          HG11      VAL  44   2.332  -4.117   3.526
  319   2HG1  VAL  44          HG12      VAL  44   3.410  -3.992   2.125
  320   3HG1  VAL  44          HG13      VAL  44   2.605  -2.547   2.757
  321   1HG2  VAL  44          HG21      VAL  44   6.157  -2.378   3.891
  322   2HG2  VAL  44          HG22      VAL  44   4.940  -1.476   2.981
  323   3HG2  VAL  44          HG23      VAL  44   5.606  -2.986   2.337
  324    H    ARG  45           HN       ARG  45   4.308  -4.626   6.486
  325    HA   ARG  45           HA       ARG  45   1.778  -5.786   6.734
  326   1HB   ARG  45          HB2       ARG  45   4.242  -6.132   8.410
  327   2HB   ARG  45          HB1       ARG  45   2.820  -7.140   8.591
  328   1HG   ARG  45          HG2       ARG  45   3.081  -7.792   6.209
  329   2HG   ARG  45          HG1       ARG  45   4.598  -6.889   6.190
  330   1HD   ARG  45          HD2       ARG  45   3.921  -9.219   7.969
  331   2HD   ARG  45          HD1       ARG  45   5.004  -9.245   6.580
  332    HE   ARG  45           HE       ARG  45   5.753  -7.278   8.447
  333   1HH1  ARG  45          HH11      ARG  45   5.909 -10.786   7.854
  334   2HH1  ARG  45          HH12      ARG  45   7.336 -10.989   8.784
  335   1HH2  ARG  45          HH21      ARG  45   7.682  -7.675   9.851
  336   2HH2  ARG  45          HH22      ARG  45   8.262  -9.265   9.976
  337    H    GLN  46           HN       GLN  46   3.565  -3.721   8.980
  338    HA   GLN  46           HA       GLN  46   1.783  -3.802  11.126
  339   1HB   GLN  46          HB2       GLN  46   3.576  -1.551  10.232
  340   2HB   GLN  46          HB1       GLN  46   2.738  -1.607  11.774
  341   1HG   GLN  46          HG2       GLN  46   3.971  -3.610  12.385
  342   2HG   GLN  46          HG1       GLN  46   4.792  -3.581  10.826
  343   1HE2  GLN  46          HE21      GLN  46   4.051  -0.694  12.618
  344   2HE2  GLN  46          HE22      GLN  46   5.682  -0.307  13.025
  345    H    ILE  47           HN       ILE  47   1.620  -1.995   8.158
  346    HA   ILE  47           HA       ILE  47  -0.478  -0.255   9.057
  347    HB   ILE  47           HB       ILE  47   0.377  -0.911   6.212
  348   1HG1  ILE  47          HG12      ILE  47   1.165   1.456   7.910
  349   2HG1  ILE  47          HG11      ILE  47   2.183   0.034   7.691
  350   1HG2  ILE  47          HG21      ILE  47  -1.853   0.085   6.341
  351   2HG2  ILE  47          HG22      ILE  47  -0.711   1.233   5.646
  352   3HG2  ILE  47          HG23      ILE  47  -1.224   1.404   7.326
  353   1HD1  ILE  47          HD11      ILE  47   2.922   1.825   6.249
  354   2HD1  ILE  47          HD12      ILE  47   1.306   1.979   5.554
  355   3HD1  ILE  47          HD13      ILE  47   2.260   0.519   5.270
  356    H    LEU  48           HN       LEU  48  -0.273  -2.894   6.732
  357    HA   LEU  48           HA       LEU  48  -3.071  -2.987   6.365
  358   1HB   LEU  48          HB2       LEU  48  -0.922  -4.881   5.482
  359   2HB   LEU  48          HB1       LEU  48  -2.611  -5.220   5.194
  360    HG   LEU  48           HG       LEU  48  -1.751  -4.319   3.196
  361   1HD1  LEU  48          HD11      LEU  48  -3.942  -3.509   3.735
  362   2HD1  LEU  48          HD12      LEU  48  -3.026  -2.273   2.865
  363   3HD1  LEU  48          HD13      LEU  48  -3.242  -2.142   4.609
  364   1HD2  LEU  48          HD21      LEU  48  -0.660  -2.003   4.787
  365   2HD2  LEU  48          HD22      LEU  48  -0.613  -2.149   3.031
  366   3HD2  LEU  48          HD23      LEU  48   0.287  -3.287   4.040
  367    H    GLU  49           HN       GLU  49  -1.014  -4.935   8.458
  368    HA   GLU  49           HA       GLU  49  -3.045  -6.755   9.211
  369   1HB   GLU  49          HB2       GLU  49  -0.599  -5.860  10.733
  370   2HB   GLU  49          HB1       GLU  49  -1.664  -7.151  11.247
  371   1HG   GLU  49          HG2       GLU  49  -1.085  -8.396   9.212
  372   2HG   GLU  49          HG1       GLU  49   0.030  -7.098   8.769
  373    H    ARG  50           HN       ARG  50  -1.804  -3.836  10.803
  374    HA   ARG  50           HA       ARG  50  -3.643  -4.050  12.939
  375   1HB   ARG  50          HB2       ARG  50  -1.859  -1.799  12.073
  376   2HB   ARG  50          HB1       ARG  50  -2.948  -1.663  13.448
  377   1HG   ARG  50          HG2       ARG  50  -1.828  -3.611  14.475
  378   2HG   ARG  50          HG1       ARG  50  -0.693  -3.635  13.123
  379   1HD   ARG  50          HD2       ARG  50   0.134  -1.466  13.693
  380   2HD   ARG  50          HD1       ARG  50  -1.127  -1.247  14.906
  381    HE   ARG  50           HE       ARG  50   0.564  -3.527  15.295
  382   1HH1  ARG  50          HH11      ARG  50   0.260  -0.041  15.932
  383   2HH1  ARG  50          HH12      ARG  50   1.054  -0.068  17.424
  384   1HH2  ARG  50          HH21      ARG  50   1.649  -3.594  17.409
  385   2HH2  ARG  50          HH22      ARG  50   1.913  -2.150  18.267
  386    H    GLU  51           HN       GLU  51  -3.798  -2.351   9.897
  387    HA   GLU  51           HA       GLU  51  -6.163  -0.961  10.734
  388   1HB   GLU  51          HB2       GLU  51  -4.838  -1.159   8.049
  389   2HB   GLU  51          HB1       GLU  51  -6.277  -0.206   8.367
  390   1HG   GLU  51          HG2       GLU  51  -3.553   0.189   9.580
  391   2HG   GLU  51          HG1       GLU  51  -4.333   1.204   8.366
  392    H    HIS  52           HN       HIS  52  -5.555  -3.503   8.260
  393    HA   HIS  52           HA       HIS  52  -8.444  -3.986   8.430
  394   1HB   HIS  52          HB2       HIS  52  -6.774  -3.675   5.981
  395   2HB   HIS  52          HB1       HIS  52  -8.204  -4.687   5.923
  396    HD1  HIS  52           HD1      HIS  52  -8.259  -2.303   4.137
  397    HD2  HIS  52           HD2      HIS  52  -9.537  -2.127   8.090
  398    HE1  HIS  52           HE1      HIS  52  -9.777  -0.315   4.279
  399    HE2  HIS  52           HE2      HIS  52 -10.630  -0.288   6.630
  400    H    ASP  53           HN       ASP  53  -5.874  -5.476   9.466
  401    HA   ASP  53           HA       ASP  53  -5.463  -7.606  10.070
  402   1HB   ASP  53          HB2       ASP  53  -7.798  -7.833  10.612
  403   2HB   ASP  53          HB1       ASP  53  -8.244  -8.008   8.931
  404    H    LEU  54           HN       LEU  54  -5.081  -6.560   7.163
  405    HA   LEU  54           HA       LEU  54  -4.764  -9.062   5.746
  406   1HB   LEU  54          HB2       LEU  54  -4.316  -6.217   4.937
  407   2HB   LEU  54          HB1       LEU  54  -3.551  -7.493   4.025
  408    HG   LEU  54           HG       LEU  54  -5.847  -8.423   3.576
  409   1HD1  LEU  54          HD11      LEU  54  -7.053  -7.396   5.404
  410   2HD1  LEU  54          HD12      LEU  54  -7.758  -6.964   3.845
  411   3HD1  LEU  54          HD13      LEU  54  -6.756  -5.800   4.715
  412   1HD2  LEU  54          HD21      LEU  54  -4.652  -7.125   1.921
  413   2HD2  LEU  54          HD22      LEU  54  -5.268  -5.630   2.624
  414   3HD2  LEU  54          HD23      LEU  54  -6.380  -6.769   1.862
  415    H    VAL  55           HN       VAL  55  -3.254 -10.239   6.782
  416    HA   VAL  55           HA       VAL  55  -0.618  -9.154   7.205
  417    HB   VAL  55           HB       VAL  55  -1.490 -12.071   7.201
  418   1HG1  VAL  55          HG11      VAL  55   1.057 -10.793   8.241
  419   2HG1  VAL  55          HG12      VAL  55   0.919 -11.829   6.829
  420   3HG1  VAL  55          HG13      VAL  55   0.619 -12.491   8.426
  421   1HG2  VAL  55          HG21      VAL  55  -2.649 -10.799   8.946
  422   2HG2  VAL  55          HG22      VAL  55  -1.100 -10.193   9.540
  423   3HG2  VAL  55          HG23      VAL  55  -1.474 -11.912   9.647
  424    H    LEU  56           HN       LEU  56   0.174  -8.480   5.360
  425    HA   LEU  56           HA       LEU  56   0.272 -10.341   3.110
  426   1HB   LEU  56          HB2       LEU  56   1.111  -7.436   3.178
  427   2HB   LEU  56          HB1       LEU  56   0.933  -8.445   1.770
  428    HG   LEU  56           HG       LEU  56  -1.332  -7.475   3.512
  429   1HD1  LEU  56          HD11      LEU  56  -0.360  -5.703   2.175
  430   2HD1  LEU  56          HD12      LEU  56  -1.954  -6.143   1.562
  431   3HD1  LEU  56          HD13      LEU  56  -0.502  -6.695   0.727
  432   1HD2  LEU  56          HD21      LEU  56  -2.792  -8.433   1.797
  433   2HD2  LEU  56          HD22      LEU  56  -1.813  -9.674   2.573
  434   3HD2  LEU  56          HD23      LEU  56  -1.385  -9.095   0.964
  435    HA   PRO  57           HA       PRO  57   4.328 -11.041   4.927
  436   1HB   PRO  57          HB2       PRO  57   4.490 -13.180   2.926
  437   2HB   PRO  57          HB1       PRO  57   4.516 -13.303   4.688
  438   1HG   PRO  57          HG2       PRO  57   2.411 -14.153   3.256
  439   2HG   PRO  57          HG1       PRO  57   2.206 -13.384   4.846
  440   1HD   PRO  57          HD2       PRO  57   1.907 -12.186   2.113
  441   2HD   PRO  57          HD1       PRO  57   0.831 -12.048   3.524
  442    H    ILE  58           HN       ILE  58   6.521 -11.165   4.070
  443    HA   ILE  58           HA       ILE  58   6.981  -9.229   2.070
  444    HB   ILE  58           HB       ILE  58   8.876 -11.134   3.498
  445   1HG1  ILE  58          HG12      ILE  58   9.844  -8.997   4.418
  446   2HG1  ILE  58          HG11      ILE  58   8.546  -8.126   3.624
  447   1HG2  ILE  58          HG21      ILE  58  10.798  -9.987   2.506
  448   2HG2  ILE  58          HG22      ILE  58   9.709  -9.085   1.452
  449   3HG2  ILE  58          HG23      ILE  58   9.833 -10.837   1.298
  450   1HD1  ILE  58          HD11      ILE  58   8.245 -10.163   5.818
  451   2HD1  ILE  58          HD12      ILE  58   6.922  -9.313   5.025
  452   3HD1  ILE  58          HD13      ILE  58   8.099  -8.413   5.983
  453    H    ARG  59           HN       ARG  59   6.635 -12.609   2.047
  454    HA   ARG  59           HA       ARG  59   7.684 -13.429  -0.396
  455   1HB   ARG  59          HB2       ARG  59   5.156 -14.283   0.999
  456   2HB   ARG  59          HB1       ARG  59   5.650 -14.990  -0.521
  457   1HG   ARG  59          HG2       ARG  59   6.295 -16.489   1.165
  458   2HG   ARG  59          HG1       ARG  59   7.767 -15.706   0.620
  459   1HD   ARG  59          HD2       ARG  59   7.754 -14.282   2.616
  460   2HD   ARG  59          HD1       ARG  59   6.233 -15.005   3.136
  461    HE   ARG  59           HE       ARG  59   7.783 -17.163   2.802
  462   1HH1  ARG  59          HH11      ARG  59   8.403 -14.206   4.690
  463   2HH1  ARG  59          HH12      ARG  59   9.444 -15.023   5.778
  464   1HH2  ARG  59          HH21      ARG  59   9.145 -18.206   4.368
  465   2HH2  ARG  59          HH22      ARG  59   9.792 -17.305   5.643
  466    H    GLU  60           HN       GLU  60   4.808 -11.518   0.212
  467    HA   GLU  60           HA       GLU  60   4.194 -11.456  -2.666
  468   1HB   GLU  60          HB2       GLU  60   2.516 -10.735  -0.255
  469   2HB   GLU  60          HB1       GLU  60   1.978 -10.532  -1.911
  470   1HG   GLU  60          HG2       GLU  60   2.163 -12.953  -2.254
  471   2HG   GLU  60          HG1       GLU  60   2.694 -13.145  -0.588
  472    H    VAL  61           HN       VAL  61   4.555  -9.405   0.182
  473    HA   VAL  61           HA       VAL  61   4.171  -6.917  -0.975
  474    HB   VAL  61           HB       VAL  61   5.772  -7.704   1.477
  475   1HG1  VAL  61          HG11      VAL  61   6.493  -5.492   0.722
  476   2HG1  VAL  61          HG12      VAL  61   5.553  -5.390   2.210
  477   3HG1  VAL  61          HG13      VAL  61   4.811  -4.966   0.667
  478   1HG2  VAL  61          HG21      VAL  61   3.434  -8.279   1.557
  479   2HG2  VAL  61          HG22      VAL  61   2.995  -6.625   1.122
  480   3HG2  VAL  61          HG23      VAL  61   3.785  -6.953   2.665
  481    H    ARG  62           HN       ARG  62   7.063  -8.864  -0.974
  482    HA   ARG  62           HA       ARG  62   8.984  -6.861  -1.446
  483   1HB   ARG  62          HB2       ARG  62   9.277  -9.273  -0.728
  484   2HB   ARG  62          HB1       ARG  62   9.097  -9.700  -2.416
  485   1HG   ARG  62          HG2       ARG  62  11.076  -8.502  -2.978
  486   2HG   ARG  62          HG1       ARG  62  11.225  -7.892  -1.323
  487   1HD   ARG  62          HD2       ARG  62  11.354 -10.261  -0.536
  488   2HD   ARG  62          HD1       ARG  62  11.327 -10.787  -2.215
  489    HE   ARG  62           HE       ARG  62  13.447  -8.999  -1.309
  490   1HH1  ARG  62          HH11      ARG  62  12.476 -12.296  -2.164
  491   2HH1  ARG  62          HH12      ARG  62  14.032 -12.832  -2.581
  492   1HH2  ARG  62          HH21      ARG  62  15.641  -9.724  -1.781
  493   2HH2  ARG  62          HH22      ARG  62  15.906 -11.326  -2.290
  494    H    GLN  63           HN       GLN  63   6.559  -8.054  -3.499
  495    HA   GLN  63           HA       GLN  63   7.997  -7.313  -5.938
  496   1HB   GLN  63          HB2       GLN  63   5.548  -9.032  -5.531
  497   2HB   GLN  63          HB1       GLN  63   6.026  -8.437  -7.110
  498   1HG   GLN  63          HG2       GLN  63   6.808 -10.658  -6.942
  499   2HG   GLN  63          HG1       GLN  63   8.208  -9.611  -6.791
  500   1HE2  GLN  63          HE21      GLN  63   5.931 -10.241  -4.202
  501   2HE2  GLN  63          HE22      GLN  63   7.019 -11.172  -3.239
  502    H    LEU  64           HN       LEU  64   6.178  -5.847  -3.753
  503    HA   LEU  64           HA       LEU  64   4.283  -4.598  -5.496
  504   1HB   LEU  64          HB2       LEU  64   5.161  -3.770  -2.726
  505   2HB   LEU  64          HB1       LEU  64   3.799  -3.093  -3.597
  506    HG   LEU  64           HG       LEU  64   4.064  -5.916  -2.595
  507   1HD1  LEU  64          HD11      LEU  64   2.272  -3.664  -1.716
  508   2HD1  LEU  64          HD12      LEU  64   3.638  -4.331  -0.823
  509   3HD1  LEU  64          HD13      LEU  64   2.206  -5.320  -1.115
  510   1HD2  LEU  64          HD21      LEU  64   2.819  -5.893  -4.686
  511   2HD2  LEU  64          HD22      LEU  64   1.778  -4.610  -4.072
  512   3HD2  LEU  64          HD23      LEU  64   1.734  -6.211  -3.330
  513    H    THR  65           HN       THR  65   4.853  -3.246  -7.017
  514    HA   THR  65           HA       THR  65   7.449  -2.091  -7.165
  515    HB   THR  65           HB       THR  65   6.536  -1.429  -9.417
  516    HG1  THR  65           HG1      THR  65   4.390  -1.409  -9.356
  517   1HG2  THR  65          HG21      THR  65   7.744  -3.535  -9.032
  518   2HG2  THR  65          HG22      THR  65   6.432  -3.749 -10.210
  519   3HG2  THR  65          HG23      THR  65   6.221  -4.277  -8.533
  520    H    LEU  66           HN       LEU  66   6.210  -0.915  -5.121
  521    HA   LEU  66           HA       LEU  66   5.791   1.003  -4.082
  522   1HB   LEU  66          HB2       LEU  66   7.827   1.653  -5.530
  523   2HB   LEU  66          HB1       LEU  66   6.684   2.529  -6.522
  524    HG   LEU  66           HG       LEU  66   7.887   3.985  -4.913
  525   1HD1  LEU  66          HD11      LEU  66   5.703   4.670  -5.667
  526   2HD1  LEU  66          HD12      LEU  66   5.942   5.140  -3.977
  527   3HD1  LEU  66          HD13      LEU  66   4.945   3.735  -4.383
  528   1HD2  LEU  66          HD21      LEU  66   6.451   2.354  -2.830
  529   2HD2  LEU  66          HD22      LEU  66   7.371   3.826  -2.527
  530   3HD2  LEU  66          HD23      LEU  66   8.190   2.382  -3.124
  531    H    ARG  67           HN       ARG  67   4.727   1.657  -7.437
  532    HA   ARG  67           HA       ARG  67   2.420   2.925  -6.284
  533   1HB   ARG  67          HB2       ARG  67   3.367   2.686  -9.112
  534   2HB   ARG  67          HB1       ARG  67   1.694   3.126  -8.792
  535   1HG   ARG  67          HG2       ARG  67   4.102   4.596  -7.725
  536   2HG   ARG  67          HG1       ARG  67   3.129   5.100  -9.112
  537   1HD   ARG  67          HD2       ARG  67   1.142   5.191  -7.638
  538   2HD   ARG  67          HD1       ARG  67   2.151   4.722  -6.295
  539    HE   ARG  67           HE       ARG  67   3.200   6.813  -6.307
  540   1HH1  ARG  67          HH11      ARG  67   0.668   6.724  -8.803
  541   2HH1  ARG  67          HH12      ARG  67   0.339   8.383  -8.710
  542   1HH2  ARG  67          HH21      ARG  67   2.690   9.178  -6.199
  543   2HH2  ARG  67          HH22      ARG  67   1.505   9.770  -7.245
  544    H    LYS  68           HN       LYS  68   3.223  -0.149  -7.019
  545    HA   LYS  68           HA       LYS  68   0.580  -1.144  -7.496
  546   1HB   LYS  68          HB2       LYS  68   2.826  -2.364  -7.923
  547   2HB   LYS  68          HB1       LYS  68   2.810  -2.698  -6.198
  548   1HG   LYS  68          HG2       LYS  68   0.681  -3.882  -6.442
  549   2HG   LYS  68          HG1       LYS  68   0.715  -3.562  -8.176
  550   1HD   LYS  68          HD2       LYS  68   2.745  -5.141  -6.615
  551   2HD   LYS  68          HD1       LYS  68   1.501  -5.836  -7.656
  552   1HE   LYS  68          HE2       LYS  68   3.817  -4.080  -8.504
  553   2HE   LYS  68          HE1       LYS  68   3.670  -5.804  -8.782
  554   1HZ   LYS  68          HZ1       LYS  68   1.887  -3.715  -9.969
  555   2HZ   LYS  68          HZ2       LYS  68   1.781  -5.375 -10.226
  556   3HZ   LYS  68          HZ3       LYS  68   3.145  -4.521 -10.745
  557    H    LEU  69           HN       LEU  69   2.362  -0.023  -4.838
  558    HA   LEU  69           HA       LEU  69   1.053  -1.254  -2.669
  559   1HB   LEU  69          HB2       LEU  69   2.447   1.391  -2.918
  560   2HB   LEU  69          HB1       LEU  69   1.490   1.070  -1.497
  561    HG   LEU  69           HG       LEU  69   3.823   0.697  -1.045
  562   1HD1  LEU  69          HD11      LEU  69   2.261  -0.664   0.146
  563   2HD1  LEU  69          HD12      LEU  69   3.748  -1.555  -0.161
  564   3HD1  LEU  69          HD13      LEU  69   2.307  -1.884  -1.127
  565   1HD2  LEU  69          HD21      LEU  69   5.100  -1.090  -2.108
  566   2HD2  LEU  69          HD22      LEU  69   4.612   0.141  -3.280
  567   3HD2  LEU  69          HD23      LEU  69   3.755  -1.397  -3.205
  568    H    GLN  70           HN       GLN  70   0.128   1.562  -4.595
  569    HA   GLN  70           HA       GLN  70  -2.187   1.980  -2.934
  570   1HB   GLN  70          HB2       GLN  70  -2.783   3.784  -4.577
  571   2HB   GLN  70          HB1       GLN  70  -1.264   3.988  -3.731
  572   1HG   GLN  70          HG2       GLN  70  -0.025   3.410  -5.615
  573   2HG   GLN  70          HG1       GLN  70  -1.468   2.870  -6.514
  574   1HE2  GLN  70          HE21      GLN  70  -1.155   4.300  -8.183
  575   2HE2  GLN  70          HE22      GLN  70  -1.367   6.009  -7.963
  576    H    GLU  71           HN       GLU  71  -1.614  -0.286  -5.066
  577    HA   GLU  71           HA       GLU  71  -4.378  -0.380  -6.075
  578   1HB   GLU  71          HB2       GLU  71  -2.340  -0.760  -7.620
  579   2HB   GLU  71          HB1       GLU  71  -2.078  -2.242  -6.723
  580   1HG   GLU  71          HG2       GLU  71  -3.207  -2.745  -8.764
  581   2HG   GLU  71          HG1       GLU  71  -4.320  -3.016  -7.426
  582    H    MET  72           HN       MET  72  -2.095  -1.642  -3.894
  583    HA   MET  72           HA       MET  72  -3.924  -3.733  -2.959
  584   1HB   MET  72          HB2       MET  72  -0.930  -3.408  -2.625
  585   2HB   MET  72          HB1       MET  72  -1.883  -4.655  -1.843
  586   1HG   MET  72          HG2       MET  72  -1.510  -4.315  -4.814
  587   2HG   MET  72          HG1       MET  72  -0.699  -5.497  -3.795
  588   1HE   MET  72          HE1       MET  72  -3.141  -7.746  -5.856
  589   2HE   MET  72          HE2       MET  72  -1.470  -7.484  -5.358
  590   3HE   MET  72          HE3       MET  72  -2.265  -6.322  -6.419
  591    H    SER  73           HN       SER  73  -3.840  -0.740  -2.453
  592    HA   SER  73           HA       SER  73  -2.860  -0.542   0.211
  593   1HB   SER  73          HB2       SER  73  -3.712   1.842   0.063
  594   2HB   SER  73          HB1       SER  73  -2.463   1.378  -1.082
  595    HG   SER  73           HG       SER  73  -4.123   2.572  -1.993
  596    H    SER  74           HN       SER  74  -5.486  -1.903  -0.908
  597    HA   SER  74           HA       SER  74  -7.356  -2.755   0.077
  598   1HB   SER  74          HB2       SER  74  -5.720  -3.042   1.996
  599   2HB   SER  74          HB1       SER  74  -6.269  -1.499   2.631
  600    HG   SER  74           HG       SER  74  -7.951  -3.729   2.142
  601    H    LYS  75           HN       LYS  75  -7.328  -0.139  -1.135
  602    HA   LYS  75           HA       LYS  75  -9.137   1.491   0.433
  603   1HB   LYS  75          HB2       LYS  75  -7.869   1.893  -2.278
  604   2HB   LYS  75          HB1       LYS  75  -8.952   3.053  -1.510
  605   1HG   LYS  75          HG2       LYS  75  -6.378   2.099  -0.292
  606   2HG   LYS  75          HG1       LYS  75  -6.529   3.562  -1.270
  607   1HD   LYS  75          HD2       LYS  75  -8.021   4.544   0.299
  608   2HD   LYS  75          HD1       LYS  75  -8.189   3.025   1.176
  609   1HE   LYS  75          HE2       LYS  75  -5.594   4.513   0.902
  610   2HE   LYS  75          HE1       LYS  75  -6.710   4.735   2.249
  611   1HZ   LYS  75          HZ1       LYS  75  -6.505   2.396   2.752
  612   2HZ   LYS  75          HZ2       LYS  75  -4.987   3.118   2.836
  613   3HZ   LYS  75          HZ3       LYS  75  -5.404   2.141   1.526
  614    H    ALA  76           HN       ALA  76 -11.096   0.687   0.478
  615    HA   ALA  76           HA       ALA  76 -12.287  -0.639  -1.760
  616   1HB   ALA  76          HB1       ALA  76 -13.581   0.414   0.768
  617   2HB   ALA  76          HB2       ALA  76 -12.953  -1.218   0.535
  618   3HB   ALA  76          HB3       ALA  76 -14.340  -0.663  -0.405
  619    H    GLY  77           HN       GLY  77 -13.000   2.412  -0.075
  620   1HA   GLY  77          HA2       GLY  77 -13.507   4.453  -0.999
  621   2HA   GLY  77          HA1       GLY  77 -13.424   3.725  -2.603
  622    H    SER  78           HN       SER  78 -15.404   5.323  -2.424
  623    HA   SER  78           HA       SER  78 -17.698   3.631  -2.567
  624   1HB   SER  78          HB2       SER  78 -17.681   5.944  -0.590
  625   2HB   SER  78          HB1       SER  78 -19.101   5.003  -1.045
  626    HG   SER  78           HG       SER  78 -17.069   3.412  -0.277
  627    H    ASP  79           HN       ASP  79 -17.849   4.176  -4.665
  628    HA   ASP  79           HA       ASP  79 -17.448   6.809  -5.645
  629   1HB   ASP  79          HB2       ASP  79 -17.160   4.809  -7.068
  630   2HB   ASP  79          HB1       ASP  79 -18.896   4.511  -6.981
  631    H    THR  80           HN       THR  80 -18.850   8.444  -5.970
  632    HA   THR  80           HA       THR  80 -21.614   7.950  -5.107
  633    HB   THR  80           HB       THR  80 -20.143  10.558  -4.667
  634    HG1  THR  80           HG1      THR  80 -19.593   8.169  -3.543
  635   1HG2  THR  80          HG21      THR  80 -21.774  10.786  -2.833
  636   2HG2  THR  80          HG22      THR  80 -22.433   9.195  -3.215
  637   3HG2  THR  80          HG23      THR  80 -22.606  10.518  -4.368
  638    H    GLU  81           HN       GLU  81 -20.368   7.984  -7.839
  639    HA   GLU  81           HA       GLU  81 -21.334  10.473  -8.921
  640   1HB   GLU  81          HB2       GLU  81 -19.198   9.480  -9.727
  641   2HB   GLU  81          HB1       GLU  81 -20.095   8.096 -10.329
  642   1HG   GLU  81          HG2       GLU  81 -19.506   9.729 -12.072
  643   2HG   GLU  81          HG1       GLU  81 -21.248   9.473 -11.922
  644    H    LEU  82           HN       LEU  82 -23.011  10.625 -10.323
  645    HA   LEU  82           HA       LEU  82 -25.057  10.301 -11.158
  646   1HB   LEU  82          HB2       LEU  82 -24.061   8.382 -12.341
  647   2HB   LEU  82          HB1       LEU  82 -24.431   7.349 -10.976
  648    HG   LEU  82           HG       LEU  82 -26.849   7.793 -11.374
  649   1HD1  LEU  82          HD11      LEU  82 -25.838   9.101 -13.889
  650   2HD1  LEU  82          HD12      LEU  82 -26.654   9.903 -12.546
  651   3HD1  LEU  82          HD13      LEU  82 -27.522   8.724 -13.528
  652   1HD2  LEU  82          HD21      LEU  82 -27.015   6.324 -13.321
  653   2HD2  LEU  82          HD22      LEU  82 -25.786   5.765 -12.187
  654   3HD2  LEU  82          HD23      LEU  82 -25.308   6.593 -13.669
  655    H    ALA  83           HN       ALA  83 -26.651  10.926  -9.937
  656    HA   ALA  83           HA       ALA  83 -27.116   9.687  -7.350
  657   1HB   ALA  83          HB1       ALA  83 -28.353  12.139  -8.605
  658   2HB   ALA  83          HB2       ALA  83 -26.975  12.132  -7.504
  659   3HB   ALA  83          HB3       ALA  83 -28.560  11.611  -6.937
  660    H    ALA  84           HN       ALA  84 -27.824   8.439  -9.927
  661    HA   ALA  84           HA       ALA  84 -30.725   8.274  -9.810
  662   1HB   ALA  84          HB1       ALA  84 -28.748   6.821 -11.591
  663   2HB   ALA  84          HB2       ALA  84 -29.652   8.268 -12.029
  664   3HB   ALA  84          HB3       ALA  84 -30.506   6.750 -11.736
  665    HA   PRO  85           HA       PRO  85 -30.155   4.869  -7.012
  666   1HB   PRO  85          HB2       PRO  85 -32.709   4.507  -6.340
  667   2HB   PRO  85          HB1       PRO  85 -31.838   5.964  -5.843
  668   1HG   PRO  85          HG2       PRO  85 -33.827   5.598  -8.037
  669   2HG   PRO  85          HG1       PRO  85 -33.606   6.968  -6.939
  670   1HD   PRO  85          HD2       PRO  85 -32.649   6.816  -9.550
  671   2HD   PRO  85          HD1       PRO  85 -32.078   7.945  -8.309
  672    H    LYS  86           HN       LYS  86 -31.076   2.664  -6.738
  673    HA   LYS  86           HA       LYS  86 -31.453   1.385  -9.314
  674   1HB   LYS  86          HB2       LYS  86 -31.208   0.174  -6.545
  675   2HB   LYS  86          HB1       LYS  86 -31.117  -0.696  -8.071
  676   1HG   LYS  86          HG2       LYS  86 -29.048   0.445  -8.627
  677   2HG   LYS  86          HG1       LYS  86 -29.152   1.390  -7.142
  678   1HD   LYS  86          HD2       LYS  86 -29.081  -0.744  -5.861
  679   2HD   LYS  86          HD1       LYS  86 -28.818  -1.597  -7.384
  680   1HE   LYS  86          HE2       LYS  86 -26.765  -0.332  -7.749
  681   2HE   LYS  86          HE1       LYS  86 -27.037   0.558  -6.252
  682   1HZ   LYS  86          HZ1       LYS  86 -25.460  -1.224  -5.869
  683   2HZ   LYS  86          HZ2       LYS  86 -26.549  -2.355  -6.506
  684   3HZ   LYS  86          HZ3       LYS  86 -26.910  -1.567  -5.061
  685    H    SER  87           HN       SER  87 -33.468   1.744  -9.904
  686    HA   SER  87           HA       SER  87 -35.584   1.643  -7.917
  687   1HB   SER  87          HB2       SER  87 -35.505   3.608  -9.415
  688   2HB   SER  87          HB1       SER  87 -35.679   2.552 -10.809
  689    HG   SER  87           HG       SER  87 -37.585   2.660  -8.709
  690    H    LYS  88           HN       LYS  88 -35.422   0.517 -11.324
  691    HA   LYS  88           HA       LYS  88 -36.662  -1.889 -10.266
  692   1HB   LYS  88          HB2       LYS  88 -37.839  -2.192 -12.449
  693   2HB   LYS  88          HB1       LYS  88 -38.352  -0.789 -11.531
  694   1HG   LYS  88          HG2       LYS  88 -36.995   0.641 -13.006
  695   2HG   LYS  88          HG1       LYS  88 -36.532  -0.787 -13.934
  696   1HD   LYS  88          HD2       LYS  88 -38.911  -1.193 -14.438
  697   2HD   LYS  88          HD1       LYS  88 -39.329   0.284 -13.567
  698   1HE   LYS  88          HE2       LYS  88 -37.935   1.572 -15.133
  699   2HE   LYS  88          HE1       LYS  88 -37.575   0.090 -16.013
  700   1HZ   LYS  88          HZ1       LYS  88 -39.308   1.264 -17.120
  701   2HZ   LYS  88          HZ2       LYS  88 -40.204   1.395 -15.689
  702   3HZ   LYS  88          HZ3       LYS  88 -40.004  -0.123 -16.418
  703    H    ASN  89           HN       ASN  89 -34.583  -2.620  -9.894
  704    HA   ASN  89           HA       ASN  89 -33.557  -4.064 -12.181
  705   1HB   ASN  89          HB2       ASN  89 -31.939  -2.208 -10.476
  706   2HB   ASN  89          HB1       ASN  89 -31.186  -3.700 -11.033
  707   1HD2  ASN  89          HD21      ASN  89 -30.510  -0.945 -11.760
  708   2HD2  ASN  89          HD22      ASN  89 -30.708  -0.883 -13.471
  Start of MODEL   26
    1   1H    GLY   1          HT1       GLY   1 -13.032  10.163  10.024
    2   2H    GLY   1          HT2       GLY   1 -12.389  10.179  11.602
    3   3H    GLY   1          HT3       GLY   1 -11.416   9.701  10.341
    4   1HA   GLY   1          HA1       GLY   1 -11.600  11.993   9.434
    5   2HA   GLY   1          HA2       GLY   1 -12.546  12.396  10.865
    6    H    ASP   2           HN       ASP   2 -10.446  13.894  10.575
    7    HA   ASP   2           HA       ASP   2  -8.614  14.732  11.606
    8   1HB   ASP   2          HB2       ASP   2  -9.302  13.911  13.783
    9   2HB   ASP   2          HB1       ASP   2  -8.804  12.273  13.382
   10    H    GLY   3           HN       GLY   3  -8.040  11.272  11.601
   11   1HA   GLY   3          HA2       GLY   3  -5.865  11.717   9.679
   12   2HA   GLY   3          HA1       GLY   3  -5.712  10.575  11.023
   13    H    GLU   4           HN       GLU   4  -5.504   9.623   8.419
   14    HA   GLU   4           HA       GLU   4  -8.153   8.495   8.020
   15   1HB   GLU   4          HB2       GLU   4  -7.035   9.585   6.088
   16   2HB   GLU   4          HB1       GLU   4  -5.767   8.370   6.181
   17   1HG   GLU   4          HG2       GLU   4  -7.399   7.858   4.446
   18   2HG   GLU   4          HG1       GLU   4  -7.370   6.624   5.702
   19    H    ALA   5           HN       ALA   5  -8.578   6.498   8.496
   20    HA   ALA   5           HA       ALA   5  -6.600   4.826   9.706
   21   1HB   ALA   5          HB1       ALA   5  -8.463   3.225   9.954
   22   2HB   ALA   5          HB2       ALA   5  -9.483   4.267   8.964
   23   3HB   ALA   5          HB3       ALA   5  -8.917   4.827  10.536
   24    H    GLN   6           HN       GLN   6  -5.160   4.116   8.370
   25    HA   GLN   6           HA       GLN   6  -4.111   3.020   6.778
   26   1HB   GLN   6          HB2       GLN   6  -5.671   1.189   7.125
   27   2HB   GLN   6          HB1       GLN   6  -6.827   1.941   6.041
   28   1HG   GLN   6          HG2       GLN   6  -5.432   1.530   4.164
   29   2HG   GLN   6          HG1       GLN   6  -4.106   1.000   5.203
   30   1HE2  GLN   6          HE21      GLN   6  -4.071  -0.978   4.120
   31   2HE2  GLN   6          HE22      GLN   6  -5.285  -2.166   4.403
   32    H    ARG   7           HN       ARG   7  -3.283   4.529   5.733
   33    HA   ARG   7           HA       ARG   7  -4.624   6.169   3.771
   34   1HB   ARG   7          HB2       ARG   7  -2.493   7.271   3.608
   35   2HB   ARG   7          HB1       ARG   7  -2.780   6.941   5.316
   36   1HG   ARG   7          HG2       ARG   7  -1.378   4.882   5.064
   37   2HG   ARG   7          HG1       ARG   7  -0.969   5.428   3.443
   38   1HD   ARG   7          HD2       ARG   7   0.809   6.175   4.714
   39   2HD   ARG   7          HD1       ARG   7  -0.228   7.595   4.614
   40    HE   ARG   7           HE       ARG   7  -1.016   6.288   6.880
   41   1HH1  ARG   7          HH11      ARG   7   1.902   7.868   5.653
   42   2HH1  ARG   7          HH12      ARG   7   2.597   8.145   7.180
   43   1HH2  ARG   7          HH21      ARG   7  -0.008   6.577   9.047
   44   2HH2  ARG   7          HH22      ARG   7   1.549   7.288   9.123
   45    H    ASP   8           HN       ASP   8  -3.095   6.386   1.648
   46    HA   ASP   8           HA       ASP   8  -3.136   3.905   0.220
   47   1HB   ASP   8          HB2       ASP   8  -1.461   6.334  -0.485
   48   2HB   ASP   8          HB1       ASP   8  -2.105   5.115  -1.577
   49    H    LEU   9           HN       LEU   9  -1.401   2.451   0.019
   50    HA   LEU   9           HA       LEU   9   0.529   2.523   2.052
   51   1HB   LEU   9          HB2       LEU   9   0.587   0.877  -0.468
   52   2HB   LEU   9          HB1       LEU   9   1.606   0.622   0.929
   53    HG   LEU   9           HG       LEU   9  -1.380   0.270   0.792
   54   1HD1  LEU   9          HD11      LEU   9   0.865  -1.697   1.195
   55   2HD1  LEU   9          HD12      LEU   9  -0.125  -1.519  -0.254
   56   3HD1  LEU   9          HD13      LEU   9  -0.857  -2.070   1.254
   57   1HD2  LEU   9          HD21      LEU   9  -1.217  -0.504   3.103
   58   2HD2  LEU   9          HD22      LEU   9  -0.738   1.192   2.942
   59   3HD2  LEU   9          HD23      LEU   9   0.491  -0.057   3.128
   60    H    VAL  10           HN       VAL  10   0.603   3.833  -1.107
   61    HA   VAL  10           HA       VAL  10   3.387   4.171  -1.332
   62    HB   VAL  10           HB       VAL  10   1.082   5.675  -2.616
   63   1HG1  VAL  10          HG11      VAL  10   4.020   5.853  -3.319
   64   2HG1  VAL  10          HG12      VAL  10   3.059   7.147  -2.603
   65   3HG1  VAL  10          HG13      VAL  10   2.693   6.572  -4.232
   66   1HG2  VAL  10          HG21      VAL  10   1.276   3.354  -3.190
   67   2HG2  VAL  10          HG22      VAL  10   2.973   3.574  -3.624
   68   3HG2  VAL  10          HG23      VAL  10   1.710   4.367  -4.566
   69    H    LYS  11           HN       LYS  11   0.974   5.871   0.495
   70    HA   LYS  11           HA       LYS  11   2.561   8.268   0.858
   71   1HB   LYS  11          HB2       LYS  11   0.094   7.414   2.392
   72   2HB   LYS  11          HB1       LYS  11   0.763   9.032   2.225
   73   1HG   LYS  11          HG2       LYS  11  -0.429   7.428  -0.027
   74   2HG   LYS  11          HG1       LYS  11  -1.279   8.669   0.884
   75   1HD   LYS  11          HD2       LYS  11   0.267  10.353   0.092
   76   2HD   LYS  11          HD1       LYS  11   1.230   9.122  -0.730
   77   1HE   LYS  11          HE2       LYS  11  -0.255  10.355  -2.280
   78   2HE   LYS  11          HE1       LYS  11  -0.612   8.632  -2.232
   79   1HZ   LYS  11          HZ1       LYS  11  -2.590  10.117  -2.203
   80   2HZ   LYS  11          HZ2       LYS  11  -2.134  10.639  -0.645
   81   3HZ   LYS  11          HZ3       LYS  11  -2.538   9.027  -0.930
   82    H    ALA  12           HN       ALA  12   3.042   5.320   1.845
   83    HA   ALA  12           HA       ALA  12   4.239   6.122   4.391
   84   1HB   ALA  12          HB1       ALA  12   2.922   3.460   3.803
   85   2HB   ALA  12          HB2       ALA  12   2.283   4.718   4.865
   86   3HB   ALA  12          HB3       ALA  12   3.772   3.881   5.293
   87    H    VAL  13           HN       VAL  13   4.210   3.564   1.907
   88    HA   VAL  13           HA       VAL  13   6.857   2.717   2.350
   89    HB   VAL  13           HB       VAL  13   5.068   2.348  -0.069
   90   1HG1  VAL  13          HG11      VAL  13   6.541   0.500  -0.680
   91   2HG1  VAL  13          HG12      VAL  13   7.618   0.905   0.658
   92   3HG1  VAL  13          HG13      VAL  13   7.409   2.037  -0.682
   93   1HG2  VAL  13          HG21      VAL  13   5.688   0.547   2.262
   94   2HG2  VAL  13          HG22      VAL  13   4.677   0.124   0.877
   95   3HG2  VAL  13          HG23      VAL  13   4.172   1.403   1.985
   96    H    ALA  14           HN       ALA  14   5.499   4.825  -0.210
   97    HA   ALA  14           HA       ALA  14   8.076   5.328  -1.306
   98   1HB   ALA  14          HB1       ALA  14   6.950   7.064  -2.660
   99   2HB   ALA  14          HB2       ALA  14   5.507   6.903  -1.656
  100   3HB   ALA  14          HB3       ALA  14   6.010   5.568  -2.670
  101    H    HIS  15           HN       HIS  15   6.156   6.598   1.190
  102    HA   HIS  15           HA       HIS  15   7.324   9.132   1.622
  103   1HB   HIS  15          HB2       HIS  15   5.152   8.190   2.596
  104   2HB   HIS  15          HB1       HIS  15   6.144   7.305   3.735
  105    HD1  HIS  15           HD1      HIS  15   4.355  10.378   3.298
  106    HD2  HIS  15           HD2      HIS  15   7.680   9.203   5.486
  107    HE1  HIS  15           HE1      HIS  15   4.617  12.102   5.098
  108    HE2  HIS  15           HE2      HIS  15   6.901  11.624   5.933
  109    H    ILE  16           HN       ILE  16   8.234   5.862   2.572
  110    HA   ILE  16           HA       ILE  16  10.234   6.391   4.484
  111    HB   ILE  16           HB       ILE  16  10.222   4.154   2.421
  112   1HG1  ILE  16          HG12      ILE  16   8.148   4.083   3.677
  113   2HG1  ILE  16          HG11      ILE  16   9.182   2.750   4.170
  114   1HG2  ILE  16          HG21      ILE  16  11.591   2.891   4.021
  115   2HG2  ILE  16          HG22      ILE  16  11.650   4.307   5.069
  116   3HG2  ILE  16          HG23      ILE  16  12.389   4.365   3.468
  117   1HD1  ILE  16          HD11      ILE  16   8.754   5.321   5.664
  118   2HD1  ILE  16          HD12      ILE  16   9.806   4.002   6.174
  119   3HD1  ILE  16          HD13      ILE  16   8.062   3.750   6.064
  120    H    LEU  17           HN       LEU  17  10.276   6.270   1.008
  121    HA   LEU  17           HA       LEU  17  13.126   6.688   0.798
  122   1HB   LEU  17          HB2       LEU  17  10.997   6.664  -1.339
  123   2HB   LEU  17          HB1       LEU  17  12.728   6.606  -1.611
  124    HG   LEU  17           HG       LEU  17  11.095   4.467  -0.244
  125   1HD1  LEU  17          HD11      LEU  17  10.621   4.588  -2.617
  126   2HD1  LEU  17          HD12      LEU  17  11.549   3.137  -2.239
  127   3HD1  LEU  17          HD13      LEU  17  12.346   4.530  -2.977
  128   1HD2  LEU  17          HD21      LEU  17  13.133   3.117  -0.362
  129   2HD2  LEU  17          HD22      LEU  17  13.385   4.566   0.609
  130   3HD2  LEU  17          HD23      LEU  17  14.009   4.490  -1.039
  131    H    GLY  18           HN       GLY  18  10.178   8.540   0.470
  132   1HA   GLY  18          HA2       GLY  18  10.349  10.922   1.049
  133   2HA   GLY  18          HA1       GLY  18  11.821  10.968   0.087
  134    H    ILE  19           HN       ILE  19   9.607   8.982  -1.342
  135    HA   ILE  19           HA       ILE  19   8.904  11.072  -3.225
  136    HB   ILE  19           HB       ILE  19   8.056   8.969  -4.561
  137   1HG1  ILE  19          HG12      ILE  19  10.270   7.790  -2.865
  138   2HG1  ILE  19          HG11      ILE  19   8.575   7.327  -2.810
  139   1HG2  ILE  19          HG21      ILE  19  10.233   8.901  -5.709
  140   2HG2  ILE  19          HG22      ILE  19  10.917   9.880  -4.397
  141   3HG2  ILE  19          HG23      ILE  19   9.600  10.513  -5.399
  142   1HD1  ILE  19          HD11      ILE  19   9.901   5.711  -4.038
  143   2HD1  ILE  19          HD12      ILE  19  10.437   6.973  -5.151
  144   3HD1  ILE  19          HD13      ILE  19   8.739   6.498  -5.105
  145    H    ARG  20           HN       ARG  20   6.786  10.789  -4.315
  146    HA   ARG  20           HA       ARG  20   4.598   9.746  -2.740
  147   1HB   ARG  20          HB2       ARG  20   5.222  11.834  -1.512
  148   2HB   ARG  20          HB1       ARG  20   4.962  12.736  -2.993
  149   1HG   ARG  20          HG2       ARG  20   2.580  11.799  -2.919
  150   2HG   ARG  20          HG1       ARG  20   2.949  11.379  -1.243
  151   1HD   ARG  20          HD2       ARG  20   1.884  13.543  -1.285
  152   2HD   ARG  20          HD1       ARG  20   3.584  13.752  -0.846
  153    HE   ARG  20           HE       ARG  20   3.498  14.011  -3.580
  154   1HH1  ARG  20          HH11      ARG  20   2.258  15.885  -0.816
  155   2HH1  ARG  20          HH12      ARG  20   1.995  17.283  -1.753
  156   1HH2  ARG  20          HH21      ARG  20   3.118  15.898  -4.817
  157   2HH2  ARG  20          HH22      ARG  20   2.428  17.272  -4.073
  158    H    ASP  21           HN       ASP  21   5.700  12.111  -5.092
  159    HA   ASP  21           HA       ASP  21   3.272  12.130  -6.584
  160   1HB   ASP  21          HB2       ASP  21   5.947  13.395  -7.193
  161   2HB   ASP  21          HB1       ASP  21   4.444  13.721  -8.044
  162    H    LEU  22           HN       LEU  22   6.511  10.884  -7.023
  163    HA   LEU  22           HA       LEU  22   7.358   9.277  -8.411
  164   1HB   LEU  22          HB2       LEU  22   4.456   8.525  -8.352
  165   2HB   LEU  22          HB1       LEU  22   5.549   7.682  -9.423
  166    HG   LEU  22           HG       LEU  22   5.146   6.448  -7.392
  167   1HD1  LEU  22          HD11      LEU  22   7.248   6.174  -8.515
  168   2HD1  LEU  22          HD12      LEU  22   7.488   6.044  -6.771
  169   3HD1  LEU  22          HD13      LEU  22   7.935   7.527  -7.626
  170   1HD2  LEU  22          HD21      LEU  22   6.021   7.200  -5.226
  171   2HD2  LEU  22          HD22      LEU  22   4.750   8.273  -5.819
  172   3HD2  LEU  22          HD23      LEU  22   6.438   8.758  -5.938
  173    H    ALA  23           HN       ALA  23   6.896  11.793  -9.475
  174    HA   ALA  23           HA       ALA  23   5.666  11.472 -12.062
  175   1HB   ALA  23          HB1       ALA  23   5.363  13.571 -10.831
  176   2HB   ALA  23          HB2       ALA  23   6.129  13.842 -12.396
  177   3HB   ALA  23          HB3       ALA  23   7.099  13.869 -10.924
  178    H    GLY  24           HN       GLY  24   8.665  11.144 -10.738
  179   1HA   GLY  24          HA2       GLY  24   9.801  10.667 -13.386
  180   2HA   GLY  24          HA1       GLY  24  10.660  11.822 -12.362
  181    H    ILE  25           HN       ILE  25   9.022   8.873 -11.480
  182    HA   ILE  25           HA       ILE  25  11.604   7.720 -10.673
  183    HB   ILE  25           HB       ILE  25   9.020   7.525  -9.084
  184   1HG1  ILE  25          HG12      ILE  25  10.062   9.762  -8.884
  185   2HG1  ILE  25          HG11      ILE  25  10.071   8.879  -7.366
  186   1HG2  ILE  25          HG21      ILE  25  11.769   6.459  -8.434
  187   2HG2  ILE  25          HG22      ILE  25  10.355   5.505  -8.884
  188   3HG2  ILE  25          HG23      ILE  25  10.367   6.397  -7.362
  189   1HD1  ILE  25          HD11      ILE  25  12.149  10.067  -7.704
  190   2HD1  ILE  25          HD12      ILE  25  12.410   9.217  -9.229
  191   3HD1  ILE  25          HD13      ILE  25  12.416   8.326  -7.705
  192    H    ASN  26           HN       ASN  26  11.768   5.587 -11.125
  193    HA   ASN  26           HA       ASN  26   9.966   4.447 -13.008
  194   1HB   ASN  26          HB2       ASN  26  12.347   3.864 -13.042
  195   2HB   ASN  26          HB1       ASN  26  12.212   3.148 -11.440
  196   1HD2  ASN  26          HD21      ASN  26  11.438   2.778 -14.818
  197   2HD2  ASN  26          HD22      ASN  26  11.044   1.112 -14.743
  198    H    LEU  27           HN       LEU  27   8.122   3.563 -12.615
  199    HA   LEU  27           HA       LEU  27   7.160   3.206  -9.935
  200   1HB   LEU  27          HB2       LEU  27   5.829   2.427 -12.524
  201   2HB   LEU  27          HB1       LEU  27   5.053   2.661 -10.974
  202    HG   LEU  27           HG       LEU  27   6.317   4.820 -12.667
  203   1HD1  LEU  27          HD11      LEU  27   4.019   5.609 -12.952
  204   2HD1  LEU  27          HD12      LEU  27   3.435   4.206 -12.056
  205   3HD1  LEU  27          HD13      LEU  27   4.248   3.987 -13.605
  206   1HD2  LEU  27          HD21      LEU  27   6.528   5.308 -10.280
  207   2HD2  LEU  27          HD22      LEU  27   4.797   5.031 -10.071
  208   3HD2  LEU  27          HD23      LEU  27   5.360   6.381 -11.051
  209    H    ASP  28           HN       ASP  28   8.423   1.204 -12.415
  210    HA   ASP  28           HA       ASP  28   7.214  -1.243 -11.480
  211   1HB   ASP  28          HB2       ASP  28   9.246  -0.798 -13.662
  212   2HB   ASP  28          HB1       ASP  28   8.427  -2.318 -13.324
  213    H    SER  29           HN       SER  29   9.468   0.378 -10.049
  214    HA   SER  29           HA       SER  29  11.510  -1.607  -9.771
  215   1HB   SER  29          HB2       SER  29  10.898   0.839  -8.087
  216   2HB   SER  29          HB1       SER  29  12.389  -0.105  -8.047
  217    HG   SER  29           HG       SER  29  11.573   0.853 -10.520
  218    H    SER  30           HN       SER  30  11.412  -3.292  -8.462
  219    HA   SER  30           HA       SER  30   9.050  -3.975  -7.049
  220   1HB   SER  30          HB2       SER  30  10.415  -5.930  -6.285
  221   2HB   SER  30          HB1       SER  30  10.482  -5.702  -8.027
  222    HG   SER  30           HG       SER  30  12.485  -4.849  -7.870
  223    H    LEU  31           HN       LEU  31   8.793  -4.241  -4.764
  224    HA   LEU  31           HA       LEU  31   9.738  -2.227  -3.139
  225   1HB   LEU  31          HB2       LEU  31   7.773  -3.807  -2.800
  226   2HB   LEU  31          HB1       LEU  31   8.933  -4.956  -2.164
  227    HG   LEU  31           HG       LEU  31   9.570  -3.282  -0.438
  228   1HD1  LEU  31          HD11      LEU  31   8.072  -1.383  -0.102
  229   2HD1  LEU  31          HD12      LEU  31   7.217  -1.839  -1.587
  230   3HD1  LEU  31          HD13      LEU  31   8.898  -1.317  -1.667
  231   1HD2  LEU  31          HD21      LEU  31   6.657  -4.018  -0.538
  232   2HD2  LEU  31          HD22      LEU  31   7.563  -3.555   0.902
  233   3HD2  LEU  31          HD23      LEU  31   7.964  -5.045   0.048
  234    H    ALA  32           HN       ALA  32  11.006  -5.419  -3.762
  235    HA   ALA  32           HA       ALA  32  13.000  -5.390  -1.773
  236   1HB   ALA  32          HB1       ALA  32  12.274  -7.451  -2.855
  237   2HB   ALA  32          HB2       ALA  32  14.020  -7.233  -2.996
  238   3HB   ALA  32          HB3       ALA  32  12.973  -6.898  -4.377
  239    H    ASP  33           HN       ASP  33  12.904  -4.221  -5.105
  240    HA   ASP  33           HA       ASP  33  15.657  -3.841  -5.362
  241   1HB   ASP  33          HB2       ASP  33  14.128  -3.883  -7.299
  242   2HB   ASP  33          HB1       ASP  33  13.499  -2.312  -6.811
  243    H    LEU  34           HN       LEU  34  13.090  -1.957  -4.105
  244    HA   LEU  34           HA       LEU  34  14.244   0.603  -3.840
  245   1HB   LEU  34          HB2       LEU  34  12.039  -0.868  -2.486
  246   2HB   LEU  34          HB1       LEU  34  12.583   0.643  -1.811
  247    HG   LEU  34           HG       LEU  34  11.669   1.898  -3.558
  248   1HD1  LEU  34          HD11      LEU  34  11.006   1.011  -5.723
  249   2HD1  LEU  34          HD12      LEU  34  11.514  -0.606  -5.236
  250   3HD1  LEU  34          HD13      LEU  34  12.714   0.670  -5.436
  251   1HD2  LEU  34          HD21      LEU  34   9.425   1.000  -3.899
  252   2HD2  LEU  34          HD22      LEU  34   9.971   0.862  -2.222
  253   3HD2  LEU  34          HD23      LEU  34   9.987  -0.553  -3.277
  254    H    GLY  35           HN       GLY  35  14.565  -2.286  -1.987
  255   1HA   GLY  35          HA2       GLY  35  16.656  -2.391  -0.687
  256   2HA   GLY  35          HA1       GLY  35  16.215  -0.810  -0.055
  257    H    LEU  36           HN       LEU  36  13.688  -3.130  -0.509
  258    HA   LEU  36           HA       LEU  36  13.078  -3.171   2.217
  259   1HB   LEU  36          HB2       LEU  36  11.202  -3.670   1.200
  260   2HB   LEU  36          HB1       LEU  36  11.903  -4.412  -0.185
  261    HG   LEU  36           HG       LEU  36  12.235  -6.486   1.332
  262   1HD1  LEU  36          HD11      LEU  36  11.946  -5.456   3.476
  263   2HD1  LEU  36          HD12      LEU  36  10.726  -6.706   3.222
  264   3HD1  LEU  36          HD13      LEU  36  10.289  -5.004   3.067
  265   1HD2  LEU  36          HD21      LEU  36   9.446  -5.588   0.671
  266   2HD2  LEU  36          HD22      LEU  36   9.944  -7.245   1.012
  267   3HD2  LEU  36          HD23      LEU  36  10.566  -6.411  -0.412
  268    H    ASP  37           HN       ASP  37  14.223  -3.914   3.658
  269    HA   ASP  37           HA       ASP  37  15.408  -6.582   3.348
  270   1HB   ASP  37          HB2       ASP  37  17.119  -4.909   3.781
  271   2HB   ASP  37          HB1       ASP  37  16.226  -4.312   5.173
  272    H    SER  38           HN       SER  38  14.117  -4.389   5.800
  273    HA   SER  38           HA       SER  38  12.648  -6.631   6.925
  274   1HB   SER  38          HB2       SER  38  14.388  -4.737   8.522
  275   2HB   SER  38          HB1       SER  38  13.323  -5.959   9.208
  276    HG   SER  38           HG       SER  38  15.700  -6.303   7.698
  277    H    LEU  39           HN       LEU  39  13.173  -3.120   7.546
  278    HA   LEU  39           HA       LEU  39  10.649  -2.662   8.670
  279   1HB   LEU  39          HB2       LEU  39  12.521  -1.108   8.919
  280   2HB   LEU  39          HB1       LEU  39  12.382  -0.670   7.223
  281    HG   LEU  39           HG       LEU  39  10.037   0.087   7.719
  282   1HD1  LEU  39          HD11      LEU  39   9.659  -1.079   9.784
  283   2HD1  LEU  39          HD12      LEU  39   9.480   0.659  10.020
  284   3HD1  LEU  39          HD13      LEU  39  10.941  -0.160  10.573
  285   1HD2  LEU  39          HD21      LEU  39  11.837   1.640   7.389
  286   2HD2  LEU  39          HD22      LEU  39  12.292   1.508   9.098
  287   3HD2  LEU  39          HD23      LEU  39  10.732   2.211   8.643
  288    H    MET  40           HN       MET  40  11.698  -2.456   5.320
  289    HA   MET  40           HA       MET  40   9.298  -1.233   4.366
  290   1HB   MET  40          HB2       MET  40  11.443  -2.706   2.854
  291   2HB   MET  40          HB1       MET  40  10.107  -1.842   2.112
  292   1HG   MET  40          HG2       MET  40  10.895   0.240   3.160
  293   2HG   MET  40          HG1       MET  40  12.266  -0.645   3.830
  294   1HE   MET  40          HE1       MET  40  12.712   1.965   2.155
  295   2HE   MET  40          HE2       MET  40  14.024   1.470   1.084
  296   3HE   MET  40          HE3       MET  40  14.028   0.969   2.774
  297    H    GLY  41           HN       GLY  41   9.665  -4.172   5.601
  298   1HA   GLY  41          HA2       GLY  41   7.324  -5.145   4.102
  299   2HA   GLY  41          HA1       GLY  41   8.514  -6.213   4.847
  300    H    VAL  42           HN       VAL  42   8.871  -4.745   7.242
  301    HA   VAL  42           HA       VAL  42   6.741  -5.825   8.758
  302    HB   VAL  42           HB       VAL  42   8.987  -3.978   9.641
  303   1HG1  VAL  42          HG11      VAL  42   7.113  -3.867  11.210
  304   2HG1  VAL  42          HG12      VAL  42   8.485  -4.713  11.927
  305   3HG1  VAL  42          HG13      VAL  42   7.099  -5.626  11.332
  306   1HG2  VAL  42          HG21      VAL  42  10.007  -6.027  10.528
  307   2HG2  VAL  42          HG22      VAL  42   9.785  -6.110   8.782
  308   3HG2  VAL  42          HG23      VAL  42   8.682  -6.974   9.853
  309    H    GLU  43           HN       GLU  43   7.603  -2.415   7.984
  310    HA   GLU  43           HA       GLU  43   5.459  -1.461   9.550
  311   1HB   GLU  43          HB2       GLU  43   7.346   0.021   9.082
  312   2HB   GLU  43          HB1       GLU  43   6.986  -0.009   7.360
  313   1HG   GLU  43          HG2       GLU  43   5.111   1.337   7.604
  314   2HG   GLU  43          HG1       GLU  43   4.941   0.957   9.312
  315    H    VAL  44           HN       VAL  44   5.730  -2.470   6.273
  316    HA   VAL  44           HA       VAL  44   3.204  -1.582   5.321
  317    HB   VAL  44           HB       VAL  44   4.767  -4.062   4.520
  318   1HG1  VAL  44          HG11      VAL  44   2.603  -2.557   3.047
  319   2HG1  VAL  44          HG12      VAL  44   2.440  -4.147   3.790
  320   3HG1  VAL  44          HG13      VAL  44   3.526  -3.924   2.417
  321   1HG2  VAL  44          HG21      VAL  44   4.783  -1.286   3.350
  322   2HG2  VAL  44          HG22      VAL  44   5.622  -2.694   2.689
  323   3HG2  VAL  44          HG23      VAL  44   6.086  -2.052   4.264
  324    H    ARG  45           HN       ARG  45   4.225  -4.662   6.776
  325    HA   ARG  45           HA       ARG  45   1.659  -5.757   6.895
  326   1HB   ARG  45          HB2       ARG  45   4.131  -6.314   8.506
  327   2HB   ARG  45          HB1       ARG  45   2.643  -7.207   8.775
  328   1HG   ARG  45          HG2       ARG  45   2.683  -7.843   6.366
  329   2HG   ARG  45          HG1       ARG  45   4.263  -7.074   6.251
  330   1HD   ARG  45          HD2       ARG  45   3.604  -9.280   8.183
  331   2HD   ARG  45          HD1       ARG  45   4.296  -9.552   6.588
  332    HE   ARG  45           HE       ARG  45   6.158  -8.099   7.382
  333   1HH1  ARG  45          HH11      ARG  45   4.172  -9.767   9.773
  334   2HH1  ARG  45          HH12      ARG  45   5.473 -10.253  10.761
  335   1HH2  ARG  45          HH21      ARG  45   8.038  -8.807   8.774
  336   2HH2  ARG  45          HH22      ARG  45   7.676  -9.631  10.211
  337    H    GLN  46           HN       GLN  46   3.314  -3.624   9.079
  338    HA   GLN  46           HA       GLN  46   1.384  -3.747  11.153
  339   1HB   GLN  46          HB2       GLN  46   3.490  -1.710  10.469
  340   2HB   GLN  46          HB1       GLN  46   2.417  -1.523  11.847
  341   1HG   GLN  46          HG2       GLN  46   4.215  -3.875  11.405
  342   2HG   GLN  46          HG1       GLN  46   4.635  -2.481  12.405
  343   1HE2  GLN  46          HE21      GLN  46   4.329  -5.308  13.150
  344   2HE2  GLN  46          HE22      GLN  46   3.144  -5.287  14.405
  345    H    ILE  47           HN       ILE  47   1.225  -2.338   8.114
  346    HA   ILE  47           HA       ILE  47  -0.898  -0.506   8.907
  347    HB   ILE  47           HB       ILE  47   0.173  -1.180   6.135
  348   1HG1  ILE  47          HG12      ILE  47   0.553   1.309   7.771
  349   2HG1  ILE  47          HG11      ILE  47   1.741   0.006   7.700
  350   1HG2  ILE  47          HG21      ILE  47  -1.091   0.808   5.389
  351   2HG2  ILE  47          HG22      ILE  47  -1.774   0.976   7.007
  352   3HG2  ILE  47          HG23      ILE  47  -2.152  -0.443   6.033
  353   1HD1  ILE  47          HD11      ILE  47   2.380   1.819   6.249
  354   2HD1  ILE  47          HD12      ILE  47   0.827   1.748   5.409
  355   3HD1  ILE  47          HD13      ILE  47   1.969   0.406   5.282
  356    H    LEU  48           HN       LEU  48  -0.451  -3.136   6.602
  357    HA   LEU  48           HA       LEU  48  -3.151  -3.502   6.047
  358   1HB   LEU  48          HB2       LEU  48  -0.806  -5.335   5.662
  359   2HB   LEU  48          HB1       LEU  48  -2.422  -5.789   5.175
  360    HG   LEU  48           HG       LEU  48  -1.270  -5.058   3.247
  361   1HD1  LEU  48          HD11      LEU  48  -3.056  -2.840   4.139
  362   2HD1  LEU  48          HD12      LEU  48  -3.574  -4.351   3.380
  363   3HD1  LEU  48          HD13      LEU  48  -2.594  -3.192   2.474
  364   1HD2  LEU  48          HD21      LEU  48  -0.278  -2.845   2.996
  365   2HD2  LEU  48          HD22      LEU  48   0.524  -3.788   4.249
  366   3HD2  LEU  48          HD23      LEU  48  -0.609  -2.511   4.694
  367    H    GLU  49           HN       GLU  49  -1.121  -5.256   8.383
  368    HA   GLU  49           HA       GLU  49  -3.211  -7.073   9.030
  369   1HB   GLU  49          HB2       GLU  49  -0.827  -7.662   9.206
  370   2HB   GLU  49          HB1       GLU  49  -0.636  -6.481  10.492
  371   1HG   GLU  49          HG2       GLU  49  -2.243  -7.763  11.847
  372   2HG   GLU  49          HG1       GLU  49  -2.308  -8.976  10.568
  373    H    ARG  50           HN       ARG  50  -2.290  -3.962  10.117
  374    HA   ARG  50           HA       ARG  50  -3.650  -4.257  12.666
  375   1HB   ARG  50          HB2       ARG  50  -1.522  -2.905  12.254
  376   2HB   ARG  50          HB1       ARG  50  -2.564  -1.718  11.490
  377   1HG   ARG  50          HG2       ARG  50  -3.838  -1.569  13.620
  378   2HG   ARG  50          HG1       ARG  50  -2.626  -2.621  14.354
  379   1HD   ARG  50          HD2       ARG  50  -1.928  -0.440  14.888
  380   2HD   ARG  50          HD1       ARG  50  -0.905  -0.931  13.533
  381    HE   ARG  50           HE       ARG  50  -3.235   0.401  12.609
  382   1HH1  ARG  50          HH11      ARG  50   0.039   1.015  13.813
  383   2HH1  ARG  50          HH12      ARG  50   0.006   2.683  13.435
  384   1HH2  ARG  50          HH21      ARG  50  -3.289   2.614  12.093
  385   2HH2  ARG  50          HH22      ARG  50  -1.968   3.649  12.447
  386    H    GLU  51           HN       GLU  51  -3.989  -2.360   9.676
  387    HA   GLU  51           HA       GLU  51  -6.404  -1.120  10.612
  388   1HB   GLU  51          HB2       GLU  51  -5.112  -0.978   7.903
  389   2HB   GLU  51          HB1       GLU  51  -6.321   0.123   8.523
  390   1HG   GLU  51          HG2       GLU  51  -3.489  -0.196   9.529
  391   2HG   GLU  51          HG1       GLU  51  -4.093   1.115   8.530
  392    H    HIS  52           HN       HIS  52  -5.595  -3.805   8.458
  393    HA   HIS  52           HA       HIS  52  -8.502  -4.105   7.970
  394   1HB   HIS  52          HB2       HIS  52  -7.070  -3.227   5.956
  395   2HB   HIS  52          HB1       HIS  52  -6.438  -4.854   5.896
  396    HD1  HIS  52           HD1      HIS  52  -7.835  -3.909   3.408
  397    HD2  HIS  52           HD2      HIS  52  -9.923  -5.742   6.508
  398    HE1  HIS  52           HE1      HIS  52  -9.894  -4.838   2.374
  399    HE2  HIS  52           HE2      HIS  52 -11.283  -5.500   4.325
  400    H    ASP  53           HN       ASP  53  -6.054  -5.415   9.567
  401    HA   ASP  53           HA       ASP  53  -5.384  -7.445  10.309
  402   1HB   ASP  53          HB2       ASP  53  -8.282  -7.985   9.750
  403   2HB   ASP  53          HB1       ASP  53  -7.236  -9.315  10.237
  404    H    LEU  54           HN       LEU  54  -4.936  -6.831   7.550
  405    HA   LEU  54           HA       LEU  54  -5.000  -9.385   6.193
  406   1HB   LEU  54          HB2       LEU  54  -4.216  -6.629   5.423
  407   2HB   LEU  54          HB1       LEU  54  -3.667  -7.978   4.461
  408    HG   LEU  54           HG       LEU  54  -6.520  -7.246   5.014
  409   1HD1  LEU  54          HD11      LEU  54  -6.557  -6.677   2.647
  410   2HD1  LEU  54          HD12      LEU  54  -4.835  -7.066   2.544
  411   3HD1  LEU  54          HD13      LEU  54  -5.375  -5.703   3.531
  412   1HD2  LEU  54          HD21      LEU  54  -6.244  -9.644   4.782
  413   2HD2  LEU  54          HD22      LEU  54  -5.345  -9.407   3.284
  414   3HD2  LEU  54          HD23      LEU  54  -7.052  -8.969   3.368
  415    H    VAL  55           HN       VAL  55  -3.550 -10.770   7.014
  416    HA   VAL  55           HA       VAL  55  -0.869  -9.869   7.565
  417    HB   VAL  55           HB       VAL  55  -1.859 -12.734   7.360
  418   1HG1  VAL  55          HG11      VAL  55   0.559 -12.538   7.193
  419   2HG1  VAL  55          HG12      VAL  55   0.109 -13.276   8.727
  420   3HG1  VAL  55          HG13      VAL  55   0.603 -11.583   8.675
  421   1HG2  VAL  55          HG21      VAL  55  -3.135 -11.556   9.070
  422   2HG2  VAL  55          HG22      VAL  55  -1.640 -10.989   9.816
  423   3HG2  VAL  55          HG23      VAL  55  -2.029 -12.711   9.811
  424    H    LEU  56           HN       LEU  56  -0.312  -9.010   5.620
  425    HA   LEU  56           HA       LEU  56  -0.097 -10.863   3.364
  426   1HB   LEU  56          HB2       LEU  56   0.546  -7.908   3.312
  427   2HB   LEU  56          HB1       LEU  56   0.240  -8.959   1.953
  428    HG   LEU  56           HG       LEU  56  -1.769  -7.832   3.894
  429   1HD1  LEU  56          HD11      LEU  56  -2.731  -6.819   1.898
  430   2HD1  LEU  56          HD12      LEU  56  -1.411  -7.489   0.936
  431   3HD1  LEU  56          HD13      LEU  56  -1.071  -6.305   2.198
  432   1HD2  LEU  56          HD21      LEU  56  -2.367 -10.181   3.349
  433   2HD2  LEU  56          HD22      LEU  56  -2.402  -9.753   1.628
  434   3HD2  LEU  56          HD23      LEU  56  -3.523  -8.991   2.777
  435    HA   PRO  57           HA       PRO  57   4.028 -11.183   5.087
  436   1HB   PRO  57          HB2       PRO  57   4.437 -13.324   3.154
  437   2HB   PRO  57          HB1       PRO  57   4.333 -13.423   4.913
  438   1HG   PRO  57          HG2       PRO  57   2.418 -14.424   3.283
  439   2HG   PRO  57          HG1       PRO  57   2.060 -13.773   4.893
  440   1HD   PRO  57          HD2       PRO  57   1.768 -12.474   2.214
  441   2HD   PRO  57          HD1       PRO  57   0.639 -12.476   3.590
  442    H    ILE  58           HN       ILE  58   6.208 -11.065   4.303
  443    HA   ILE  58           HA       ILE  58   6.614  -9.189   2.247
  444    HB   ILE  58           HB       ILE  58   8.562 -10.980   3.735
  445   1HG1  ILE  58          HG12      ILE  58   9.493  -8.807   4.534
  446   2HG1  ILE  58          HG11      ILE  58   8.243  -7.974   3.632
  447   1HG2  ILE  58          HG21      ILE  58   9.387  -9.066   1.560
  448   2HG2  ILE  58          HG22      ILE  58   9.523 -10.824   1.519
  449   3HG2  ILE  58          HG23      ILE  58  10.477  -9.893   2.675
  450   1HD1  ILE  58          HD11      ILE  58   7.825  -9.848   5.943
  451   2HD1  ILE  58          HD12      ILE  58   6.553  -9.032   5.038
  452   3HD1  ILE  58          HD13      ILE  58   7.708  -8.088   5.981
  453    H    ARG  59           HN       ARG  59   6.374 -12.558   2.185
  454    HA   ARG  59           HA       ARG  59   7.662 -13.172  -0.239
  455   1HB   ARG  59          HB2       ARG  59   5.316 -14.614   1.020
  456   2HB   ARG  59          HB1       ARG  59   6.247 -15.224  -0.331
  457   1HG   ARG  59          HG2       ARG  59   7.084 -16.377   1.504
  458   2HG   ARG  59          HG1       ARG  59   8.262 -15.096   1.248
  459   1HD   ARG  59          HD2       ARG  59   7.164 -13.776   3.019
  460   2HD   ARG  59          HD1       ARG  59   6.048 -15.112   3.300
  461    HE   ARG  59           HE       ARG  59   8.911 -15.561   3.516
  462   1HH1  ARG  59          HH11      ARG  59   5.734 -15.428   5.104
  463   2HH1  ARG  59          HH12      ARG  59   6.339 -15.948   6.610
  464   1HH2  ARG  59          HH21      ARG  59   9.672 -16.277   5.524
  465   2HH2  ARG  59          HH22      ARG  59   8.632 -16.435   6.877
  466    H    GLU  60           HN       GLU  60   4.679 -11.583   0.344
  467    HA   GLU  60           HA       GLU  60   3.980 -11.762  -2.511
  468   1HB   GLU  60          HB2       GLU  60   2.336 -10.861  -0.145
  469   2HB   GLU  60          HB1       GLU  60   1.794 -10.779  -1.812
  470   1HG   GLU  60          HG2       GLU  60   1.987 -13.217  -1.964
  471   2HG   GLU  60          HG1       GLU  60   2.472 -13.264  -0.272
  472    H    VAL  61           HN       VAL  61   4.307  -9.515   0.177
  473    HA   VAL  61           HA       VAL  61   3.796  -7.165  -1.246
  474    HB   VAL  61           HB       VAL  61   5.395  -7.456   1.323
  475   1HG1  VAL  61          HG11      VAL  61   3.877  -5.101   0.219
  476   2HG1  VAL  61          HG12      VAL  61   5.629  -5.244   0.332
  477   3HG1  VAL  61          HG13      VAL  61   4.655  -5.174   1.800
  478   1HG2  VAL  61          HG21      VAL  61   3.270  -7.052   2.466
  479   2HG2  VAL  61          HG22      VAL  61   3.223  -8.531   1.505
  480   3HG2  VAL  61          HG23      VAL  61   2.433  -7.069   0.913
  481    H    ARG  62           HN       ARG  62   6.765  -8.961  -0.928
  482    HA   ARG  62           HA       ARG  62   8.643  -6.972  -1.552
  483   1HB   ARG  62          HB2       ARG  62   9.256  -9.125  -0.644
  484   2HB   ARG  62          HB1       ARG  62   8.683  -9.934  -2.087
  485   1HG   ARG  62          HG2       ARG  62  10.444  -8.893  -3.382
  486   2HG   ARG  62          HG1       ARG  62  11.002  -8.034  -1.942
  487   1HD   ARG  62          HD2       ARG  62  12.348 -10.044  -2.370
  488   2HD   ARG  62          HD1       ARG  62  11.467 -10.168  -0.846
  489    HE   ARG  62           HE       ARG  62  10.456 -11.387  -3.314
  490   1HH1  ARG  62          HH11      ARG  62  11.510 -11.714   0.061
  491   2HH1  ARG  62          HH12      ARG  62  10.914 -13.281   0.276
  492   1HH2  ARG  62          HH21      ARG  62   9.673 -13.580  -3.071
  493   2HH2  ARG  62          HH22      ARG  62   9.831 -14.395  -1.589
  494    H    GLN  63           HN       GLN  63   6.372  -8.602  -3.595
  495    HA   GLN  63           HA       GLN  63   7.884  -7.834  -5.982
  496   1HB   GLN  63          HB2       GLN  63   5.510  -9.691  -5.766
  497   2HB   GLN  63          HB1       GLN  63   6.299  -9.245  -7.260
  498   1HG   GLN  63          HG2       GLN  63   7.194 -11.324  -6.790
  499   2HG   GLN  63          HG1       GLN  63   8.431 -10.206  -6.238
  500   1HE2  GLN  63          HE21      GLN  63   5.470 -10.957  -4.545
  501   2HE2  GLN  63          HE22      GLN  63   6.218 -11.810  -3.247
  502    H    LEU  64           HN       LEU  64   5.890  -6.427  -4.039
  503    HA   LEU  64           HA       LEU  64   4.116  -5.290  -6.008
  504   1HB   LEU  64          HB2       LEU  64   4.770  -4.220  -3.248
  505   2HB   LEU  64          HB1       LEU  64   3.455  -3.709  -4.277
  506    HG   LEU  64           HG       LEU  64   3.721  -6.360  -2.886
  507   1HD1  LEU  64          HD11      LEU  64   3.083  -4.561  -1.418
  508   2HD1  LEU  64          HD12      LEU  64   1.713  -5.639  -1.685
  509   3HD1  LEU  64          HD13      LEU  64   1.790  -4.084  -2.518
  510   1HD2  LEU  64          HD21      LEU  64   1.527  -5.391  -4.725
  511   2HD2  LEU  64          HD22      LEU  64   1.495  -6.882  -3.786
  512   3HD2  LEU  64          HD23      LEU  64   2.681  -6.678  -5.076
  513    H    THR  65           HN       THR  65   4.597  -3.569  -7.249
  514    HA   THR  65           HA       THR  65   7.206  -2.400  -6.975
  515    HB   THR  65           HB       THR  65   6.453  -1.308  -9.148
  516    HG1  THR  65           HG1      THR  65   4.580  -2.008 -10.030
  517   1HG2  THR  65          HG21      THR  65   6.647  -3.385 -10.453
  518   2HG2  THR  65          HG22      THR  65   6.347  -4.322  -8.983
  519   3HG2  THR  65          HG23      THR  65   7.807  -3.349  -9.124
  520    H    LEU  66           HN       LEU  66   7.362  -0.067  -7.072
  521    HA   LEU  66           HA       LEU  66   6.425   0.998  -4.740
  522   1HB   LEU  66          HB2       LEU  66   8.313   1.841  -6.228
  523   2HB   LEU  66          HB1       LEU  66   7.097   2.724  -7.119
  524    HG   LEU  66           HG       LEU  66   8.347   4.144  -5.506
  525   1HD1  LEU  66          HD11      LEU  66   5.473   3.785  -4.814
  526   2HD1  LEU  66          HD12      LEU  66   6.110   4.812  -6.106
  527   3HD1  LEU  66          HD13      LEU  66   6.440   5.209  -4.407
  528   1HD2  LEU  66          HD21      LEU  66   8.775   2.491  -3.791
  529   2HD2  LEU  66          HD22      LEU  66   7.057   2.404  -3.420
  530   3HD2  LEU  66          HD23      LEU  66   7.948   3.893  -3.105
  531    H    ARG  67           HN       ARG  67   4.854   1.665  -7.911
  532    HA   ARG  67           HA       ARG  67   2.895   3.106  -6.390
  533   1HB   ARG  67          HB2       ARG  67   3.455   2.955  -9.281
  534   2HB   ARG  67          HB1       ARG  67   1.793   3.294  -8.803
  535   1HG   ARG  67          HG2       ARG  67   4.209   4.840  -7.889
  536   2HG   ARG  67          HG1       ARG  67   3.082   5.342  -9.158
  537   1HD   ARG  67          HD2       ARG  67   1.235   5.226  -7.516
  538   2HD   ARG  67          HD1       ARG  67   2.397   4.819  -6.274
  539    HE   ARG  67           HE       ARG  67   3.162   6.985  -6.237
  540   1HH1  ARG  67          HH11      ARG  67   0.895   6.648  -8.922
  541   2HH1  ARG  67          HH12      ARG  67   0.393   8.266  -8.905
  542   1HH2  ARG  67          HH21      ARG  67   2.449   9.296  -6.211
  543   2HH2  ARG  67          HH22      ARG  67   1.308   9.765  -7.380
  544    H    LYS  68           HN       LYS  68   3.253  -0.020  -7.316
  545    HA   LYS  68           HA       LYS  68   0.484  -0.646  -7.524
  546   1HB   LYS  68          HB2       LYS  68   2.184  -2.087  -8.517
  547   2HB   LYS  68          HB1       LYS  68   2.850  -2.419  -6.926
  548   1HG   LYS  68          HG2       LYS  68   0.913  -3.633  -6.277
  549   2HG   LYS  68          HG1       LYS  68   0.044  -3.126  -7.724
  550   1HD   LYS  68          HD2       LYS  68   2.554  -4.744  -7.732
  551   2HD   LYS  68          HD1       LYS  68   0.934  -5.458  -7.807
  552   1HE   LYS  68          HE2       LYS  68   2.231  -3.612  -9.831
  553   2HE   LYS  68          HE1       LYS  68   1.818  -5.307 -10.047
  554   1HZ   LYS  68          HZ1       LYS  68  -0.093  -3.035  -9.764
  555   2HZ   LYS  68          HZ2       LYS  68  -0.558  -4.646  -9.722
  556   3HZ   LYS  68          HZ3       LYS  68   0.158  -4.013 -11.114
  557    H    LEU  69           HN       LEU  69   2.660  -0.051  -4.992
  558    HA   LEU  69           HA       LEU  69   1.397  -1.276  -2.833
  559   1HB   LEU  69          HB2       LEU  69   2.971   1.261  -3.026
  560   2HB   LEU  69          HB1       LEU  69   2.090   0.949  -1.556
  561    HG   LEU  69           HG       LEU  69   4.366   0.318  -1.246
  562   1HD1  LEU  69          HD11      LEU  69   2.770  -1.069  -0.128
  563   2HD1  LEU  69          HD12      LEU  69   4.174  -2.022  -0.609
  564   3HD1  LEU  69          HD13      LEU  69   2.672  -2.140  -1.526
  565   1HD2  LEU  69          HD21      LEU  69   5.480  -1.421  -2.550
  566   2HD2  LEU  69          HD22      LEU  69   5.038  -0.038  -3.555
  567   3HD2  LEU  69          HD23      LEU  69   4.079  -1.515  -3.615
  568    H    GLN  70           HN       GLN  70   0.350   1.621  -4.592
  569    HA   GLN  70           HA       GLN  70  -1.761   1.861  -2.634
  570   1HB   GLN  70          HB2       GLN  70  -2.506   3.895  -3.851
  571   2HB   GLN  70          HB1       GLN  70  -0.892   3.983  -3.171
  572   1HG   GLN  70          HG2       GLN  70   0.064   3.616  -5.356
  573   2HG   GLN  70          HG1       GLN  70  -1.563   3.528  -6.080
  574   1HE2  GLN  70          HE21      GLN  70  -1.185   5.299  -7.367
  575   2HE2  GLN  70          HE22      GLN  70  -1.093   6.920  -6.740
  576    H    GLU  71           HN       GLU  71  -1.336   0.091  -5.292
  577    HA   GLU  71           HA       GLU  71  -4.142   0.047  -6.094
  578   1HB   GLU  71          HB2       GLU  71  -1.887  -1.874  -6.698
  579   2HB   GLU  71          HB1       GLU  71  -3.492  -1.956  -7.385
  580   1HG   GLU  71          HG2       GLU  71  -3.065   0.207  -8.495
  581   2HG   GLU  71          HG1       GLU  71  -1.414   0.155  -7.861
  582    H    MET  72           HN       MET  72  -1.776  -1.805  -4.368
  583    HA   MET  72           HA       MET  72  -3.697  -3.809  -3.449
  584   1HB   MET  72          HB2       MET  72  -0.703  -3.582  -3.119
  585   2HB   MET  72          HB1       MET  72  -1.680  -4.922  -2.561
  586   1HG   MET  72          HG2       MET  72  -1.499  -4.126  -5.460
  587   2HG   MET  72          HG1       MET  72  -0.369  -5.244  -4.720
  588   1HE   MET  72          HE1       MET  72  -4.369  -4.850  -4.393
  589   2HE   MET  72          HE2       MET  72  -4.880  -6.131  -5.492
  590   3HE   MET  72          HE3       MET  72  -4.033  -4.717  -6.120
  591    H    SER  73           HN       SER  73  -3.720  -1.007  -2.531
  592    HA   SER  73           HA       SER  73  -2.540  -0.921   0.027
  593   1HB   SER  73          HB2       SER  73  -3.827   1.230   0.237
  594   2HB   SER  73          HB1       SER  73  -2.860   1.096  -1.212
  595    HG   SER  73           HG       SER  73  -4.783   1.824  -1.900
  596    H    SER  74           HN       SER  74  -5.663  -1.821  -1.256
  597    HA   SER  74           HA       SER  74  -7.593  -2.582  -0.358
  598   1HB   SER  74          HB2       SER  74  -6.066  -4.556  -0.388
  599   2HB   SER  74          HB1       SER  74  -5.621  -4.191   1.280
  600    HG   SER  74           HG       SER  74  -7.516  -5.754   0.561
  601    H    LYS  75           HN       LYS  75  -8.008  -0.470   0.632
  602    HA   LYS  75           HA       LYS  75  -7.307  -0.136   3.402
  603   1HB   LYS  75          HB2       LYS  75  -9.079   1.574   1.681
  604   2HB   LYS  75          HB1       LYS  75  -8.413   1.994   3.247
  605   1HG   LYS  75          HG2       LYS  75  -6.183   2.016   2.321
  606   2HG   LYS  75          HG1       LYS  75  -6.813   1.493   0.750
  607   1HD   LYS  75          HD2       LYS  75  -8.237   3.512   0.712
  608   2HD   LYS  75          HD1       LYS  75  -7.462   4.041   2.204
  609   1HE   LYS  75          HE2       LYS  75  -5.322   4.113   1.090
  610   2HE   LYS  75          HE1       LYS  75  -6.056   3.501  -0.394
  611   1HZ   LYS  75          HZ1       LYS  75  -6.705   6.078   0.923
  612   2HZ   LYS  75          HZ2       LYS  75  -7.439   5.461  -0.481
  613   3HZ   LYS  75          HZ3       LYS  75  -5.805   5.878  -0.513
  614    H    ALA  76           HN       ALA  76  -8.644  -0.138   5.083
  615    HA   ALA  76           HA       ALA  76 -10.999  -1.653   5.118
  616   1HB   ALA  76          HB1       ALA  76  -9.649  -1.220   7.117
  617   2HB   ALA  76          HB2       ALA  76 -11.323  -0.728   7.371
  618   3HB   ALA  76          HB3       ALA  76 -10.088   0.488   7.048
  619    H    GLY  77           HN       GLY  77 -10.378   1.763   4.692
  620   1HA   GLY  77          HA2       GLY  77 -13.142   2.531   4.799
  621   2HA   GLY  77          HA1       GLY  77 -11.770   3.568   4.453
  622    H    SER  78           HN       SER  78 -11.600   0.881   2.430
  623    HA   SER  78           HA       SER  78 -12.552   2.432   0.216
  624   1HB   SER  78          HB2       SER  78 -11.464  -0.403   0.313
  625   2HB   SER  78          HB1       SER  78 -11.794   0.506  -1.159
  626    HG   SER  78           HG       SER  78 -10.326   2.115   0.168
  627    H    ASP  79           HN       ASP  79 -14.670   2.683   0.252
  628    HA   ASP  79           HA       ASP  79 -16.451   0.563   1.017
  629   1HB   ASP  79          HB2       ASP  79 -16.979   2.847   1.659
  630   2HB   ASP  79          HB1       ASP  79 -16.981   3.348  -0.028
  631    H    THR  80           HN       THR  80 -16.828  -1.000  -0.335
  632    HA   THR  80           HA       THR  80 -17.727  -0.396  -2.991
  633    HB   THR  80           HB       THR  80 -15.439  -2.356  -2.504
  634    HG1  THR  80           HG1      THR  80 -15.506   0.310  -2.966
  635   1HG2  THR  80          HG21      THR  80 -15.341  -2.462  -4.962
  636   2HG2  THR  80          HG22      THR  80 -16.709  -1.350  -5.064
  637   3HG2  THR  80          HG23      THR  80 -16.930  -2.959  -4.374
  638    H    GLU  81           HN       GLU  81 -19.276  -1.838  -3.551
  639    HA   GLU  81           HA       GLU  81 -19.680  -4.162  -1.813
  640   1HB   GLU  81          HB2       GLU  81 -22.113  -3.675  -1.830
  641   2HB   GLU  81          HB1       GLU  81 -21.167  -2.449  -1.003
  642   1HG   GLU  81          HG2       GLU  81 -21.251  -1.118  -3.138
  643   2HG   GLU  81          HG1       GLU  81 -22.435  -2.290  -3.713
  644    H    LEU  82           HN       LEU  82 -20.544  -5.972  -2.784
  645    HA   LEU  82           HA       LEU  82 -21.267  -7.384  -4.297
  646   1HB   LEU  82          HB2       LEU  82 -22.044  -4.922  -5.836
  647   2HB   LEU  82          HB1       LEU  82 -22.200  -6.508  -6.548
  648    HG   LEU  82           HG       LEU  82 -24.330  -5.821  -5.724
  649   1HD1  LEU  82          HD11      LEU  82 -23.833  -8.147  -5.530
  650   2HD1  LEU  82          HD12      LEU  82 -24.861  -7.629  -4.194
  651   3HD1  LEU  82          HD13      LEU  82 -23.138  -7.900  -3.929
  652   1HD2  LEU  82          HD21      LEU  82 -23.652  -4.185  -4.036
  653   2HD2  LEU  82          HD22      LEU  82 -23.061  -5.486  -3.004
  654   3HD2  LEU  82          HD23      LEU  82 -24.782  -5.357  -3.359
  655    H    ALA  83           HN       ALA  83 -18.637  -5.514  -4.717
  656    HA   ALA  83           HA       ALA  83 -17.750  -6.549  -7.240
  657   1HB   ALA  83          HB1       ALA  83 -15.595  -5.534  -6.663
  658   2HB   ALA  83          HB2       ALA  83 -16.178  -5.218  -5.029
  659   3HB   ALA  83          HB3       ALA  83 -16.919  -4.398  -6.403
  660    H    ALA  84           HN       ALA  84 -17.458  -7.339  -3.890
  661    HA   ALA  84           HA       ALA  84 -15.887  -9.713  -4.500
  662   1HB   ALA  84          HB1       ALA  84 -15.347  -8.461  -2.453
  663   2HB   ALA  84          HB2       ALA  84 -15.944 -10.069  -2.049
  664   3HB   ALA  84          HB3       ALA  84 -17.002  -8.667  -1.881
  665    HA   PRO  85           HA       PRO  85 -19.780 -11.688  -5.678
  666   1HB   PRO  85          HB2       PRO  85 -18.556 -14.245  -5.307
  667   2HB   PRO  85          HB1       PRO  85 -18.879 -13.408  -6.824
  668   1HG   PRO  85          HG2       PRO  85 -16.377 -13.614  -5.286
  669   2HG   PRO  85          HG1       PRO  85 -16.619 -13.266  -7.004
  670   1HD   PRO  85          HD2       PRO  85 -15.817 -11.387  -5.227
  671   2HD   PRO  85          HD1       PRO  85 -16.805 -11.001  -6.648
  672    H    LYS  86           HN       LYS  86 -21.377 -11.875  -4.344
  673    HA   LYS  86           HA       LYS  86 -21.015 -12.379  -1.561
  674   1HB   LYS  86          HB2       LYS  86 -23.489 -11.891  -3.181
  675   2HB   LYS  86          HB1       LYS  86 -23.483 -12.070  -1.431
  676   1HG   LYS  86          HG2       LYS  86 -21.851 -10.179  -1.341
  677   2HG   LYS  86          HG1       LYS  86 -22.145  -9.938  -3.063
  678   1HD   LYS  86          HD2       LYS  86 -23.501  -8.441  -1.683
  679   2HD   LYS  86          HD1       LYS  86 -24.497  -9.552  -2.626
  680   1HE   LYS  86          HE2       LYS  86 -24.860 -10.938  -0.693
  681   2HE   LYS  86          HE1       LYS  86 -23.729  -9.973   0.256
  682   1HZ   LYS  86          HZ1       LYS  86 -25.152  -8.158   0.210
  683   2HZ   LYS  86          HZ2       LYS  86 -26.189  -9.469   0.574
  684   3HZ   LYS  86          HZ3       LYS  86 -26.142  -8.811  -0.975
  685    H    SER  87           HN       SER  87 -20.598 -14.625  -3.458
  686    HA   SER  87           HA       SER  87 -22.406 -16.573  -2.284
  687   1HB   SER  87          HB2       SER  87 -20.177 -16.927  -4.305
  688   2HB   SER  87          HB1       SER  87 -21.396 -18.128  -3.867
  689    HG   SER  87           HG       SER  87 -22.889 -16.269  -4.455
  690    H    LYS  88           HN       LYS  88 -19.495 -15.000  -1.741
  691    HA   LYS  88           HA       LYS  88 -18.985 -16.390   0.645
  692   1HB   LYS  88          HB2       LYS  88 -17.851 -17.936  -0.993
  693   2HB   LYS  88          HB1       LYS  88 -16.837 -16.585  -1.487
  694   1HG   LYS  88          HG2       LYS  88 -16.000 -16.417   0.837
  695   2HG   LYS  88          HG1       LYS  88 -16.950 -17.849   1.246
  696   1HD   LYS  88          HD2       LYS  88 -15.706 -19.092  -0.508
  697   2HD   LYS  88          HD1       LYS  88 -14.700 -17.665  -0.746
  698   1HE   LYS  88          HE2       LYS  88 -14.003 -17.790   1.610
  699   2HE   LYS  88          HE1       LYS  88 -14.975 -19.248   1.806
  700   1HZ   LYS  88          HZ1       LYS  88 -12.751 -19.942   1.396
  701   2HZ   LYS  88          HZ2       LYS  88 -12.585 -18.871   0.111
  702   3HZ   LYS  88          HZ3       LYS  88 -13.587 -20.212  -0.055
  703    H    ASN  89           HN       ASN  89 -18.869 -14.546   1.737
  704    HA   ASN  89           HA       ASN  89 -17.005 -12.497   0.776
  705   1HB   ASN  89          HB2       ASN  89 -19.643 -12.122   2.213
  706   2HB   ASN  89          HB1       ASN  89 -18.419 -10.868   2.139
  707   1HD2  ASN  89          HD21      ASN  89 -17.651 -11.605  -0.594
  708   2HD2  ASN  89          HD22      ASN  89 -18.911 -11.011  -1.612
  Start of MODEL   27
    1   1H    GLY   1          HT1       GLY   1 -21.183   3.862  10.361
    2   2H    GLY   1          HT2       GLY   1 -19.685   4.347  11.005
    3   3H    GLY   1          HT3       GLY   1 -19.739   3.316   9.667
    4   1HA   GLY   1          HA1       GLY   1 -20.733   5.054   8.339
    5   2HA   GLY   1          HA2       GLY   1 -20.595   6.133   9.726
    6    H    ASP   2           HN       ASP   2 -18.677   7.166  10.051
    7    HA   ASP   2           HA       ASP   2 -16.543   6.373   8.198
    8   1HB   ASP   2          HB2       ASP   2 -15.663   8.571   8.254
    9   2HB   ASP   2          HB1       ASP   2 -17.402   8.806   8.183
   10    H    GLY   3           HN       GLY   3 -14.538   5.909   8.916
   11   1HA   GLY   3          HA2       GLY   3 -13.856   6.215  11.690
   12   2HA   GLY   3          HA1       GLY   3 -14.100   4.544  11.171
   13    H    GLU   4           HN       GLU   4 -12.533   3.544  10.145
   14    HA   GLU   4           HA       GLU   4 -10.183   5.152   9.525
   15   1HB   GLU   4          HB2       GLU   4 -10.474   2.165   9.729
   16   2HB   GLU   4          HB1       GLU   4  -8.996   3.002   9.286
   17   1HG   GLU   4          HG2       GLU   4  -9.049   4.128  11.487
   18   2HG   GLU   4          HG1       GLU   4 -10.434   3.118  11.913
   19    H    ALA   5           HN       ALA   5 -10.088   5.864   7.589
   20    HA   ALA   5           HA       ALA   5 -11.011   4.164   5.400
   21   1HB   ALA   5          HB1       ALA   5 -11.921   6.447   5.376
   22   2HB   ALA   5          HB2       ALA   5 -10.803   6.227   4.032
   23   3HB   ALA   5          HB3       ALA   5 -10.288   7.109   5.470
   24    H    GLN   6           HN       GLN   6  -9.395   2.916   4.669
   25    HA   GLN   6           HA       GLN   6  -6.755   3.522   5.426
   26   1HB   GLN   6          HB2       GLN   6  -7.720   1.175   5.008
   27   2HB   GLN   6          HB1       GLN   6  -7.427   1.493   3.299
   28   1HG   GLN   6          HG2       GLN   6  -5.104   1.694   3.627
   29   2HG   GLN   6          HG1       GLN   6  -5.285   1.769   5.372
   30   1HE2  GLN   6          HE21      GLN   6  -4.067   0.138   5.904
   31   2HE2  GLN   6          HE22      GLN   6  -4.316  -1.517   5.461
   32    H    ARG   7           HN       ARG   7  -5.140   4.302   4.408
   33    HA   ARG   7           HA       ARG   7  -5.809   6.209   2.304
   34   1HB   ARG   7          HB2       ARG   7  -3.721   7.271   2.940
   35   2HB   ARG   7          HB1       ARG   7  -4.757   6.996   4.338
   36   1HG   ARG   7          HG2       ARG   7  -3.425   5.005   4.912
   37   2HG   ARG   7          HG1       ARG   7  -2.367   5.335   3.539
   38   1HD   ARG   7          HD2       ARG   7  -1.421   6.142   5.634
   39   2HD   ARG   7          HD1       ARG   7  -1.758   7.466   4.515
   40    HE   ARG   7           HE       ARG   7  -3.984   7.099   6.135
   41   1HH1  ARG   7          HH11      ARG   7  -0.625   8.107   6.525
   42   2HH1  ARG   7          HH12      ARG   7  -0.958   9.253   7.744
   43   1HH2  ARG   7          HH21      ARG   7  -4.457   8.611   7.834
   44   2HH2  ARG   7          HH22      ARG   7  -3.207   9.532   8.532
   45    H    ASP   8           HN       ASP   8  -3.837   6.765   0.890
   46    HA   ASP   8           HA       ASP   8  -3.091   4.647  -0.830
   47   1HB   ASP   8          HB2       ASP   8  -1.748   7.245  -0.234
   48   2HB   ASP   8          HB1       ASP   8  -1.155   6.158  -1.488
   49    H    LEU   9           HN       LEU   9  -1.664   3.080  -0.426
   50    HA   LEU   9           HA       LEU   9  -0.109   3.153   1.921
   51   1HB   LEU   9          HB2       LEU   9   0.074   1.281  -0.432
   52   2HB   LEU   9          HB1       LEU   9   0.835   1.032   1.129
   53    HG   LEU   9           HG       LEU   9  -2.131   1.146   0.605
   54   1HD1  LEU   9          HD11      LEU   9  -2.081  -1.229   1.219
   55   2HD1  LEU   9          HD12      LEU   9  -0.324  -1.154   1.351
   56   3HD1  LEU   9          HD13      LEU   9  -1.103  -0.903  -0.213
   57   1HD2  LEU   9          HD21      LEU   9  -0.609   0.620   3.147
   58   2HD2  LEU   9          HD22      LEU   9  -2.369   0.525   2.957
   59   3HD2  LEU   9          HD23      LEU   9  -1.530   2.070   2.763
   60    H    VAL  10           HN       VAL  10   0.325   4.454  -1.122
   61    HA   VAL  10           HA       VAL  10   3.158   4.549  -1.166
   62    HB   VAL  10           HB       VAL  10   1.092   6.310  -2.551
   63   1HG1  VAL  10          HG11      VAL  10   4.064   6.156  -3.075
   64   2HG1  VAL  10          HG12      VAL  10   3.211   7.528  -2.366
   65   3HG1  VAL  10          HG13      VAL  10   2.891   7.057  -4.037
   66   1HG2  VAL  10          HG21      VAL  10   1.036   3.997  -3.226
   67   2HG2  VAL  10          HG22      VAL  10   2.770   4.027  -3.557
   68   3HG2  VAL  10          HG23      VAL  10   1.667   5.003  -4.529
   69    H    LYS  11           HN       LYS  11   0.617   6.519   0.198
   70    HA   LYS  11           HA       LYS  11   2.359   8.651   1.032
   71   1HB   LYS  11          HB2       LYS  11  -0.529   7.989   1.387
   72   2HB   LYS  11          HB1       LYS  11   0.185   9.204   2.434
   73   1HG   LYS  11          HG2       LYS  11  -1.025  10.179   0.512
   74   2HG   LYS  11          HG1       LYS  11   0.680  10.604   0.505
   75   1HD   LYS  11          HD2       LYS  11   1.124   9.082  -1.264
   76   2HD   LYS  11          HD1       LYS  11  -0.461   8.345  -1.166
   77   1HE   LYS  11          HE2       LYS  11   0.145  11.183  -1.988
   78   2HE   LYS  11          HE1       LYS  11  -0.276   9.863  -3.072
   79   1HZ   LYS  11          HZ1       LYS  11  -2.476   9.757  -1.869
   80   2HZ   LYS  11          HZ2       LYS  11  -2.180  11.160  -2.743
   81   3HZ   LYS  11          HZ3       LYS  11  -2.037  11.201  -1.074
   82    H    ALA  12           HN       ALA  12   2.365   5.676   1.969
   83    HA   ALA  12           HA       ALA  12   2.954   6.307   4.770
   84   1HB   ALA  12          HB1       ALA  12   1.665   3.779   3.743
   85   2HB   ALA  12          HB2       ALA  12   0.852   5.058   4.645
   86   3HB   ALA  12          HB3       ALA  12   2.118   4.100   5.416
   87    H    VAL  13           HN       VAL  13   3.400   3.744   2.317
   88    HA   VAL  13           HA       VAL  13   5.882   2.879   3.407
   89    HB   VAL  13           HB       VAL  13   4.597   2.269   0.727
   90   1HG1  VAL  13          HG11      VAL  13   6.987   1.837   0.667
   91   2HG1  VAL  13          HG12      VAL  13   6.085   0.320   0.645
   92   3HG1  VAL  13          HG13      VAL  13   6.868   0.863   2.133
   93   1HG2  VAL  13          HG21      VAL  13   3.901   0.165   1.785
   94   2HG2  VAL  13          HG22      VAL  13   3.215   1.571   2.598
   95   3HG2  VAL  13          HG23      VAL  13   4.585   0.719   3.313
   96    H    ALA  14           HN       ALA  14   4.998   4.639   0.416
   97    HA   ALA  14           HA       ALA  14   7.705   5.029  -0.330
   98   1HB   ALA  14          HB1       ALA  14   6.831   6.594  -2.047
   99   2HB   ALA  14          HB2       ALA  14   5.254   6.555  -1.252
  100   3HB   ALA  14          HB3       ALA  14   5.885   5.106  -2.001
  101    H    HIS  15           HN       HIS  15   5.517   6.639   1.712
  102    HA   HIS  15           HA       HIS  15   6.784   9.128   1.994
  103   1HB   HIS  15          HB2       HIS  15   4.525   8.695   2.870
  104   2HB   HIS  15          HB1       HIS  15   5.184   7.568   4.045
  105    HD1  HIS  15           HD1      HIS  15   5.581   8.509   6.274
  106    HD2  HIS  15           HD2      HIS  15   5.496  11.478   3.373
  107    HE1  HIS  15           HE1      HIS  15   5.746  10.686   7.522
  108    HE2  HIS  15           HE2      HIS  15   5.571  12.460   5.784
  109    H    ILE  16           HN       ILE  16   7.589   5.984   3.264
  110    HA   ILE  16           HA       ILE  16   9.525   6.891   5.179
  111    HB   ILE  16           HB       ILE  16   9.012   4.193   3.892
  112   1HG1  ILE  16          HG12      ILE  16   7.272   4.888   5.426
  113   2HG1  ILE  16          HG11      ILE  16   8.181   3.554   6.127
  114   1HG2  ILE  16          HG21      ILE  16  11.007   4.738   6.092
  115   2HG2  ILE  16          HG22      ILE  16  11.379   4.273   4.433
  116   3HG2  ILE  16          HG23      ILE  16  10.538   3.145   5.486
  117   1HD1  ILE  16          HD11      ILE  16   7.667   5.251   7.794
  118   2HD1  ILE  16          HD12      ILE  16   8.498   6.469   6.825
  119   3HD1  ILE  16          HD13      ILE  16   9.408   5.135   7.532
  120    H    LEU  17           HN       LEU  17   9.483   5.999   1.829
  121    HA   LEU  17           HA       LEU  17  12.360   5.939   1.581
  122   1HB   LEU  17          HB2       LEU  17  10.274   5.867  -0.591
  123   2HB   LEU  17          HB1       LEU  17  11.964   5.434  -0.747
  124    HG   LEU  17           HG       LEU  17   9.872   3.949   0.827
  125   1HD1  LEU  17          HD11      LEU  17   9.684   3.634  -1.568
  126   2HD1  LEU  17          HD12      LEU  17  10.268   2.165  -0.788
  127   3HD1  LEU  17          HD13      LEU  17  11.391   3.208  -1.663
  128   1HD2  LEU  17          HD21      LEU  17  12.011   3.860   1.967
  129   2HD2  LEU  17          HD22      LEU  17  12.801   3.345   0.477
  130   3HD2  LEU  17          HD23      LEU  17  11.617   2.297   1.257
  131    H    GLY  18           HN       GLY  18   9.963   8.270   1.510
  132   1HA   GLY  18          HA2       GLY  18  10.269  10.588   1.370
  133   2HA   GLY  18          HA1       GLY  18  11.867  10.306   0.690
  134    H    ILE  19           HN       ILE  19   8.939   8.804  -0.475
  135    HA   ILE  19           HA       ILE  19   9.015  10.523  -2.802
  136    HB   ILE  19           HB       ILE  19   8.225   8.363  -4.006
  137   1HG1  ILE  19          HG12      ILE  19  10.011   7.188  -1.876
  138   2HG1  ILE  19          HG11      ILE  19   8.296   6.874  -2.104
  139   1HG2  ILE  19          HG21      ILE  19  11.141   8.957  -3.461
  140   2HG2  ILE  19          HG22      ILE  19  10.132   9.681  -4.715
  141   3HG2  ILE  19          HG23      ILE  19  10.551   7.973  -4.801
  142   1HD1  ILE  19          HD11      ILE  19   8.776   5.807  -4.247
  143   2HD1  ILE  19          HD12      ILE  19   9.659   5.038  -2.929
  144   3HD1  ILE  19          HD13      ILE  19  10.495   6.135  -4.026
  145    H    ARG  20           HN       ARG  20   7.142  10.729  -3.881
  146    HA   ARG  20           HA       ARG  20   4.724   9.386  -3.025
  147   1HB   ARG  20          HB2       ARG  20   4.981  11.450  -1.534
  148   2HB   ARG  20          HB1       ARG  20   4.787  12.415  -2.992
  149   1HG   ARG  20          HG2       ARG  20   2.590  11.354  -3.362
  150   2HG   ARG  20          HG1       ARG  20   2.782  10.483  -1.844
  151   1HD   ARG  20          HD2       ARG  20   1.420  12.363  -1.384
  152   2HD   ARG  20          HD1       ARG  20   3.007  12.713  -0.709
  153    HE   ARG  20           HE       ARG  20   2.933  13.730  -3.287
  154   1HH1  ARG  20          HH11      ARG  20   1.378  14.354  -0.116
  155   2HH1  ARG  20          HH12      ARG  20   1.017  15.973  -0.486
  156   1HH2  ARG  20          HH21      ARG  20   2.355  16.011  -3.756
  157   2HH2  ARG  20          HH22      ARG  20   1.571  16.908  -2.527
  158    H    ASP  21           HN       ASP  21   6.458  11.610  -5.048
  159    HA   ASP  21           HA       ASP  21   4.580  11.954  -7.169
  160   1HB   ASP  21          HB2       ASP  21   6.359  13.540  -6.833
  161   2HB   ASP  21          HB1       ASP  21   7.570  12.274  -6.957
  162    H    LEU  22           HN       LEU  22   7.553  10.056  -7.356
  163    HA   LEU  22           HA       LEU  22   7.969   8.069  -8.332
  164   1HB   LEU  22          HB2       LEU  22   4.997   7.769  -8.060
  165   2HB   LEU  22          HB1       LEU  22   5.970   6.572  -8.885
  166    HG   LEU  22           HG       LEU  22   5.450   5.928  -6.658
  167   1HD1  LEU  22          HD11      LEU  22   8.350   6.614  -7.080
  168   2HD1  LEU  22          HD12      LEU  22   7.523   5.155  -7.617
  169   3HD1  LEU  22          HD13      LEU  22   7.774   5.445  -5.889
  170   1HD2  LEU  22          HD21      LEU  22   6.445   7.030  -4.696
  171   2HD2  LEU  22          HD22      LEU  22   5.274   8.055  -5.531
  172   3HD2  LEU  22          HD23      LEU  22   7.003   8.335  -5.742
  173    H    ALA  23           HN       ALA  23   7.053  10.577  -9.957
  174    HA   ALA  23           HA       ALA  23   6.290   9.283 -12.363
  175   1HB   ALA  23          HB1       ALA  23   5.327  11.452 -11.839
  176   2HB   ALA  23          HB2       ALA  23   6.245  11.542 -13.342
  177   3HB   ALA  23          HB3       ALA  23   6.930  12.186 -11.848
  178    H    GLY  24           HN       GLY  24   9.030   9.826 -10.750
  179   1HA   GLY  24          HA2       GLY  24  10.763   9.639 -13.155
  180   2HA   GLY  24          HA1       GLY  24  11.219  10.440 -11.645
  181    H    ILE  25           HN       ILE  25   9.959   8.414 -10.020
  182    HA   ILE  25           HA       ILE  25  12.192   6.661  -9.742
  183    HB   ILE  25           HB       ILE  25   9.470   6.551  -8.393
  184   1HG1  ILE  25          HG12      ILE  25  10.618   8.686  -7.984
  185   2HG1  ILE  25          HG11      ILE  25  10.495   7.721  -6.523
  186   1HG2  ILE  25          HG21      ILE  25  12.067   5.247  -7.564
  187   2HG2  ILE  25          HG22      ILE  25  10.637   4.421  -8.180
  188   3HG2  ILE  25          HG23      ILE  25  10.574   5.248  -6.621
  189   1HD1  ILE  25          HD11      ILE  25  12.818   7.053  -6.762
  190   2HD1  ILE  25          HD12      ILE  25  12.647   8.809  -6.691
  191   3HD1  ILE  25          HD13      ILE  25  12.945   8.010  -8.241
  192    H    ASN  26           HN       ASN  26  12.220   4.440 -10.060
  193    HA   ASN  26           HA       ASN  26  10.745   3.564 -12.327
  194   1HB   ASN  26          HB2       ASN  26  12.806   2.213 -10.624
  195   2HB   ASN  26          HB1       ASN  26  11.881   1.302 -11.813
  196   1HD2  ASN  26          HD21      ASN  26  11.722   3.496 -13.726
  197   2HD2  ASN  26          HD22      ASN  26  13.300   3.660 -14.399
  198    H    LEU  27           HN       LEU  27   8.974   2.693 -12.448
  199    HA   LEU  27           HA       LEU  27   7.695   1.528 -10.077
  200   1HB   LEU  27          HB2       LEU  27   6.497   2.381 -12.716
  201   2HB   LEU  27          HB1       LEU  27   5.602   1.810 -11.318
  202    HG   LEU  27           HG       LEU  27   7.187   4.363 -11.499
  203   1HD1  LEU  27          HD11      LEU  27   4.219   3.872 -11.337
  204   2HD1  LEU  27          HD12      LEU  27   5.108   4.456 -12.743
  205   3HD1  LEU  27          HD13      LEU  27   5.006   5.448 -11.288
  206   1HD2  LEU  27          HD21      LEU  27   6.280   4.845  -9.273
  207   2HD2  LEU  27          HD22      LEU  27   7.311   3.413  -9.263
  208   3HD2  LEU  27          HD23      LEU  27   5.555   3.238  -9.227
  209    H    ASP  28           HN       ASP  28   9.524   0.655 -12.529
  210    HA   ASP  28           HA       ASP  28   8.167  -1.868 -13.231
  211   1HB   ASP  28          HB2       ASP  28  10.779  -0.718 -14.288
  212   2HB   ASP  28          HB1       ASP  28   9.943  -2.133 -14.910
  213    H    SER  29           HN       SER  29   9.481  -0.976 -10.687
  214    HA   SER  29           HA       SER  29  11.833  -2.521 -10.318
  215   1HB   SER  29          HB2       SER  29  11.353  -1.600  -7.961
  216   2HB   SER  29          HB1       SER  29  11.745  -0.441  -9.215
  217    HG   SER  29           HG       SER  29   9.934   0.447  -8.672
  218    H    SER  30           HN       SER  30  11.518  -3.573  -7.857
  219    HA   SER  30           HA       SER  30   9.323  -5.486  -8.076
  220   1HB   SER  30          HB2       SER  30  11.968  -5.490  -6.656
  221   2HB   SER  30          HB1       SER  30  10.879  -6.809  -6.452
  222    HG   SER  30           HG       SER  30  11.479  -6.080  -9.088
  223    H    LEU  31           HN       LEU  31  11.344  -3.824  -5.763
  224    HA   LEU  31           HA       LEU  31  10.162  -2.132  -4.269
  225   1HB   LEU  31          HB2       LEU  31   8.115  -3.674  -3.983
  226   2HB   LEU  31          HB1       LEU  31   9.141  -4.734  -3.039
  227    HG   LEU  31           HG       LEU  31   9.464  -2.959  -1.369
  228   1HD1  LEU  31          HD11      LEU  31   7.534  -1.439  -3.068
  229   2HD1  LEU  31          HD12      LEU  31   9.262  -1.070  -2.879
  230   3HD1  LEU  31          HD13      LEU  31   8.159  -0.920  -1.495
  231   1HD2  LEU  31          HD21      LEU  31   6.568  -3.427  -2.040
  232   2HD2  LEU  31          HD22      LEU  31   7.203  -2.896  -0.480
  233   3HD2  LEU  31          HD23      LEU  31   7.597  -4.501  -1.093
  234    H    ALA  32           HN       ALA  32  11.364  -5.317  -4.085
  235    HA   ALA  32           HA       ALA  32  12.886  -5.079  -1.714
  236   1HB   ALA  32          HB1       ALA  32  14.025  -7.124  -2.415
  237   2HB   ALA  32          HB2       ALA  32  13.339  -6.933  -4.036
  238   3HB   ALA  32          HB3       ALA  32  12.282  -7.237  -2.664
  239    H    ASP  33           HN       ASP  33  13.505  -4.436  -5.044
  240    HA   ASP  33           HA       ASP  33  16.241  -4.264  -4.902
  241   1HB   ASP  33          HB2       ASP  33  15.980  -3.113  -7.181
  242   2HB   ASP  33          HB1       ASP  33  15.297  -4.723  -7.017
  243    H    LEU  34           HN       LEU  34  13.754  -2.230  -3.981
  244    HA   LEU  34           HA       LEU  34  15.089   0.330  -4.126
  245   1HB   LEU  34          HB2       LEU  34  12.484  -0.617  -2.949
  246   2HB   LEU  34          HB1       LEU  34  13.074   1.001  -2.689
  247    HG   LEU  34           HG       LEU  34  12.714   1.598  -4.989
  248   1HD1  LEU  34          HD11      LEU  34  11.990   0.022  -6.691
  249   2HD1  LEU  34          HD12      LEU  34  12.067  -1.304  -5.532
  250   3HD1  LEU  34          HD13      LEU  34  13.541  -0.505  -6.042
  251   1HD2  LEU  34          HD21      LEU  34  10.354   1.033  -5.281
  252   2HD2  LEU  34          HD22      LEU  34  10.743   1.553  -3.624
  253   3HD2  LEU  34          HD23      LEU  34  10.531  -0.165  -3.992
  254    H    GLY  35           HN       GLY  35  15.105  -2.337  -2.049
  255   1HA   GLY  35          HA2       GLY  35  16.892  -2.061  -0.307
  256   2HA   GLY  35          HA1       GLY  35  15.961  -0.668   0.224
  257    H    LEU  36           HN       LEU  36  13.684  -2.835  -0.706
  258    HA   LEU  36           HA       LEU  36  13.063  -3.485   1.958
  259   1HB   LEU  36          HB2       LEU  36  11.138  -3.395   0.857
  260   2HB   LEU  36          HB1       LEU  36  11.707  -4.061  -0.632
  261    HG   LEU  36           HG       LEU  36  11.677  -6.338   0.554
  262   1HD1  LEU  36          HD11      LEU  36  10.254  -6.566   2.518
  263   2HD1  LEU  36          HD12      LEU  36  10.129  -4.808   2.622
  264   3HD1  LEU  36          HD13      LEU  36  11.690  -5.595   2.839
  265   1HD2  LEU  36          HD21      LEU  36   9.957  -5.718  -1.015
  266   2HD2  LEU  36          HD22      LEU  36   9.077  -4.867   0.252
  267   3HD2  LEU  36          HD23      LEU  36   9.260  -6.619   0.332
  268    H    ASP  37           HN       ASP  37  13.899  -4.768   3.154
  269    HA   ASP  37           HA       ASP  37  14.286  -7.529   2.403
  270   1HB   ASP  37          HB2       ASP  37  16.521  -6.504   2.045
  271   2HB   ASP  37          HB1       ASP  37  16.505  -5.929   3.705
  272    H    SER  38           HN       SER  38  14.021  -4.962   4.794
  273    HA   SER  38           HA       SER  38  12.666  -6.898   6.467
  274   1HB   SER  38          HB2       SER  38  14.863  -5.101   7.493
  275   2HB   SER  38          HB1       SER  38  13.804  -6.090   8.502
  276    HG   SER  38           HG       SER  38  14.771  -7.645   6.620
  277    H    LEU  39           HN       LEU  39  13.629  -3.478   7.041
  278    HA   LEU  39           HA       LEU  39  11.262  -2.826   8.345
  279   1HB   LEU  39          HB2       LEU  39  13.430  -1.615   8.542
  280   2HB   LEU  39          HB1       LEU  39  13.185  -0.942   6.956
  281    HG   LEU  39           HG       LEU  39  12.802   0.619   8.883
  282   1HD1  LEU  39          HD11      LEU  39  11.877   1.175   6.723
  283   2HD1  LEU  39          HD12      LEU  39  10.788   1.682   8.014
  284   3HD1  LEU  39          HD13      LEU  39  10.433   0.227   7.077
  285   1HD2  LEU  39          HD21      LEU  39  11.742  -0.907  10.429
  286   2HD2  LEU  39          HD22      LEU  39  10.364  -1.089   9.343
  287   3HD2  LEU  39          HD23      LEU  39  10.679   0.467  10.114
  288    H    MET  40           HN       MET  40  11.981  -2.601   4.908
  289    HA   MET  40           HA       MET  40   9.566  -1.087   4.277
  290   1HB   MET  40          HB2       MET  40  11.445  -2.561   2.441
  291   2HB   MET  40          HB1       MET  40  10.203  -1.409   1.960
  292   1HG   MET  40          HG2       MET  40  11.366   0.372   3.126
  293   2HG   MET  40          HG1       MET  40  12.600  -0.749   3.671
  294   1HE   MET  40          HE1       MET  40  14.696   0.338   2.744
  295   2HE   MET  40          HE2       MET  40  13.689   1.745   2.403
  296   3HE   MET  40          HE3       MET  40  14.790   1.128   1.171
  297    H    GLY  41           HN       GLY  41   9.867  -4.081   5.320
  298   1HA   GLY  41          HA2       GLY  41   7.395  -4.853   3.913
  299   2HA   GLY  41          HA1       GLY  41   8.529  -6.008   4.622
  300    H    VAL  42           HN       VAL  42   9.049  -4.420   6.928
  301    HA   VAL  42           HA       VAL  42   7.047  -5.286   8.716
  302    HB   VAL  42           HB       VAL  42   9.261  -3.237   9.080
  303   1HG1  VAL  42          HG11      VAL  42   8.954  -3.535  11.499
  304   2HG1  VAL  42          HG12      VAL  42   7.520  -4.524  11.179
  305   3HG1  VAL  42          HG13      VAL  42   7.552  -2.823  10.703
  306   1HG2  VAL  42          HG21      VAL  42  10.415  -5.033  10.278
  307   2HG2  VAL  42          HG22      VAL  42  10.089  -5.463   8.600
  308   3HG2  VAL  42          HG23      VAL  42   9.094  -6.138   9.892
  309    H    GLU  43           HN       GLU  43   7.842  -2.034   7.541
  310    HA   GLU  43           HA       GLU  43   5.840  -0.590   8.861
  311   1HB   GLU  43          HB2       GLU  43   7.736   0.388   7.627
  312   2HB   GLU  43          HB1       GLU  43   6.982  -0.106   6.121
  313   1HG   GLU  43          HG2       GLU  43   6.663   2.184   6.560
  314   2HG   GLU  43          HG1       GLU  43   5.084   1.376   6.573
  315    H    VAL  44           HN       VAL  44   5.816  -2.306   5.833
  316    HA   VAL  44           HA       VAL  44   3.259  -1.552   4.902
  317    HB   VAL  44           HB       VAL  44   4.865  -4.065   4.332
  318   1HG1  VAL  44          HG11      VAL  44   2.546  -4.332   3.700
  319   2HG1  VAL  44          HG12      VAL  44   3.608  -4.196   2.285
  320   3HG1  VAL  44          HG13      VAL  44   2.620  -2.815   2.783
  321   1HG2  VAL  44          HG21      VAL  44   5.603  -2.887   2.331
  322   2HG2  VAL  44          HG22      VAL  44   6.092  -2.047   3.803
  323   3HG2  VAL  44          HG23      VAL  44   4.728  -1.450   2.856
  324    H    ARG  45           HN       ARG  45   4.385  -4.390   6.687
  325    HA   ARG  45           HA       ARG  45   1.858  -5.571   6.943
  326   1HB   ARG  45          HB2       ARG  45   4.431  -5.936   8.422
  327   2HB   ARG  45          HB1       ARG  45   3.006  -6.852   8.874
  328   1HG   ARG  45          HG2       ARG  45   2.873  -7.725   6.578
  329   2HG   ARG  45          HG1       ARG  45   4.335  -6.828   6.173
  330   1HD   ARG  45          HD2       ARG  45   4.161  -8.918   8.328
  331   2HD   ARG  45          HD1       ARG  45   4.696  -9.236   6.682
  332    HE   ARG  45           HE       ARG  45   6.386  -7.379   7.267
  333   1HH1  ARG  45          HH11      ARG  45   5.183  -9.806   9.538
  334   2HH1  ARG  45          HH12      ARG  45   6.671 -10.060  10.321
  335   1HH2  ARG  45          HH21      ARG  45   8.543  -7.765   8.371
  336   2HH2  ARG  45          HH22      ARG  45   8.558  -8.799   9.706
  337    H    GLN  46           HN       GLN  46   3.515  -3.211   8.914
  338    HA   GLN  46           HA       GLN  46   1.573  -3.329  10.989
  339   1HB   GLN  46          HB2       GLN  46   3.682  -1.276  10.343
  340   2HB   GLN  46          HB1       GLN  46   2.595  -1.117  11.710
  341   1HG   GLN  46          HG2       GLN  46   3.460  -3.221  12.622
  342   2HG   GLN  46          HG1       GLN  46   4.573  -3.337  11.257
  343   1HE2  GLN  46          HE21      GLN  46   3.739  -1.526  14.101
  344   2HE2  GLN  46          HE22      GLN  46   5.266  -0.723  14.294
  345    H    ILE  47           HN       ILE  47   1.224  -2.299   7.955
  346    HA   ILE  47           HA       ILE  47  -0.829  -0.339   8.706
  347    HB   ILE  47           HB       ILE  47   0.208  -1.036   5.929
  348   1HG1  ILE  47          HG12      ILE  47   0.714   1.463   7.537
  349   2HG1  ILE  47          HG11      ILE  47   1.855   0.122   7.448
  350   1HG2  ILE  47          HG21      ILE  47  -2.101  -0.223   5.936
  351   2HG2  ILE  47          HG22      ILE  47  -1.022   0.980   5.229
  352   3HG2  ILE  47          HG23      ILE  47  -1.616   1.189   6.874
  353   1HD1  ILE  47          HD11      ILE  47   2.036   0.460   5.033
  354   2HD1  ILE  47          HD12      ILE  47   2.468   1.914   5.930
  355   3HD1  ILE  47          HD13      ILE  47   0.897   1.801   5.139
  356    H    LEU  48           HN       LEU  48  -0.319  -3.037   6.476
  357    HA   LEU  48           HA       LEU  48  -3.087  -3.433   6.093
  358   1HB   LEU  48          HB2       LEU  48  -0.732  -5.161   5.371
  359   2HB   LEU  48          HB1       LEU  48  -2.378  -5.635   5.021
  360    HG   LEU  48           HG       LEU  48  -1.459  -4.770   3.025
  361   1HD1  LEU  48          HD11      LEU  48  -2.886  -2.877   2.499
  362   2HD1  LEU  48          HD12      LEU  48  -3.197  -2.647   4.216
  363   3HD1  LEU  48          HD13      LEU  48  -3.747  -4.123   3.413
  364   1HD2  LEU  48          HD21      LEU  48   0.430  -3.519   3.907
  365   2HD2  LEU  48          HD22      LEU  48  -0.660  -2.288   4.545
  366   3HD2  LEU  48          HD23      LEU  48  -0.508  -2.513   2.802
  367    H    GLU  49           HN       GLU  49  -0.750  -5.274   8.038
  368    HA   GLU  49           HA       GLU  49  -2.708  -7.150   8.938
  369   1HB   GLU  49          HB2       GLU  49  -0.376  -7.810   8.737
  370   2HB   GLU  49          HB1       GLU  49   0.099  -6.569   9.880
  371   1HG   GLU  49          HG2       GLU  49  -1.331  -7.769  11.580
  372   2HG   GLU  49          HG1       GLU  49  -1.445  -9.087  10.415
  373    H    ARG  50           HN       ARG  50  -1.214  -4.289  10.216
  374    HA   ARG  50           HA       ARG  50  -2.334  -4.695  12.802
  375   1HB   ARG  50          HB2       ARG  50  -0.164  -3.565  12.371
  376   2HB   ARG  50          HB1       ARG  50  -1.050  -2.205  11.714
  377   1HG   ARG  50          HG2       ARG  50  -0.290  -1.785  13.988
  378   2HG   ARG  50          HG1       ARG  50  -2.049  -1.771  13.882
  379   1HD   ARG  50          HD2       ARG  50  -0.583  -4.270  14.679
  380   2HD   ARG  50          HD1       ARG  50  -0.901  -3.009  15.866
  381    HE   ARG  50           HE       ARG  50  -3.265  -3.250  15.139
  382   1HH1  ARG  50          HH11      ARG  50  -1.027  -6.057  15.054
  383   2HH1  ARG  50          HH12      ARG  50  -2.230  -7.193  15.388
  384   1HH2  ARG  50          HH21      ARG  50  -4.940  -4.915  15.558
  385   2HH2  ARG  50          HH22      ARG  50  -4.521  -6.552  15.620
  386    H    GLU  51           HN       GLU  51  -3.290  -2.677  10.010
  387    HA   GLU  51           HA       GLU  51  -5.399  -1.552  11.638
  388   1HB   GLU  51          HB2       GLU  51  -4.976  -1.206   8.677
  389   2HB   GLU  51          HB1       GLU  51  -6.074  -0.288   9.688
  390   1HG   GLU  51          HG2       GLU  51  -4.099   0.544  10.938
  391   2HG   GLU  51          HG1       GLU  51  -3.079  -0.257   9.743
  392    H    HIS  52           HN       HIS  52  -5.178  -3.838   8.900
  393    HA   HIS  52           HA       HIS  52  -8.083  -4.306   9.245
  394   1HB   HIS  52          HB2       HIS  52  -6.503  -4.261   6.667
  395   2HB   HIS  52          HB1       HIS  52  -8.132  -4.896   6.785
  396    HD1  HIS  52           HD1      HIS  52  -9.756  -3.242   5.896
  397    HD2  HIS  52           HD2      HIS  52  -6.550  -1.387   7.769
  398    HE1  HIS  52           HE1      HIS  52 -10.185  -0.766   5.711
  399    HE2  HIS  52           HE2      HIS  52  -8.227   0.321   6.920
  400    H    ASP  53           HN       ASP  53  -5.353  -5.765   9.967
  401    HA   ASP  53           HA       ASP  53  -4.601  -7.841  10.291
  402   1HB   ASP  53          HB2       ASP  53  -7.484  -8.210  10.414
  403   2HB   ASP  53          HB1       ASP  53  -6.647  -9.676   9.914
  404    H    LEU  54           HN       LEU  54  -4.720  -6.824   7.509
  405    HA   LEU  54           HA       LEU  54  -4.751  -9.284   5.976
  406   1HB   LEU  54          HB2       LEU  54  -4.206  -6.418   5.258
  407   2HB   LEU  54          HB1       LEU  54  -3.621  -7.680   4.204
  408    HG   LEU  54           HG       LEU  54  -5.933  -8.445   3.842
  409   1HD1  LEU  54          HD11      LEU  54  -7.820  -7.077   4.559
  410   2HD1  LEU  54          HD12      LEU  54  -6.725  -6.063   5.501
  411   3HD1  LEU  54          HD13      LEU  54  -6.947  -7.756   5.933
  412   1HD2  LEU  54          HD21      LEU  54  -4.940  -6.872   2.306
  413   2HD2  LEU  54          HD22      LEU  54  -5.470  -5.521   3.307
  414   3HD2  LEU  54          HD23      LEU  54  -6.662  -6.537   2.492
  415    H    VAL  55           HN       VAL  55  -3.229 -10.622   6.605
  416    HA   VAL  55           HA       VAL  55  -0.599  -9.623   7.221
  417    HB   VAL  55           HB       VAL  55  -1.510 -12.516   7.132
  418   1HG1  VAL  55          HG11      VAL  55   0.454 -12.945   8.536
  419   2HG1  VAL  55          HG12      VAL  55   0.905 -11.242   8.415
  420   3HG1  VAL  55          HG13      VAL  55   0.906 -12.258   6.974
  421   1HG2  VAL  55          HG21      VAL  55  -1.710 -12.360   9.577
  422   2HG2  VAL  55          HG22      VAL  55  -2.828 -11.263   8.764
  423   3HG2  VAL  55          HG23      VAL  55  -1.348 -10.635   9.490
  424    H    LEU  56           HN       LEU  56   0.050  -8.822   5.331
  425    HA   LEU  56           HA       LEU  56   0.482 -10.707   3.136
  426   1HB   LEU  56          HB2       LEU  56   0.971  -7.730   3.177
  427   2HB   LEU  56          HB1       LEU  56   1.005  -8.773   1.785
  428    HG   LEU  56           HG       LEU  56  -1.477  -8.078   3.361
  429   1HD1  LEU  56          HD11      LEU  56  -0.553  -7.193   0.636
  430   2HD1  LEU  56          HD12      LEU  56  -0.648  -6.193   2.085
  431   3HD1  LEU  56          HD13      LEU  56  -2.121  -6.832   1.358
  432   1HD2  LEU  56          HD21      LEU  56  -2.690  -9.210   1.565
  433   2HD2  LEU  56          HD22      LEU  56  -1.600 -10.322   2.390
  434   3HD2  LEU  56          HD23      LEU  56  -1.160  -9.668   0.812
  435    HA   PRO  57           HA       PRO  57   4.575 -10.758   5.063
  436   1HB   PRO  57          HB2       PRO  57   5.009 -13.079   3.357
  437   2HB   PRO  57          HB1       PRO  57   4.972 -13.005   5.123
  438   1HG   PRO  57          HG2       PRO  57   3.047 -14.236   3.676
  439   2HG   PRO  57          HG1       PRO  57   2.695 -13.408   5.207
  440   1HD   PRO  57          HD2       PRO  57   2.311 -12.454   2.396
  441   2HD   PRO  57          HD1       PRO  57   1.214 -12.328   3.793
  442    H    ILE  58           HN       ILE  58   6.788 -10.901   4.076
  443    HA   ILE  58           HA       ILE  58   6.946  -9.054   1.970
  444    HB   ILE  58           HB       ILE  58   9.098 -10.717   3.334
  445   1HG1  ILE  58          HG12      ILE  58   9.911  -8.464   4.110
  446   2HG1  ILE  58          HG11      ILE  58   8.484  -7.752   3.373
  447   1HG2  ILE  58          HG21      ILE  58   9.868 -10.419   1.063
  448   2HG2  ILE  58          HG22      ILE  58  10.827  -9.437   2.174
  449   3HG2  ILE  58          HG23      ILE  58   9.586  -8.681   1.170
  450   1HD1  ILE  58          HD11      ILE  58   7.074  -9.010   4.926
  451   2HD1  ILE  58          HD12      ILE  58   8.234  -7.984   5.772
  452   3HD1  ILE  58          HD13      ILE  58   8.518  -9.719   5.647
  453    H    ARG  59           HN       ARG  59   6.837 -12.457   2.003
  454    HA   ARG  59           HA       ARG  59   7.853 -13.261  -0.466
  455   1HB   ARG  59          HB2       ARG  59   5.238 -14.229   0.758
  456   2HB   ARG  59          HB1       ARG  59   6.051 -15.005  -0.575
  457   1HG   ARG  59          HG2       ARG  59   6.385 -16.276   1.437
  458   2HG   ARG  59          HG1       ARG  59   7.927 -15.566   0.964
  459   1HD   ARG  59          HD2       ARG  59   7.850 -13.995   2.687
  460   2HD   ARG  59          HD1       ARG  59   6.125 -14.215   2.933
  461    HE   ARG  59           HE       ARG  59   6.652 -16.391   3.867
  462   1HH1  ARG  59          HH11      ARG  59   9.379 -14.189   3.564
  463   2HH1  ARG  59          HH12      ARG  59  10.081 -14.590   5.061
  464   1HH2  ARG  59          HH21      ARG  59   7.573 -16.918   5.979
  465   2HH2  ARG  59          HH22      ARG  59   9.011 -16.163   6.485
  466    H    GLU  60           HN       GLU  60   4.811 -11.656   0.246
  467    HA   GLU  60           HA       GLU  60   4.059 -11.619  -2.605
  468   1HB   GLU  60          HB2       GLU  60   2.437 -11.068  -0.115
  469   2HB   GLU  60          HB1       GLU  60   1.794 -11.079  -1.751
  470   1HG   GLU  60          HG2       GLU  60   2.350 -13.447  -1.962
  471   2HG   GLU  60          HG1       GLU  60   3.056 -13.437  -0.353
  472    H    VAL  61           HN       VAL  61   4.763  -9.555   0.137
  473    HA   VAL  61           HA       VAL  61   3.986  -7.127  -1.100
  474    HB   VAL  61           HB       VAL  61   5.846  -7.639   1.251
  475   1HG1  VAL  61          HG11      VAL  61   5.554  -5.284   1.843
  476   2HG1  VAL  61          HG12      VAL  61   4.636  -5.018   0.362
  477   3HG1  VAL  61          HG13      VAL  61   6.347  -5.441   0.275
  478   1HG2  VAL  61          HG21      VAL  61   2.974  -6.759   1.113
  479   2HG2  VAL  61          HG22      VAL  61   3.929  -6.927   2.589
  480   3HG2  VAL  61          HG23      VAL  61   3.558  -8.347   1.604
  481    H    ARG  62           HN       ARG  62   6.864  -9.030  -1.306
  482    HA   ARG  62           HA       ARG  62   8.715  -7.009  -1.923
  483   1HB   ARG  62          HB2       ARG  62   9.061  -9.436  -1.148
  484   2HB   ARG  62          HB1       ARG  62   8.982  -9.833  -2.856
  485   1HG   ARG  62          HG2       ARG  62  10.839  -8.436  -3.320
  486   2HG   ARG  62          HG1       ARG  62  10.886  -7.862  -1.659
  487   1HD   ARG  62          HD2       ARG  62  12.584  -9.526  -1.877
  488   2HD   ARG  62          HD1       ARG  62  11.267 -10.268  -0.967
  489    HE   ARG  62           HE       ARG  62  11.014 -10.712  -3.759
  490   1HH1  ARG  62          HH11      ARG  62  12.664 -11.975  -0.851
  491   2HH1  ARG  62          HH12      ARG  62  13.076 -13.450  -1.593
  492   1HH2  ARG  62          HH21      ARG  62  11.542 -12.710  -4.713
  493   2HH2  ARG  62          HH22      ARG  62  12.381 -13.909  -3.849
  494    H    GLN  63           HN       GLN  63   6.199  -8.107  -3.826
  495    HA   GLN  63           HA       GLN  63   7.622  -7.374  -6.280
  496   1HB   GLN  63          HB2       GLN  63   5.100  -9.015  -5.948
  497   2HB   GLN  63          HB1       GLN  63   5.653  -8.457  -7.503
  498   1HG   GLN  63          HG2       GLN  63   6.368 -10.652  -7.423
  499   2HG   GLN  63          HG1       GLN  63   7.805  -9.757  -6.942
  500   1HE2  GLN  63          HE21      GLN  63   5.057 -10.317  -4.849
  501   2HE2  GLN  63          HE22      GLN  63   5.892 -11.411  -3.798
  502    H    LEU  64           HN       LEU  64   5.910  -5.900  -4.040
  503    HA   LEU  64           HA       LEU  64   3.898  -4.644  -5.705
  504   1HB   LEU  64          HB2       LEU  64   4.763  -3.916  -2.905
  505   2HB   LEU  64          HB1       LEU  64   3.351  -3.298  -3.738
  506    HG   LEU  64           HG       LEU  64   3.821  -6.103  -2.793
  507   1HD1  LEU  64          HD11      LEU  64   1.873  -3.996  -1.883
  508   2HD1  LEU  64          HD12      LEU  64   3.284  -4.581  -1.000
  509   3HD1  LEU  64          HD13      LEU  64   1.921  -5.659  -1.297
  510   1HD2  LEU  64          HD21      LEU  64   2.566  -6.159  -4.878
  511   2HD2  LEU  64          HD22      LEU  64   1.428  -4.969  -4.243
  512   3HD2  LEU  64          HD23      LEU  64   1.514  -6.576  -3.525
  513    H    THR  65           HN       THR  65   4.627  -3.348  -7.198
  514    HA   THR  65           HA       THR  65   7.186  -2.167  -7.266
  515    HB   THR  65           HB       THR  65   6.312  -1.335  -9.438
  516    HG1  THR  65           HG1      THR  65   4.198  -1.377  -9.740
  517   1HG2  THR  65          HG21      THR  65   5.642  -4.183  -8.800
  518   2HG2  THR  65          HG22      THR  65   7.285  -3.600  -9.025
  519   3HG2  THR  65          HG23      THR  65   6.138  -3.549 -10.382
  520    H    LEU  66           HN       LEU  66   5.926  -1.074  -5.096
  521    HA   LEU  66           HA       LEU  66   5.619   0.803  -3.949
  522   1HB   LEU  66          HB2       LEU  66   7.706   1.417  -5.360
  523   2HB   LEU  66          HB1       LEU  66   6.616   2.403  -6.305
  524    HG   LEU  66           HG       LEU  66   7.877   3.722  -4.666
  525   1HD1  LEU  66          HD11      LEU  66   6.025   4.912  -3.625
  526   2HD1  LEU  66          HD12      LEU  66   4.954   3.559  -4.035
  527   3HD1  LEU  66          HD13      LEU  66   5.697   4.511  -5.316
  528   1HD2  LEU  66          HD21      LEU  66   8.184   2.023  -2.963
  529   2HD2  LEU  66          HD22      LEU  66   6.459   2.043  -2.605
  530   3HD2  LEU  66          HD23      LEU  66   7.444   3.467  -2.271
  531    H    ARG  67           HN       ARG  67   4.647   1.595  -7.277
  532    HA   ARG  67           HA       ARG  67   2.438   3.088  -6.249
  533   1HB   ARG  67          HB2       ARG  67   3.405   2.555  -9.010
  534   2HB   ARG  67          HB1       ARG  67   1.746   3.100  -8.789
  535   1HG   ARG  67          HG2       ARG  67   4.202   4.524  -7.787
  536   2HG   ARG  67          HG1       ARG  67   3.250   4.977  -9.208
  537   1HD   ARG  67          HD2       ARG  67   1.257   5.199  -7.720
  538   2HD   ARG  67          HD1       ARG  67   2.292   4.854  -6.367
  539    HE   ARG  67           HE       ARG  67   3.371   6.890  -6.585
  540   1HH1  ARG  67          HH11      ARG  67   0.840   6.644  -9.097
  541   2HH1  ARG  67          HH12      ARG  67   0.533   8.318  -9.116
  542   1HH2  ARG  67          HH21      ARG  67   2.908   9.213  -6.645
  543   2HH2  ARG  67          HH22      ARG  67   1.756   9.799  -7.731
  544    H    LYS  68           HN       LYS  68   2.903  -0.144  -6.982
  545    HA   LYS  68           HA       LYS  68   0.158  -0.751  -7.415
  546   1HB   LYS  68          HB2       LYS  68   2.043  -2.332  -7.969
  547   2HB   LYS  68          HB1       LYS  68   2.256  -2.580  -6.237
  548   1HG   LYS  68          HG2       LYS  68   0.098  -3.556  -6.035
  549   2HG   LYS  68          HG1       LYS  68  -0.292  -3.156  -7.705
  550   1HD   LYS  68          HD2       LYS  68   1.504  -4.641  -8.460
  551   2HD   LYS  68          HD1       LYS  68   1.850  -5.043  -6.772
  552   1HE   LYS  68          HE2       LYS  68  -0.323  -5.975  -6.491
  553   2HE   LYS  68          HE1       LYS  68  -0.820  -5.442  -8.094
  554   1HZ   LYS  68          HZ1       LYS  68  -0.261  -7.813  -8.091
  555   2HZ   LYS  68          HZ2       LYS  68   1.324  -7.456  -7.578
  556   3HZ   LYS  68          HZ3       LYS  68   0.789  -6.938  -9.068
  557    H    LEU  69           HN       LEU  69   2.057  -0.022  -4.736
  558    HA   LEU  69           HA       LEU  69   0.509  -1.014  -2.588
  559   1HB   LEU  69          HB2       LEU  69   2.323   1.372  -2.760
  560   2HB   LEU  69          HB1       LEU  69   1.338   1.138  -1.338
  561    HG   LEU  69           HG       LEU  69   3.553   0.369  -0.910
  562   1HD1  LEU  69          HD11      LEU  69   3.144  -1.939  -0.237
  563   2HD1  LEU  69          HD12      LEU  69   1.691  -1.955  -1.239
  564   3HD1  LEU  69          HD13      LEU  69   1.792  -0.870   0.146
  565   1HD2  LEU  69          HD21      LEU  69   4.593  -1.472  -2.140
  566   2HD2  LEU  69          HD22      LEU  69   4.295  -0.079  -3.182
  567   3HD2  LEU  69          HD23      LEU  69   3.232  -1.485  -3.260
  568    H    GLN  70           HN       GLN  70   0.095   1.989  -4.439
  569    HA   GLN  70           HA       GLN  70  -2.158   2.699  -2.767
  570   1HB   GLN  70          HB2       GLN  70  -2.456   4.644  -4.243
  571   2HB   GLN  70          HB1       GLN  70  -0.828   4.540  -3.594
  572   1HG   GLN  70          HG2       GLN  70   0.077   3.916  -5.581
  573   2HG   GLN  70          HG1       GLN  70  -1.478   3.441  -6.299
  574   1HE2  GLN  70          HE21      GLN  70  -1.301   4.710  -8.024
  575   2HE2  GLN  70          HE22      GLN  70  -1.346   6.435  -7.992
  576    H    GLU  71           HN       GLU  71  -1.759   0.535  -5.173
  577    HA   GLU  71           HA       GLU  71  -4.429   0.915  -6.272
  578   1HB   GLU  71          HB2       GLU  71  -2.348   0.217  -7.653
  579   2HB   GLU  71          HB1       GLU  71  -2.493  -1.340  -6.856
  580   1HG   GLU  71          HG2       GLU  71  -3.508  -1.449  -9.027
  581   2HG   GLU  71          HG1       GLU  71  -4.767  -1.566  -7.795
  582    H    MET  72           HN       MET  72  -2.859  -0.444  -3.714
  583    HA   MET  72           HA       MET  72  -5.008  -2.378  -3.141
  584   1HB   MET  72          HB2       MET  72  -2.118  -2.396  -2.207
  585   2HB   MET  72          HB1       MET  72  -3.343  -3.565  -1.751
  586   1HG   MET  72          HG2       MET  72  -2.220  -3.160  -4.525
  587   2HG   MET  72          HG1       MET  72  -1.817  -4.459  -3.414
  588   1HE   MET  72          HE1       MET  72  -3.478  -6.397  -2.703
  589   2HE   MET  72          HE2       MET  72  -5.170  -6.464  -3.207
  590   3HE   MET  72          HE3       MET  72  -4.620  -5.181  -2.130
  591    H    SER  73           HN       SER  73  -4.770   0.553  -2.688
  592    HA   SER  73           HA       SER  73  -3.927   1.004  -0.029
  593   1HB   SER  73          HB2       SER  73  -4.800   3.311  -0.457
  594   2HB   SER  73          HB1       SER  73  -3.657   2.698  -1.647
  595    HG   SER  73           HG       SER  73  -5.400   3.638  -2.721
  596    H    SER  74           HN       SER  74  -6.851  -0.020  -1.440
  597    HA   SER  74           HA       SER  74  -8.821  -0.742  -0.601
  598   1HB   SER  74          HB2       SER  74  -7.744  -0.011   2.139
  599   2HB   SER  74          HB1       SER  74  -9.161  -1.013   1.814
  600    HG   SER  74           HG       SER  74  -6.580  -1.640   1.896
  601    H    LYS  75           HN       LYS  75  -8.180   2.156  -1.179
  602    HA   LYS  75           HA       LYS  75  -9.877   3.755   0.395
  603   1HB   LYS  75          HB2       LYS  75  -8.981   4.145  -2.438
  604   2HB   LYS  75          HB1       LYS  75  -9.912   5.323  -1.530
  605   1HG   LYS  75          HG2       LYS  75  -8.051   5.403   0.111
  606   2HG   LYS  75          HG1       LYS  75  -7.118   4.381  -0.998
  607   1HD   LYS  75          HD2       LYS  75  -7.449   6.013  -2.776
  608   2HD   LYS  75          HD1       LYS  75  -8.344   7.048  -1.661
  609   1HE   LYS  75          HE2       LYS  75  -6.347   7.219  -0.264
  610   2HE   LYS  75          HE1       LYS  75  -5.470   6.213  -1.413
  611   1HZ   LYS  75          HZ1       LYS  75  -4.936   8.387  -1.969
  612   2HZ   LYS  75          HZ2       LYS  75  -6.511   8.956  -1.821
  613   3HZ   LYS  75          HZ3       LYS  75  -6.088   7.947  -3.132
  614    H    ALA  76           HN       ALA  76 -11.929   3.814   0.528
  615    HA   ALA  76           HA       ALA  76 -13.566   3.185  -1.814
  616   1HB   ALA  76          HB1       ALA  76 -14.225   2.724   1.104
  617   2HB   ALA  76          HB2       ALA  76 -13.864   1.470  -0.083
  618   3HB   ALA  76          HB3       ALA  76 -15.324   2.447  -0.247
  619    H    GLY  77           HN       GLY  77 -13.799   5.241  -2.518
  620   1HA   GLY  77          HA2       GLY  77 -14.111   7.490  -0.749
  621   2HA   GLY  77          HA1       GLY  77 -14.185   7.519  -2.500
  622    H    SER  78           HN       SER  78 -16.126   5.751  -0.166
  623    HA   SER  78           HA       SER  78 -18.549   6.557  -1.489
  624   1HB   SER  78          HB2       SER  78 -18.125   4.778   0.915
  625   2HB   SER  78          HB1       SER  78 -19.573   4.874  -0.089
  626    HG   SER  78           HG       SER  78 -18.105   4.328  -1.861
  627    H    ASP  79           HN       ASP  79 -16.659   7.674   1.071
  628    HA   ASP  79           HA       ASP  79 -18.851   8.724   2.647
  629   1HB   ASP  79          HB2       ASP  79 -16.894   7.992   3.876
  630   2HB   ASP  79          HB1       ASP  79 -15.865   9.069   2.936
  631    H    THR  80           HN       THR  80 -19.811  10.529   2.191
  632    HA   THR  80           HA       THR  80 -18.252  12.752   1.411
  633    HB   THR  80           HB       THR  80 -18.602  12.025  -0.815
  634    HG1  THR  80           HG1      THR  80 -19.644  13.789  -1.644
  635   1HG2  THR  80          HG21      THR  80 -20.816  11.507  -1.779
  636   2HG2  THR  80          HG22      THR  80 -21.556  11.732  -0.195
  637   3HG2  THR  80          HG23      THR  80 -20.423  10.406  -0.458
  638    H    GLU  81           HN       GLU  81 -18.774  13.635   3.256
  639    HA   GLU  81           HA       GLU  81 -21.485  14.753   3.306
  640   1HB   GLU  81          HB2       GLU  81 -21.499  14.744   5.750
  641   2HB   GLU  81          HB1       GLU  81 -21.314  13.109   5.135
  642   1HG   GLU  81          HG2       GLU  81 -18.968  13.133   5.664
  643   2HG   GLU  81          HG1       GLU  81 -19.060  14.827   6.148
  644    H    LEU  82           HN       LEU  82 -18.063  15.147   3.841
  645    HA   LEU  82           HA       LEU  82 -18.472  17.989   4.404
  646   1HB   LEU  82          HB2       LEU  82 -17.064  16.562   5.934
  647   2HB   LEU  82          HB1       LEU  82 -15.940  16.350   4.610
  648    HG   LEU  82           HG       LEU  82 -15.539  18.804   4.609
  649   1HD1  LEU  82          HD11      LEU  82 -16.293  20.137   6.515
  650   2HD1  LEU  82          HD12      LEU  82 -17.232  18.763   7.100
  651   3HD1  LEU  82          HD13      LEU  82 -17.652  19.529   5.569
  652   1HD2  LEU  82          HD21      LEU  82 -14.205  18.837   6.668
  653   2HD2  LEU  82          HD22      LEU  82 -14.034  17.309   5.802
  654   3HD2  LEU  82          HD23      LEU  82 -15.060  17.401   7.236
  655    H    ALA  83           HN       ALA  83 -18.491  16.324   1.793
  656    HA   ALA  83           HA       ALA  83 -16.354  17.601   0.302
  657   1HB   ALA  83          HB1       ALA  83 -16.927  15.279  -0.230
  658   2HB   ALA  83          HB2       ALA  83 -17.192  16.334  -1.620
  659   3HB   ALA  83          HB3       ALA  83 -18.563  15.780  -0.658
  660    H    ALA  84           HN       ALA  84 -19.786  17.807   0.759
  661    HA   ALA  84           HA       ALA  84 -20.356  19.695  -1.256
  662   1HB   ALA  84          HB1       ALA  84 -21.745  19.260   1.399
  663   2HB   ALA  84          HB2       ALA  84 -22.111  18.418  -0.108
  664   3HB   ALA  84          HB3       ALA  84 -22.402  20.150   0.025
  665    HA   PRO  85           HA       PRO  85 -18.005  23.056   0.416
  666   1HB   PRO  85          HB2       PRO  85 -19.628  24.701  -1.434
  667   2HB   PRO  85          HB1       PRO  85 -17.874  24.506  -1.343
  668   1HG   PRO  85          HG2       PRO  85 -19.285  23.388  -3.318
  669   2HG   PRO  85          HG1       PRO  85 -17.899  22.555  -2.591
  670   1HD   PRO  85          HD2       PRO  85 -20.823  22.123  -2.128
  671   2HD   PRO  85          HD1       PRO  85 -19.524  20.929  -2.310
  672    H    LYS  86           HN       LYS  86 -18.704  23.361   2.434
  673    HA   LYS  86           HA       LYS  86 -20.703  25.441   2.816
  674   1HB   LYS  86          HB2       LYS  86 -20.454  22.916   4.488
  675   2HB   LYS  86          HB1       LYS  86 -21.461  24.296   4.896
  676   1HG   LYS  86          HG2       LYS  86 -22.831  23.881   2.914
  677   2HG   LYS  86          HG1       LYS  86 -21.808  22.510   2.488
  678   1HD   LYS  86          HD2       LYS  86 -23.415  22.771   5.033
  679   2HD   LYS  86          HD1       LYS  86 -23.895  21.832   3.620
  680   1HE   LYS  86          HE2       LYS  86 -21.957  20.390   3.888
  681   2HE   LYS  86          HE1       LYS  86 -21.390  21.371   5.241
  682   1HZ   LYS  86          HZ1       LYS  86 -23.927  19.834   5.171
  683   2HZ   LYS  86          HZ2       LYS  86 -23.395  20.768   6.454
  684   3HZ   LYS  86          HZ3       LYS  86 -22.541  19.369   6.024
  685    H    SER  87           HN       SER  87 -19.052  26.878   3.090
  686    HA   SER  87           HA       SER  87 -17.528  26.527   5.550
  687   1HB   SER  87          HB2       SER  87 -16.298  27.317   2.903
  688   2HB   SER  87          HB1       SER  87 -15.467  27.300   4.459
  689    HG   SER  87           HG       SER  87 -16.670  24.963   4.096
  690    H    LYS  88           HN       LYS  88 -18.192  28.152   6.729
  691    HA   LYS  88           HA       LYS  88 -18.832  30.733   5.563
  692   1HB   LYS  88          HB2       LYS  88 -20.083  29.800   7.532
  693   2HB   LYS  88          HB1       LYS  88 -18.610  29.924   8.481
  694   1HG   LYS  88          HG2       LYS  88 -18.620  32.371   8.097
  695   2HG   LYS  88          HG1       LYS  88 -20.165  32.195   7.264
  696   1HD   LYS  88          HD2       LYS  88 -21.095  31.181   9.343
  697   2HD   LYS  88          HD1       LYS  88 -19.566  31.544  10.145
  698   1HE   LYS  88          HE2       LYS  88 -19.893  33.934   9.657
  699   2HE   LYS  88          HE1       LYS  88 -21.439  33.554   8.898
  700   1HZ   LYS  88          HZ1       LYS  88 -21.904  34.238  11.143
  701   2HZ   LYS  88          HZ2       LYS  88 -20.685  33.262  11.737
  702   3HZ   LYS  88          HZ3       LYS  88 -22.058  32.547  11.132
  703    H    ASN  89           HN       ASN  89 -16.384  29.146   7.492
  704    HA   ASN  89           HA       ASN  89 -14.359  30.980   6.772
  705   1HB   ASN  89          HB2       ASN  89 -13.710  31.496   9.123
  706   2HB   ASN  89          HB1       ASN  89 -15.256  32.210   8.696
  707   1HD2  ASN  89          HD21      ASN  89 -13.626  29.870  10.689
  708   2HD2  ASN  89          HD22      ASN  89 -15.002  29.507  11.678
  Start of MODEL   28
    1   1H    GLY   1          HT1       GLY   1   2.083   6.866  19.187
    2   2H    GLY   1          HT2       GLY   1   1.393   5.574  18.335
    3   3H    GLY   1          HT3       GLY   1   0.544   7.016  18.539
    4   1HA   GLY   1          HA1       GLY   1   2.042   8.185  17.121
    5   2HA   GLY   1          HA2       GLY   1   3.069   6.758  17.023
    6    H    ASP   2           HN       ASP   2  -0.095   8.023  16.266
    7    HA   ASP   2           HA       ASP   2  -0.174   6.362  13.887
    8   1HB   ASP   2          HB2       ASP   2  -2.438   5.485  14.303
    9   2HB   ASP   2          HB1       ASP   2  -1.312   4.933  15.532
   10    H    GLY   3           HN       GLY   3  -1.438   9.052  15.768
   11   1HA   GLY   3          HA2       GLY   3  -2.053  11.107  14.996
   12   2HA   GLY   3          HA1       GLY   3  -1.838  10.530  13.350
   13    H    GLU   4           HN       GLU   4  -3.527   9.613  12.281
   14    HA   GLU   4           HA       GLU   4  -6.143  10.163  13.420
   15   1HB   GLU   4          HB2       GLU   4  -5.304   9.371  10.636
   16   2HB   GLU   4          HB1       GLU   4  -6.950   9.734  11.129
   17   1HG   GLU   4          HG2       GLU   4  -6.303  12.006  11.667
   18   2HG   GLU   4          HG1       GLU   4  -4.637  11.643  11.204
   19    H    ALA   5           HN       ALA   5  -4.550   7.607  11.570
   20    HA   ALA   5           HA       ALA   5  -5.030   5.517  13.339
   21   1HB   ALA   5          HB1       ALA   5  -6.774   4.245  12.190
   22   2HB   ALA   5          HB2       ALA   5  -7.016   5.576  11.059
   23   3HB   ALA   5          HB3       ALA   5  -7.405   5.788  12.768
   24    H    GLN   6           HN       GLN   6  -5.368   5.977   9.855
   25    HA   GLN   6           HA       GLN   6  -3.060   4.198   9.447
   26   1HB   GLN   6          HB2       GLN   6  -5.199   3.020   9.001
   27   2HB   GLN   6          HB1       GLN   6  -5.629   4.263   7.842
   28   1HG   GLN   6          HG2       GLN   6  -3.626   3.623   6.508
   29   2HG   GLN   6          HG1       GLN   6  -3.360   2.299   7.636
   30   1HE2  GLN   6          HE21      GLN   6  -4.726   0.590   7.603
   31   2HE2  GLN   6          HE22      GLN   6  -5.847   0.288   6.324
   32    H    ARG   7           HN       ARG   7  -2.018   4.557   7.402
   33    HA   ARG   7           HA       ARG   7  -2.528   7.141   6.143
   34   1HB   ARG   7          HB2       ARG   7  -0.115   7.351   5.802
   35   2HB   ARG   7          HB1       ARG   7  -0.476   7.225   7.513
   36   1HG   ARG   7          HG2       ARG   7   0.126   4.793   7.365
   37   2HG   ARG   7          HG1       ARG   7   0.672   5.108   5.714
   38   1HD   ARG   7          HD2       ARG   7   1.710   6.413   8.226
   39   2HD   ARG   7          HD1       ARG   7   2.549   5.199   7.263
   40    HE   ARG   7           HE       ARG   7   2.732   6.815   5.500
   41   1HH1  ARG   7          HH11      ARG   7   1.719   8.125   8.637
   42   2HH1  ARG   7          HH12      ARG   7   2.227   9.713   8.312
   43   1HH2  ARG   7          HH21      ARG   7   3.455   8.977   5.039
   44   2HH2  ARG   7          HH22      ARG   7   3.317  10.213   6.220
   45    H    ASP   8           HN       ASP   8  -1.806   7.081   3.849
   46    HA   ASP   8           HA       ASP   8  -2.611   4.596   2.674
   47   1HB   ASP   8          HB2       ASP   8  -3.253   6.587   1.521
   48   2HB   ASP   8          HB1       ASP   8  -1.593   7.160   1.446
   49    H    LEU   9           HN       LEU   9  -1.380   3.249   1.389
   50    HA   LEU   9           HA       LEU   9   1.073   2.651   2.587
   51   1HB   LEU   9          HB2       LEU   9  -0.335   1.454   0.248
   52   2HB   LEU   9          HB1       LEU   9   1.224   0.864   0.772
   53    HG   LEU   9           HG       LEU   9  -1.282   0.916   2.454
   54   1HD1  LEU   9          HD11      LEU   9  -1.254  -1.444   2.235
   55   2HD1  LEU   9          HD12      LEU   9   0.263  -1.397   1.332
   56   3HD1  LEU   9          HD13      LEU   9  -1.210  -0.747   0.606
   57   1HD2  LEU   9          HD21      LEU   9   1.463  -0.169   3.021
   58   2HD2  LEU   9          HD22      LEU   9   0.041  -0.363   4.046
   59   3HD2  LEU   9          HD23      LEU   9   0.730   1.244   3.781
   60    H    VAL  10           HN       VAL  10   0.437   4.455  -0.344
   61    HA   VAL  10           HA       VAL  10   3.227   4.231  -1.046
   62    HB   VAL  10           HB       VAL  10   0.984   5.874  -2.276
   63   1HG1  VAL  10          HG11      VAL  10   3.117   7.101  -2.547
   64   2HG1  VAL  10          HG12      VAL  10   2.548   6.448  -4.083
   65   3HG1  VAL  10          HG13      VAL  10   3.858   5.649  -3.216
   66   1HG2  VAL  10          HG21      VAL  10   2.553   3.486  -3.199
   67   2HG2  VAL  10          HG22      VAL  10   1.342   4.343  -4.144
   68   3HG2  VAL  10          HG23      VAL  10   0.876   3.505  -2.651
   69    H    LYS  11           HN       LYS  11   1.180   6.343   0.687
   70    HA   LYS  11           HA       LYS  11   3.206   8.384   0.958
   71   1HB   LYS  11          HB2       LYS  11   0.540   8.025   2.376
   72   2HB   LYS  11          HB1       LYS  11   1.622   9.367   2.683
   73   1HG   LYS  11          HG2       LYS  11  -0.265   9.998   1.214
   74   2HG   LYS  11          HG1       LYS  11   1.289  10.193   0.404
   75   1HD   LYS  11          HD2       LYS  11   0.967   8.338  -0.931
   76   2HD   LYS  11          HD1       LYS  11  -0.267   7.649   0.091
   77   1HE   LYS  11          HE2       LYS  11  -1.717   9.618  -0.626
   78   2HE   LYS  11          HE1       LYS  11  -0.431   9.943  -1.805
   79   1HZ   LYS  11          HZ1       LYS  11  -0.857   8.052  -2.970
   80   2HZ   LYS  11          HZ2       LYS  11  -2.429   8.411  -2.469
   81   3HZ   LYS  11          HZ3       LYS  11  -1.520   7.227  -1.662
   82    H    ALA  12           HN       ALA  12   2.842   5.406   2.075
   83    HA   ALA  12           HA       ALA  12   4.255   5.877   4.584
   84   1HB   ALA  12          HB1       ALA  12   2.993   3.342   3.517
   85   2HB   ALA  12          HB2       ALA  12   2.297   4.406   4.743
   86   3HB   ALA  12          HB3       ALA  12   3.781   3.519   5.087
   87    H    VAL  13           HN       VAL  13   4.367   3.416   1.992
   88    HA   VAL  13           HA       VAL  13   7.026   2.642   2.472
   89    HB   VAL  13           HB       VAL  13   5.414   2.311  -0.071
   90   1HG1  VAL  13          HG11      VAL  13   7.776   1.921  -0.460
   91   2HG1  VAL  13          HG12      VAL  13   6.884   0.400  -0.524
   92   3HG1  VAL  13          HG13      VAL  13   7.839   0.802   0.905
   93   1HG2  VAL  13          HG21      VAL  13   4.260   1.381   1.848
   94   2HG2  VAL  13          HG22      VAL  13   5.709   0.482   2.304
   95   3HG2  VAL  13          HG23      VAL  13   4.861   0.093   0.807
   96    H    ALA  14           HN       ALA  14   5.679   4.623  -0.154
   97    HA   ALA  14           HA       ALA  14   8.190   5.132  -1.323
   98   1HB   ALA  14          HB1       ALA  14   5.623   6.737  -1.637
   99   2HB   ALA  14          HB2       ALA  14   6.032   5.339  -2.578
  100   3HB   ALA  14          HB3       ALA  14   7.015   6.808  -2.722
  101    H    HIS  15           HN       HIS  15   6.292   6.791   1.085
  102    HA   HIS  15           HA       HIS  15   7.978   9.092   1.132
  103   1HB   HIS  15          HB2       HIS  15   5.593   9.170   1.843
  104   2HB   HIS  15          HB1       HIS  15   6.001   8.204   3.247
  105    HD1  HIS  15           HD1      HIS  15   7.456  11.479   1.827
  106    HD2  HIS  15           HD2      HIS  15   6.086   9.845   5.403
  107    HE1  HIS  15           HE1      HIS  15   7.676  13.279   3.511
  108    HE2  HIS  15           HE2      HIS  15   6.511  12.406   5.516
  109    H    ILE  16           HN       ILE  16   8.351   5.981   2.459
  110    HA   ILE  16           HA       ILE  16  10.217   6.748   4.503
  111    HB   ILE  16           HB       ILE  16   9.740   4.081   3.117
  112   1HG1  ILE  16          HG12      ILE  16   7.940   4.731   4.608
  113   2HG1  ILE  16          HG11      ILE  16   8.823   3.375   5.295
  114   1HG2  ILE  16          HG21      ILE  16  12.073   4.131   3.760
  115   2HG2  ILE  16          HG22      ILE  16  11.183   3.012   4.792
  116   3HG2  ILE  16          HG23      ILE  16  11.635   4.603   5.402
  117   1HD1  ILE  16          HD11      ILE  16   9.094   6.265   6.105
  118   2HD1  ILE  16          HD12      ILE  16   9.997   4.916   6.795
  119   3HD1  ILE  16          HD13      ILE  16   8.247   5.002   7.000
  120    H    LEU  17           HN       LEU  17  10.346   5.694   1.180
  121    HA   LEU  17           HA       LEU  17  13.178   5.732   0.882
  122   1HB   LEU  17          HB2       LEU  17  11.044   6.044  -1.227
  123   2HB   LEU  17          HB1       LEU  17  12.711   5.590  -1.494
  124    HG   LEU  17           HG       LEU  17  10.641   3.935  -0.052
  125   1HD1  LEU  17          HD11      LEU  17  10.836   2.455  -1.984
  126   2HD1  LEU  17          HD12      LEU  17  11.931   3.606  -2.748
  127   3HD1  LEU  17          HD13      LEU  17  10.254   4.056  -2.439
  128   1HD2  LEU  17          HD21      LEU  17  12.338   2.175  -0.064
  129   2HD2  LEU  17          HD22      LEU  17  12.883   3.580   0.855
  130   3HD2  LEU  17          HD23      LEU  17  13.499   3.297  -0.774
  131    H    GLY  18           HN       GLY  18  10.609   8.025   0.457
  132   1HA   GLY  18          HA2       GLY  18  11.151  10.378   0.894
  133   2HA   GLY  18          HA1       GLY  18  12.606  10.127  -0.064
  134    H    ILE  19           HN       ILE  19   9.692   8.632  -1.117
  135    HA   ILE  19           HA       ILE  19   9.376  10.682  -3.152
  136    HB   ILE  19           HB       ILE  19   8.478   8.695  -4.523
  137   1HG1  ILE  19          HG12      ILE  19  10.485   7.244  -2.792
  138   2HG1  ILE  19          HG11      ILE  19   8.749   6.986  -2.812
  139   1HG2  ILE  19          HG21      ILE  19  10.301  10.108  -5.248
  140   2HG2  ILE  19          HG22      ILE  19  10.720   8.429  -5.590
  141   3HG2  ILE  19          HG23      ILE  19  11.435   9.251  -4.199
  142   1HD1  ILE  19          HD11      ILE  19  10.642   6.464  -5.096
  143   2HD1  ILE  19          HD12      ILE  19   8.895   6.201  -5.124
  144   3HD1  ILE  19          HD13      ILE  19   9.910   5.250  -4.045
  145    H    ARG  20           HN       ARG  20   7.340  10.485  -4.253
  146    HA   ARG  20           HA       ARG  20   5.099   9.151  -3.167
  147   1HB   ARG  20          HB2       ARG  20   5.242  10.784  -1.407
  148   2HB   ARG  20          HB1       ARG  20   5.418  12.092  -2.566
  149   1HG   ARG  20          HG2       ARG  20   3.142  11.827  -3.282
  150   2HG   ARG  20          HG1       ARG  20   2.953  10.393  -2.266
  151   1HD   ARG  20          HD2       ARG  20   2.008  12.467  -1.277
  152   2HD   ARG  20          HD1       ARG  20   3.226  11.673  -0.283
  153    HE   ARG  20           HE       ARG  20   4.115  13.813  -2.033
  154   1HH1  ARG  20          HH11      ARG  20   3.036  12.879   1.189
  155   2HH1  ARG  20          HH12      ARG  20   3.921  14.056   2.027
  156   1HH2  ARG  20          HH21      ARG  20   5.341  15.549  -0.868
  157   2HH2  ARG  20          HH22      ARG  20   5.248  15.602   0.826
  158    H    ASP  21           HN       ASP  21   6.457  11.725  -5.112
  159    HA   ASP  21           HA       ASP  21   4.202  12.091  -6.756
  160   1HB   ASP  21          HB2       ASP  21   5.581  13.387  -8.255
  161   2HB   ASP  21          HB1       ASP  21   6.124  13.744  -6.625
  162    H    LEU  22           HN       LEU  22   7.143  10.250  -7.441
  163    HA   LEU  22           HA       LEU  22   7.507   8.429  -8.747
  164   1HB   LEU  22          HB2       LEU  22   4.555   8.134  -8.282
  165   2HB   LEU  22          HB1       LEU  22   5.390   7.063  -9.381
  166    HG   LEU  22           HG       LEU  22   5.045   6.072  -7.260
  167   1HD1  LEU  22          HD11      LEU  22   7.396   5.384  -6.781
  168   2HD1  LEU  22          HD12      LEU  22   7.936   6.718  -7.814
  169   3HD1  LEU  22          HD13      LEU  22   6.996   5.406  -8.501
  170   1HD2  LEU  22          HD21      LEU  22   5.016   7.969  -5.774
  171   2HD2  LEU  22          HD22      LEU  22   6.720   8.286  -6.076
  172   3HD2  LEU  22          HD23      LEU  22   6.229   6.824  -5.218
  173    H    ALA  23           HN       ALA  23   6.891  11.127  -9.891
  174    HA   ALA  23           HA       ALA  23   5.479  10.557 -12.314
  175   1HB   ALA  23          HB1       ALA  23   5.305  12.755 -11.240
  176   2HB   ALA  23          HB2       ALA  23   5.899  12.880 -12.896
  177   3HB   ALA  23          HB3       ALA  23   7.021  13.026 -11.543
  178    H    GLY  24           HN       GLY  24   8.614  10.401 -11.265
  179   1HA   GLY  24          HA2       GLY  24   9.378   9.459 -13.896
  180   2HA   GLY  24          HA1       GLY  24  10.375  10.767 -13.226
  181    H    ILE  25           HN       ILE  25   8.888   8.253 -11.395
  182    HA   ILE  25           HA       ILE  25  11.540   7.149 -10.849
  183    HB   ILE  25           HB       ILE  25   9.060   7.166  -9.038
  184   1HG1  ILE  25          HG12      ILE  25  10.632   8.301  -7.378
  185   2HG1  ILE  25          HG11      ILE  25  11.768   8.479  -8.698
  186   1HG2  ILE  25          HG21      ILE  25  11.702   5.829  -8.491
  187   2HG2  ILE  25          HG22      ILE  25  10.162   5.027  -8.806
  188   3HG2  ILE  25          HG23      ILE  25  10.372   5.990  -7.342
  189   1HD1  ILE  25          HD11      ILE  25   9.029   9.725  -8.514
  190   2HD1  ILE  25          HD12      ILE  25  10.138   9.889  -9.874
  191   3HD1  ILE  25          HD13      ILE  25  10.579  10.538  -8.295
  192    H    ASN  26           HN       ASN  26  11.611   4.768 -10.806
  193    HA   ASN  26           HA       ASN  26   9.998   3.791 -12.939
  194   1HB   ASN  26          HB2       ASN  26  12.119   2.432 -11.271
  195   2HB   ASN  26          HB1       ASN  26  11.239   1.620 -12.554
  196   1HD2  ASN  26          HD21      ASN  26  13.107   1.250 -13.769
  197   2HD2  ASN  26          HD22      ASN  26  13.917   2.535 -14.590
  198    H    LEU  27           HN       LEU  27   8.071   3.167 -12.741
  199    HA   LEU  27           HA       LEU  27   6.885   2.197 -10.260
  200   1HB   LEU  27          HB2       LEU  27   5.751   2.200 -13.071
  201   2HB   LEU  27          HB1       LEU  27   4.849   1.970 -11.587
  202    HG   LEU  27           HG       LEU  27   6.206   4.521 -12.462
  203   1HD1  LEU  27          HD11      LEU  27   3.932   5.385 -12.660
  204   2HD1  LEU  27          HD12      LEU  27   3.295   3.792 -12.255
  205   3HD1  LEU  27          HD13      LEU  27   4.207   4.025 -13.751
  206   1HD2  LEU  27          HD21      LEU  27   4.517   3.948 -10.031
  207   2HD2  LEU  27          HD22      LEU  27   5.107   5.533 -10.526
  208   3HD2  LEU  27          HD23      LEU  27   6.250   4.282 -10.039
  209    H    ASP  28           HN       ASP  28   8.672   0.925 -12.667
  210    HA   ASP  28           HA       ASP  28   7.706  -1.787 -12.676
  211   1HB   ASP  28          HB2       ASP  28   8.914  -1.076 -14.614
  212   2HB   ASP  28          HB1       ASP  28  10.255  -0.484 -13.647
  213    H    SER  29           HN       SER  29   9.682   0.130 -10.620
  214    HA   SER  29           HA       SER  29  11.265  -2.020  -9.686
  215   1HB   SER  29          HB2       SER  29  11.051   0.827  -8.717
  216   2HB   SER  29          HB1       SER  29  12.239  -0.363  -8.178
  217    HG   SER  29           HG       SER  29  12.403  -0.600 -10.647
  218    H    SER  30           HN       SER  30  10.415  -3.520  -8.622
  219    HA   SER  30           HA       SER  30   8.323  -3.427  -6.770
  220   1HB   SER  30          HB2       SER  30  10.592  -5.310  -7.296
  221   2HB   SER  30          HB1       SER  30   9.290  -5.719  -6.209
  222    HG   SER  30           HG       SER  30   7.883  -5.693  -7.936
  223    H    LEU  31           HN       LEU  31   8.640  -3.896  -4.399
  224    HA   LEU  31           HA       LEU  31  10.578  -2.297  -3.151
  225   1HB   LEU  31          HB2       LEU  31   8.654  -4.335  -2.131
  226   2HB   LEU  31          HB1       LEU  31   9.958  -3.838  -1.074
  227    HG   LEU  31           HG       LEU  31   9.179  -1.533  -1.129
  228   1HD1  LEU  31          HD11      LEU  31   7.096  -0.905  -2.215
  229   2HD1  LEU  31          HD12      LEU  31   6.980  -2.515  -2.928
  230   3HD1  LEU  31          HD13      LEU  31   8.303  -1.440  -3.386
  231   1HD2  LEU  31          HD21      LEU  31   6.956  -3.477  -0.569
  232   2HD2  LEU  31          HD22      LEU  31   7.052  -1.819   0.025
  233   3HD2  LEU  31          HD23      LEU  31   8.243  -3.015   0.544
  234    H    ALA  32           HN       ALA  32  10.764  -5.520  -4.246
  235    HA   ALA  32           HA       ALA  32  13.077  -6.317  -2.888
  236   1HB   ALA  32          HB1       ALA  32  12.191  -7.054  -5.682
  237   2HB   ALA  32          HB2       ALA  32  11.720  -7.881  -4.194
  238   3HB   ALA  32          HB3       ALA  32  13.399  -7.913  -4.726
  239    H    ASP  33           HN       ASP  33  12.534  -4.369  -5.769
  240    HA   ASP  33           HA       ASP  33  15.205  -4.273  -6.591
  241   1HB   ASP  33          HB2       ASP  33  13.380  -3.680  -8.130
  242   2HB   ASP  33          HB1       ASP  33  12.987  -2.279  -7.141
  243    H    LEU  34           HN       LEU  34  13.124  -2.227  -4.662
  244    HA   LEU  34           HA       LEU  34  15.007  -0.193  -4.096
  245   1HB   LEU  34          HB2       LEU  34  12.590  -1.030  -2.470
  246   2HB   LEU  34          HB1       LEU  34  13.534   0.399  -2.153
  247    HG   LEU  34           HG       LEU  34  12.153   1.578  -3.460
  248   1HD1  LEU  34          HD11      LEU  34  13.678   1.203  -5.282
  249   2HD1  LEU  34          HD12      LEU  34  12.003   1.296  -5.843
  250   3HD1  LEU  34          HD13      LEU  34  12.799  -0.274  -5.694
  251   1HD2  LEU  34          HD21      LEU  34  10.457  -0.041  -2.818
  252   2HD2  LEU  34          HD22      LEU  34  10.853  -1.003  -4.247
  253   3HD2  LEU  34          HD23      LEU  34  10.167   0.610  -4.431
  254    H    GLY  35           HN       GLY  35  14.205  -3.191  -2.494
  255   1HA   GLY  35          HA2       GLY  35  16.116  -4.423  -1.625
  256   2HA   GLY  35          HA1       GLY  35  16.738  -2.892  -1.032
  257    H    LEU  36           HN       LEU  36  13.375  -3.909  -0.730
  258    HA   LEU  36           HA       LEU  36  13.232  -3.405   1.979
  259   1HB   LEU  36          HB2       LEU  36  11.142  -3.501   1.321
  260   2HB   LEU  36          HB1       LEU  36  11.403  -4.584   0.005
  261    HG   LEU  36           HG       LEU  36  11.310  -6.470   1.745
  262   1HD1  LEU  36          HD11      LEU  36  10.194  -6.001   3.859
  263   2HD1  LEU  36          HD12      LEU  36  10.263  -4.273   3.513
  264   3HD1  LEU  36          HD13      LEU  36  11.754  -5.187   3.746
  265   1HD2  LEU  36          HD21      LEU  36   8.878  -4.746   1.378
  266   2HD2  LEU  36          HD22      LEU  36   8.872  -6.434   1.883
  267   3HD2  LEU  36          HD23      LEU  36   9.457  -5.994   0.277
  268    H    ASP  37           HN       ASP  37  14.019  -4.224   3.603
  269    HA   ASP  37           HA       ASP  37  14.296  -7.106   3.927
  270   1HB   ASP  37          HB2       ASP  37  16.476  -6.476   3.092
  271   2HB   ASP  37          HB1       ASP  37  16.582  -5.150   4.242
  272    H    SER  38           HN       SER  38  14.020  -3.891   5.296
  273    HA   SER  38           HA       SER  38  13.469  -5.163   7.851
  274   1HB   SER  38          HB2       SER  38  15.697  -4.210   8.019
  275   2HB   SER  38          HB1       SER  38  15.117  -2.657   7.434
  276    HG   SER  38           HG       SER  38  14.569  -3.945   9.899
  277    H    LEU  39           HN       LEU  39  13.350  -1.658   7.236
  278    HA   LEU  39           HA       LEU  39  10.829  -1.564   8.586
  279   1HB   LEU  39          HB2       LEU  39  12.752   0.062   8.856
  280   2HB   LEU  39          HB1       LEU  39  12.377   0.688   7.276
  281    HG   LEU  39           HG       LEU  39  11.632   2.116   9.189
  282   1HD1  LEU  39          HD11      LEU  39  10.572   2.430   7.051
  283   2HD1  LEU  39          HD12      LEU  39   9.409   2.648   8.358
  284   3HD1  LEU  39          HD13      LEU  39   9.410   1.158   7.415
  285   1HD2  LEU  39          HD21      LEU  39   9.628   1.469  10.448
  286   2HD2  LEU  39          HD22      LEU  39  10.990   0.389  10.754
  287   3HD2  LEU  39          HD23      LEU  39   9.679  -0.122   9.690
  288    H    MET  40           HN       MET  40  11.862  -1.570   5.324
  289    HA   MET  40           HA       MET  40   9.666  -0.321   4.028
  290   1HB   MET  40          HB2       MET  40  11.482  -2.488   2.977
  291   2HB   MET  40          HB1       MET  40  10.386  -1.521   2.011
  292   1HG   MET  40          HG2       MET  40  11.651   0.491   2.569
  293   2HG   MET  40          HG1       MET  40  12.739  -0.470   3.571
  294   1HE   MET  40          HE1       MET  40  15.103   0.329   0.588
  295   2HE   MET  40          HE2       MET  40  14.933   0.277   2.343
  296   3HE   MET  40          HE3       MET  40  13.955   1.400   1.394
  297    H    GLY  41           HN       GLY  41   9.692  -3.187   5.762
  298   1HA   GLY  41          HA2       GLY  41   7.169  -3.962   4.450
  299   2HA   GLY  41          HA1       GLY  41   8.278  -5.125   5.167
  300    H    VAL  42           HN       VAL  42   8.604  -2.849   7.332
  301    HA   VAL  42           HA       VAL  42   6.945  -4.253   9.166
  302    HB   VAL  42           HB       VAL  42   8.558  -1.727   9.667
  303   1HG1  VAL  42          HG11      VAL  42   7.330  -3.653  11.641
  304   2HG1  VAL  42          HG12      VAL  42   6.800  -2.002  11.337
  305   3HG1  VAL  42          HG13      VAL  42   8.388  -2.302  12.048
  306   1HG2  VAL  42          HG21      VAL  42   9.951  -3.599   8.993
  307   2HG2  VAL  42          HG22      VAL  42   9.209  -4.612  10.232
  308   3HG2  VAL  42          HG23      VAL  42  10.193  -3.222  10.698
  309    H    GLU  43           HN       GLU  43   6.973  -0.800   8.332
  310    HA   GLU  43           HA       GLU  43   4.598  -0.239   9.700
  311   1HB   GLU  43          HB2       GLU  43   6.169   1.523   9.099
  312   2HB   GLU  43          HB1       GLU  43   5.880   1.244   7.390
  313   1HG   GLU  43          HG2       GLU  43   3.692   2.111   7.521
  314   2HG   GLU  43          HG1       GLU  43   3.710   2.094   9.281
  315    H    VAL  44           HN       VAL  44   5.209  -1.372   6.537
  316    HA   VAL  44           HA       VAL  44   2.682  -1.064   5.284
  317    HB   VAL  44           HB       VAL  44   4.641  -3.314   4.908
  318   1HG1  VAL  44          HG11      VAL  44   3.784  -3.327   2.617
  319   2HG1  VAL  44          HG12      VAL  44   2.615  -2.072   3.087
  320   3HG1  VAL  44          HG13      VAL  44   2.557  -3.666   3.845
  321   1HG2  VAL  44          HG21      VAL  44   5.843  -1.228   4.789
  322   2HG2  VAL  44          HG22      VAL  44   4.674  -0.600   3.617
  323   3HG2  VAL  44          HG23      VAL  44   5.708  -1.976   3.201
  324    H    ARG  45           HN       ARG  45   4.145  -3.926   6.799
  325    HA   ARG  45           HA       ARG  45   1.894  -5.523   6.457
  326   1HB   ARG  45          HB2       ARG  45   4.272  -6.239   6.785
  327   2HB   ARG  45          HB1       ARG  45   4.079  -5.891   8.489
  328   1HG   ARG  45          HG2       ARG  45   2.551  -7.675   8.767
  329   2HG   ARG  45          HG1       ARG  45   2.374  -7.886   7.016
  330   1HD   ARG  45          HD2       ARG  45   4.873  -8.358   8.645
  331   2HD   ARG  45          HD1       ARG  45   3.874  -9.592   7.869
  332    HE   ARG  45           HE       ARG  45   4.444  -8.241   5.761
  333   1HH1  ARG  45          HH11      ARG  45   6.703  -9.159   8.344
  334   2HH1  ARG  45          HH12      ARG  45   8.100  -8.866   7.421
  335   1HH2  ARG  45          HH21      ARG  45   6.445  -7.809   4.499
  336   2HH2  ARG  45          HH22      ARG  45   7.958  -8.071   5.276
  337    H    GLN  46           HN       GLN  46   2.794  -3.379   9.067
  338    HA   GLN  46           HA       GLN  46   0.932  -4.202  11.025
  339   1HB   GLN  46          HB2       GLN  46   1.899  -1.410  10.394
  340   2HB   GLN  46          HB1       GLN  46   1.053  -1.877  11.857
  341   1HG   GLN  46          HG2       GLN  46   2.918  -3.272  12.519
  342   2HG   GLN  46          HG1       GLN  46   3.751  -2.902  11.008
  343   1HE2  GLN  46          HE21      GLN  46   1.891  -0.542  12.769
  344   2HE2  GLN  46          HE22      GLN  46   3.209   0.452  13.241
  345    H    ILE  47           HN       ILE  47   0.689  -1.907   8.346
  346    HA   ILE  47           HA       ILE  47  -1.901  -0.944   8.876
  347    HB   ILE  47           HB       ILE  47  -0.259  -1.005   6.327
  348   1HG1  ILE  47          HG12      ILE  47  -0.788   1.166   8.352
  349   2HG1  ILE  47          HG11      ILE  47   0.721   0.285   8.057
  350   1HG2  ILE  47          HG21      ILE  47  -1.770   0.683   5.402
  351   2HG2  ILE  47          HG22      ILE  47  -2.826   0.492   6.803
  352   3HG2  ILE  47          HG23      ILE  47  -2.586  -0.855   5.690
  353   1HD1  ILE  47          HD11      ILE  47   0.919   1.318   5.870
  354   2HD1  ILE  47          HD12      ILE  47   0.810   2.537   7.138
  355   3HD1  ILE  47          HD13      ILE  47  -0.595   2.187   6.131
  356    H    LEU  48           HN       LEU  48  -0.673  -3.498   6.891
  357    HA   LEU  48           HA       LEU  48  -3.296  -4.045   5.926
  358   1HB   LEU  48          HB2       LEU  48  -0.723  -5.544   5.546
  359   2HB   LEU  48          HB1       LEU  48  -2.249  -6.173   4.966
  360    HG   LEU  48           HG       LEU  48  -1.199  -5.179   3.129
  361   1HD1  LEU  48          HD11      LEU  48  -2.708  -3.382   2.475
  362   2HD1  LEU  48          HD12      LEU  48  -3.231  -3.230   4.148
  363   3HD1  LEU  48          HD13      LEU  48  -3.568  -4.716   3.253
  364   1HD2  LEU  48          HD21      LEU  48  -0.793  -2.699   4.773
  365   2HD2  LEU  48          HD22      LEU  48  -0.426  -2.867   3.055
  366   3HD2  LEU  48          HD23      LEU  48   0.455  -3.827   4.244
  367    H    GLU  49           HN       GLU  49  -1.218  -5.635   8.292
  368    HA   GLU  49           HA       GLU  49  -2.930  -7.812   8.817
  369   1HB   GLU  49          HB2       GLU  49  -0.584  -7.892   9.379
  370   2HB   GLU  49          HB1       GLU  49  -0.763  -6.544  10.489
  371   1HG   GLU  49          HG2       GLU  49  -2.350  -8.011  11.804
  372   2HG   GLU  49          HG1       GLU  49  -1.803  -9.342  10.789
  373    H    ARG  50           HN       ARG  50  -2.554  -4.685  10.472
  374    HA   ARG  50           HA       ARG  50  -4.400  -5.600  12.516
  375   1HB   ARG  50          HB2       ARG  50  -2.855  -3.042  12.296
  376   2HB   ARG  50          HB1       ARG  50  -3.751  -3.596  13.714
  377   1HG   ARG  50          HG2       ARG  50  -2.301  -5.499  13.933
  378   2HG   ARG  50          HG1       ARG  50  -1.452  -5.056  12.452
  379   1HD   ARG  50          HD2       ARG  50  -0.805  -2.937  13.539
  380   2HD   ARG  50          HD1       ARG  50  -1.533  -3.531  15.033
  381    HE   ARG  50           HE       ARG  50   0.119  -5.513  14.376
  382   1HH1  ARG  50          HH11      ARG  50   0.615  -2.018  14.642
  383   2HH1  ARG  50          HH12      ARG  50   2.234  -2.125  15.142
  384   1HH2  ARG  50          HH21      ARG  50   2.361  -5.693  14.962
  385   2HH2  ARG  50          HH22      ARG  50   3.313  -4.306  15.271
  386    H    GLU  51           HN       GLU  51  -4.373  -3.389   9.852
  387    HA   GLU  51           HA       GLU  51  -6.798  -2.116  10.827
  388   1HB   GLU  51          HB2       GLU  51  -5.390  -1.637   8.221
  389   2HB   GLU  51          HB1       GLU  51  -6.521  -0.574   9.040
  390   1HG   GLU  51          HG2       GLU  51  -3.765  -1.284  10.042
  391   2HG   GLU  51          HG1       GLU  51  -4.190   0.195   9.198
  392    H    HIS  52           HN       HIS  52  -5.749  -4.344   8.313
  393    HA   HIS  52           HA       HIS  52  -8.569  -4.574   7.509
  394   1HB   HIS  52          HB2       HIS  52  -6.137  -4.846   5.734
  395   2HB   HIS  52          HB1       HIS  52  -7.771  -5.302   5.268
  396    HD1  HIS  52           HD1      HIS  52  -5.524  -2.576   4.912
  397    HD2  HIS  52           HD2      HIS  52  -9.599  -2.944   5.623
  398    HE1  HIS  52           HE1      HIS  52  -6.524  -0.381   4.280
  399    HE2  HIS  52           HE2      HIS  52  -9.003  -0.654   4.645
  400    H    ASP  53           HN       ASP  53  -5.988  -6.247   8.844
  401    HA   ASP  53           HA       ASP  53  -5.682  -8.304   9.562
  402   1HB   ASP  53          HB2       ASP  53  -8.529  -8.728   8.680
  403   2HB   ASP  53          HB1       ASP  53  -7.556 -10.070   9.276
  404    H    LEU  54           HN       LEU  54  -4.943  -7.458   6.934
  405    HA   LEU  54           HA       LEU  54  -4.681 -10.066   5.586
  406   1HB   LEU  54          HB2       LEU  54  -4.295  -7.251   4.588
  407   2HB   LEU  54          HB1       LEU  54  -3.587  -8.605   3.753
  408    HG   LEU  54           HG       LEU  54  -5.881  -9.492   3.349
  409   1HD1  LEU  54          HD11      LEU  54  -7.052  -8.432   5.186
  410   2HD1  LEU  54          HD12      LEU  54  -7.780  -7.985   3.637
  411   3HD1  LEU  54          HD13      LEU  54  -6.721  -6.852   4.484
  412   1HD2  LEU  54          HD21      LEU  54  -5.318  -6.708   2.359
  413   2HD2  LEU  54          HD22      LEU  54  -6.431  -7.862   1.623
  414   3HD2  LEU  54          HD23      LEU  54  -4.704  -8.210   1.670
  415    H    VAL  55           HN       VAL  55  -2.938 -11.066   6.473
  416    HA   VAL  55           HA       VAL  55  -0.610  -9.454   7.087
  417    HB   VAL  55           HB       VAL  55  -0.852 -12.477   7.202
  418   1HG1  VAL  55          HG11      VAL  55   1.449 -11.705   7.074
  419   2HG1  VAL  55          HG12      VAL  55   1.107 -12.339   8.683
  420   3HG1  VAL  55          HG13      VAL  55   1.180 -10.599   8.420
  421   1HG2  VAL  55          HG21      VAL  55  -2.466 -11.432   8.702
  422   2HG2  VAL  55          HG22      VAL  55  -1.190 -10.442   9.402
  423   3HG2  VAL  55          HG23      VAL  55  -1.163 -12.194   9.615
  424    H    LEU  56           HN       LEU  56  -0.008  -8.647   5.171
  425    HA   LEU  56           HA       LEU  56   0.550 -10.426   2.987
  426   1HB   LEU  56          HB2       LEU  56   1.209  -7.503   3.258
  427   2HB   LEU  56          HB1       LEU  56   1.364  -8.445   1.797
  428    HG   LEU  56           HG       LEU  56  -1.213  -7.691   3.172
  429   1HD1  LEU  56          HD11      LEU  56  -0.193  -5.895   1.896
  430   2HD1  LEU  56          HD12      LEU  56  -1.654  -6.478   1.100
  431   3HD1  LEU  56          HD13      LEU  56  -0.070  -6.946   0.485
  432   1HD2  LEU  56          HD21      LEU  56  -2.346  -8.824   1.325
  433   2HD2  LEU  56          HD22      LEU  56  -1.378  -9.956   2.268
  434   3HD2  LEU  56          HD23      LEU  56  -0.792  -9.381   0.708
  435    HA   PRO  57           HA       PRO  57   4.576 -11.192   4.682
  436   1HB   PRO  57          HB2       PRO  57   4.719 -13.325   2.751
  437   2HB   PRO  57          HB1       PRO  57   4.455 -13.453   4.492
  438   1HG   PRO  57          HG2       PRO  57   2.551 -14.098   2.653
  439   2HG   PRO  57          HG1       PRO  57   2.160 -13.448   4.262
  440   1HD   PRO  57          HD2       PRO  57   2.374 -12.008   1.648
  441   2HD   PRO  57          HD1       PRO  57   1.082 -11.930   2.874
  442    H    ILE  58           HN       ILE  58   6.689 -12.031   3.421
  443    HA   ILE  58           HA       ILE  58   7.486  -9.852   1.797
  444    HB   ILE  58           HB       ILE  58   8.888 -12.469   2.464
  445   1HG1  ILE  58          HG12      ILE  58  10.503 -10.952   3.660
  446   2HG1  ILE  58          HG11      ILE  58   9.440  -9.609   3.290
  447   1HG2  ILE  58          HG21      ILE  58  10.945 -11.614   1.434
  448   2HG2  ILE  58          HG22      ILE  58  10.040 -10.243   0.794
  449   3HG2  ILE  58          HG23      ILE  58   9.660 -11.879   0.256
  450   1HD1  ILE  58          HD11      ILE  58   9.158 -10.371   5.568
  451   2HD1  ILE  58          HD12      ILE  58   8.762 -11.992   4.998
  452   3HD1  ILE  58          HD13      ILE  58   7.685 -10.642   4.638
  453    H    ARG  59           HN       ARG  59   6.453 -13.096   1.130
  454    HA   ARG  59           HA       ARG  59   7.051 -13.092  -1.612
  455   1HB   ARG  59          HB2       ARG  59   5.348 -14.963  -1.848
  456   2HB   ARG  59          HB1       ARG  59   6.698 -15.244  -0.774
  457   1HG   ARG  59          HG2       ARG  59   4.200 -14.215   0.442
  458   2HG   ARG  59          HG1       ARG  59   4.192 -15.875  -0.162
  459   1HD   ARG  59          HD2       ARG  59   6.164 -14.712   1.808
  460   2HD   ARG  59          HD1       ARG  59   4.827 -15.790   2.206
  461    HE   ARG  59           HE       ARG  59   6.651 -16.827   0.225
  462   1HH1  ARG  59          HH11      ARG  59   5.983 -16.710   3.736
  463   2HH1  ARG  59          HH12      ARG  59   6.834 -18.148   4.036
  464   1HH2  ARG  59          HH21      ARG  59   7.759 -18.734   0.674
  465   2HH2  ARG  59          HH22      ARG  59   7.873 -19.358   2.263
  466    H    GLU  60           HN       GLU  60   4.872 -11.151  -0.147
  467    HA   GLU  60           HA       GLU  60   3.610 -10.735  -2.749
  468   1HB   GLU  60          HB2       GLU  60   2.364 -10.237  -0.031
  469   2HB   GLU  60          HB1       GLU  60   1.648  -9.725  -1.553
  470   1HG   GLU  60          HG2       GLU  60   1.637 -12.118  -2.265
  471   2HG   GLU  60          HG1       GLU  60   2.159 -12.545  -0.641
  472    H    VAL  61           HN       VAL  61   4.436  -9.024   0.260
  473    HA   VAL  61           HA       VAL  61   4.202  -6.419  -0.693
  474    HB   VAL  61           HB       VAL  61   5.966  -7.459   1.544
  475   1HG1  VAL  61          HG11      VAL  61   4.998  -4.640   1.008
  476   2HG1  VAL  61          HG12      VAL  61   6.660  -5.207   0.867
  477   3HG1  VAL  61          HG13      VAL  61   5.872  -5.169   2.447
  478   1HG2  VAL  61          HG21      VAL  61   3.187  -6.302   1.579
  479   2HG2  VAL  61          HG22      VAL  61   4.129  -6.762   2.998
  480   3HG2  VAL  61          HG23      VAL  61   3.620  -7.991   1.840
  481    H    ARG  62           HN       ARG  62   7.034  -8.539  -0.782
  482    HA   ARG  62           HA       ARG  62   8.934  -6.511  -1.372
  483   1HB   ARG  62          HB2       ARG  62   9.377  -8.810  -0.415
  484   2HB   ARG  62          HB1       ARG  62   9.142  -9.447  -2.032
  485   1HG   ARG  62          HG2       ARG  62  11.007  -7.940  -2.776
  486   2HG   ARG  62          HG1       ARG  62  11.306  -7.605  -1.071
  487   1HD   ARG  62          HD2       ARG  62  12.796  -9.354  -1.792
  488   2HD   ARG  62          HD1       ARG  62  11.599 -10.050  -0.698
  489    HE   ARG  62           HE       ARG  62  10.570 -10.369  -3.239
  490   1HH1  ARG  62          HH11      ARG  62  13.384 -11.613  -1.433
  491   2HH1  ARG  62          HH12      ARG  62  13.536 -12.978  -2.428
  492   1HH2  ARG  62          HH21      ARG  62  10.864 -12.241  -4.606
  493   2HH2  ARG  62          HH22      ARG  62  12.175 -13.281  -4.299
  494    H    GLN  63           HN       GLN  63   6.616  -8.111  -3.312
  495    HA   GLN  63           HA       GLN  63   8.137  -7.622  -5.747
  496   1HB   GLN  63          HB2       GLN  63   5.677  -9.304  -5.261
  497   2HB   GLN  63          HB1       GLN  63   6.279  -8.948  -6.873
  498   1HG   GLN  63          HG2       GLN  63   7.060 -11.114  -6.234
  499   2HG   GLN  63          HG1       GLN  63   8.432 -10.017  -6.255
  500   1HE2  GLN  63          HE21      GLN  63   6.038 -10.260  -3.721
  501   2HE2  GLN  63          HE22      GLN  63   7.122 -10.848  -2.503
  502    H    LEU  64           HN       LEU  64   5.804  -6.166  -3.897
  503    HA   LEU  64           HA       LEU  64   4.167  -5.054  -5.896
  504   1HB   LEU  64          HB2       LEU  64   4.795  -4.019  -3.133
  505   2HB   LEU  64          HB1       LEU  64   3.500  -3.430  -4.154
  506    HG   LEU  64           HG       LEU  64   3.715  -6.204  -2.992
  507   1HD1  LEU  64          HD11      LEU  64   3.145  -4.546  -1.326
  508   2HD1  LEU  64          HD12      LEU  64   1.751  -5.564  -1.690
  509   3HD1  LEU  64          HD13      LEU  64   1.851  -3.933  -2.354
  510   1HD2  LEU  64          HD21      LEU  64   1.538  -4.968  -4.677
  511   2HD2  LEU  64          HD22      LEU  64   1.467  -6.551  -3.903
  512   3HD2  LEU  64          HD23      LEU  64   2.644  -6.247  -5.182
  513    H    THR  65           HN       THR  65   4.344  -3.244  -7.105
  514    HA   THR  65           HA       THR  65   7.009  -2.311  -7.557
  515    HB   THR  65           HB       THR  65   5.788  -1.414  -9.591
  516    HG1  THR  65           HG1      THR  65   3.670  -1.936  -9.760
  517   1HG2  THR  65          HG21      THR  65   7.060  -3.525  -9.487
  518   2HG2  THR  65          HG22      THR  65   5.626  -3.661 -10.539
  519   3HG2  THR  65          HG23      THR  65   5.598  -4.316  -8.890
  520    H    LEU  66           HN       LEU  66   6.252  -1.201  -5.283
  521    HA   LEU  66           HA       LEU  66   6.085   0.711  -4.075
  522   1HB   LEU  66          HB2       LEU  66   7.896   1.309  -5.779
  523   2HB   LEU  66          HB1       LEU  66   6.665   2.192  -6.649
  524    HG   LEU  66           HG       LEU  66   8.126   3.648  -5.288
  525   1HD1  LEU  66          HD11      LEU  66   6.389   4.933  -4.154
  526   2HD1  LEU  66          HD12      LEU  66   5.301   3.549  -4.326
  527   3HD1  LEU  66          HD13      LEU  66   5.877   4.399  -5.761
  528   1HD2  LEU  66          HD21      LEU  66   7.956   3.621  -2.856
  529   2HD2  LEU  66          HD22      LEU  66   8.608   2.102  -3.471
  530   3HD2  LEU  66          HD23      LEU  66   6.928   2.194  -2.942
  531    H    ARG  67           HN       ARG  67   4.576   1.671  -7.138
  532    HA   ARG  67           HA       ARG  67   2.586   3.147  -5.704
  533   1HB   ARG  67          HB2       ARG  67   3.166   2.708  -8.572
  534   2HB   ARG  67          HB1       ARG  67   1.533   3.195  -8.135
  535   1HG   ARG  67          HG2       ARG  67   4.051   4.679  -7.399
  536   2HG   ARG  67          HG1       ARG  67   2.940   5.111  -8.706
  537   1HD   ARG  67          HD2       ARG  67   1.114   5.218  -6.976
  538   2HD   ARG  67          HD1       ARG  67   2.351   5.004  -5.763
  539    HE   ARG  67           HE       ARG  67   3.314   7.109  -6.401
  540   1HH1  ARG  67          HH11      ARG  67   0.040   6.556  -7.723
  541   2HH1  ARG  67          HH12      ARG  67  -0.356   8.209  -7.765
  542   1HH2  ARG  67          HH21      ARG  67   2.685   9.415  -6.414
  543   2HH2  ARG  67          HH22      ARG  67   1.145   9.838  -6.968
  544    H    LYS  68           HN       LYS  68   2.792  -0.004  -7.003
  545    HA   LYS  68           HA       LYS  68   0.028  -0.603  -7.055
  546   1HB   LYS  68          HB2       LYS  68   1.826  -1.919  -8.160
  547   2HB   LYS  68          HB1       LYS  68   2.306  -2.521  -6.583
  548   1HG   LYS  68          HG2       LYS  68   0.140  -3.606  -6.313
  549   2HG   LYS  68          HG1       LYS  68  -0.373  -2.989  -7.886
  550   1HD   LYS  68          HD2       LYS  68   1.980  -4.795  -7.411
  551   2HD   LYS  68          HD1       LYS  68   0.394  -5.355  -7.948
  552   1HE   LYS  68          HE2       LYS  68   0.622  -3.971  -9.988
  553   2HE   LYS  68          HE1       LYS  68   2.212  -3.438  -9.448
  554   1HZ   LYS  68          HZ1       LYS  68   1.428  -6.212 -10.133
  555   2HZ   LYS  68          HZ2       LYS  68   2.907  -5.770  -9.473
  556   3HZ   LYS  68          HZ3       LYS  68   2.494  -5.216 -11.005
  557    H    LEU  69           HN       LEU  69   2.219  -0.201  -4.522
  558    HA   LEU  69           HA       LEU  69   1.171  -1.689  -2.399
  559   1HB   LEU  69          HB2       LEU  69   2.484   0.981  -2.482
  560   2HB   LEU  69          HB1       LEU  69   1.655   0.531  -1.012
  561    HG   LEU  69           HG       LEU  69   4.041   0.111  -0.870
  562   1HD1  LEU  69          HD11      LEU  69   2.421  -2.416  -0.941
  563   2HD1  LEU  69          HD12      LEU  69   2.550  -1.293   0.411
  564   3HD1  LEU  69          HD13      LEU  69   3.965  -2.206  -0.116
  565   1HD2  LEU  69          HD21      LEU  69   4.522  -0.318  -3.209
  566   2HD2  LEU  69          HD22      LEU  69   3.603  -1.821  -3.134
  567   3HD2  LEU  69          HD23      LEU  69   5.092  -1.649  -2.202
  568    H    GLN  70           HN       GLN  70  -0.006   1.428  -3.595
  569    HA   GLN  70           HA       GLN  70  -2.086   1.407  -1.626
  570   1HB   GLN  70          HB2       GLN  70  -2.822   3.551  -2.543
  571   2HB   GLN  70          HB1       GLN  70  -1.119   3.552  -2.138
  572   1HG   GLN  70          HG2       GLN  70  -0.475   3.491  -4.364
  573   2HG   GLN  70          HG1       GLN  70  -2.134   3.166  -4.957
  574   1HE2  GLN  70          HE21      GLN  70  -0.455   5.210  -5.828
  575   2HE2  GLN  70          HE22      GLN  70  -1.156   6.720  -5.363
  576    H    GLU  71           HN       GLU  71  -1.776  -0.250  -4.333
  577    HA   GLU  71           HA       GLU  71  -4.611  -0.123  -5.076
  578   1HB   GLU  71          HB2       GLU  71  -2.806  -0.266  -6.847
  579   2HB   GLU  71          HB1       GLU  71  -2.399  -1.856  -6.224
  580   1HG   GLU  71          HG2       GLU  71  -3.766  -2.080  -8.186
  581   2HG   GLU  71          HG1       GLU  71  -4.677  -2.621  -6.775
  582    H    MET  72           HN       MET  72  -2.215  -1.943  -3.399
  583    HA   MET  72           HA       MET  72  -4.074  -4.125  -2.777
  584   1HB   MET  72          HB2       MET  72  -1.082  -3.836  -2.390
  585   2HB   MET  72          HB1       MET  72  -2.019  -5.198  -1.800
  586   1HG   MET  72          HG2       MET  72  -1.694  -4.411  -4.690
  587   2HG   MET  72          HG1       MET  72  -0.831  -5.706  -3.866
  588   1HE   MET  72          HE1       MET  72  -1.569  -7.441  -5.717
  589   2HE   MET  72          HE2       MET  72  -2.432  -6.164  -6.578
  590   3HE   MET  72          HE3       MET  72  -3.241  -7.689  -6.219
  591    H    SER  73           HN       SER  73  -4.011  -1.287  -1.773
  592    HA   SER  73           HA       SER  73  -3.015  -1.435   0.856
  593   1HB   SER  73          HB2       SER  73  -3.808   0.886   1.024
  594   2HB   SER  73          HB1       SER  73  -3.004   0.589  -0.493
  595    HG   SER  73           HG       SER  73  -4.947   1.692  -0.878
  596    H    SER  74           HN       SER  74  -6.067  -1.761  -0.794
  597    HA   SER  74           HA       SER  74  -8.080  -2.536  -0.282
  598   1HB   SER  74          HB2       SER  74  -6.723  -3.510   2.238
  599   2HB   SER  74          HB1       SER  74  -8.351  -3.972   1.735
  600    HG   SER  74           HG       SER  74  -6.658  -4.247  -0.300
  601    H    LYS  75           HN       LYS  75  -7.056   0.127   0.648
  602    HA   LYS  75           HA       LYS  75  -9.004   0.619   2.779
  603   1HB   LYS  75          HB2       LYS  75  -7.870   2.793   3.135
  604   2HB   LYS  75          HB1       LYS  75  -6.774   1.433   3.306
  605   1HG   LYS  75          HG2       LYS  75  -6.016   1.877   0.954
  606   2HG   LYS  75          HG1       LYS  75  -6.974   3.352   1.004
  607   1HD   LYS  75          HD2       LYS  75  -4.844   2.754   3.053
  608   2HD   LYS  75          HD1       LYS  75  -4.459   3.519   1.523
  609   1HE   LYS  75          HE2       LYS  75  -4.659   5.184   3.277
  610   2HE   LYS  75          HE1       LYS  75  -5.946   5.399   2.106
  611   1HZ   LYS  75          HZ1       LYS  75  -7.529   4.585   3.640
  612   2HZ   LYS  75          HZ2       LYS  75  -6.519   5.604   4.541
  613   3HZ   LYS  75          HZ3       LYS  75  -6.347   3.942   4.670
  614    H    ALA  76           HN       ALA  76  -9.048   0.476  -0.360
  615    HA   ALA  76           HA       ALA  76 -10.250   2.951  -1.087
  616   1HB   ALA  76          HB1       ALA  76  -9.033   1.585  -2.720
  617   2HB   ALA  76          HB2       ALA  76 -10.702   1.861  -3.224
  618   3HB   ALA  76          HB3       ALA  76 -10.233   0.306  -2.538
  619    H    GLY  77           HN       GLY  77 -12.083   3.430  -0.047
  620   1HA   GLY  77          HA2       GLY  77 -14.191   1.404   0.122
  621   2HA   GLY  77          HA1       GLY  77 -14.161   2.949   0.969
  622    H    SER  78           HN       SER  78 -13.142   3.503  -2.081
  623    HA   SER  78           HA       SER  78 -15.786   3.718  -3.257
  624   1HB   SER  78          HB2       SER  78 -13.854   6.043  -3.056
  625   2HB   SER  78          HB1       SER  78 -15.379   6.045  -3.944
  626    HG   SER  78           HG       SER  78 -15.932   5.191  -1.565
  627    H    ASP  79           HN       ASP  79 -15.259   2.165  -4.757
  628    HA   ASP  79           HA       ASP  79 -13.053   2.789  -6.600
  629   1HB   ASP  79          HB2       ASP  79 -13.448   0.392  -5.847
  630   2HB   ASP  79          HB1       ASP  79 -14.974   0.436  -6.723
  631    H    THR  80           HN       THR  80 -16.413   2.999  -6.151
  632    HA   THR  80           HA       THR  80 -18.163   3.691  -7.286
  633    HB   THR  80           HB       THR  80 -16.178   5.281  -8.949
  634    HG1  THR  80           HG1      THR  80 -15.754   6.085  -7.037
  635   1HG2  THR  80          HG21      THR  80 -18.495   5.289  -9.823
  636   2HG2  THR  80          HG22      THR  80 -18.054   6.871  -9.174
  637   3HG2  THR  80          HG23      THR  80 -19.087   5.791  -8.239
  638    H    GLU  81           HN       GLU  81 -18.580   1.632  -8.020
  639    HA   GLU  81           HA       GLU  81 -17.566   0.779 -10.551
  640   1HB   GLU  81          HB2       GLU  81 -19.716  -0.450  -8.845
  641   2HB   GLU  81          HB1       GLU  81 -18.963  -1.197 -10.247
  642   1HG   GLU  81          HG2       GLU  81 -16.789  -1.088  -9.100
  643   2HG   GLU  81          HG1       GLU  81 -17.606  -0.437  -7.681
  644    H    LEU  82           HN       LEU  82 -20.162   2.691  -9.586
  645    HA   LEU  82           HA       LEU  82 -21.748   2.223 -11.915
  646   1HB   LEU  82          HB2       LEU  82 -21.748   4.527  -9.963
  647   2HB   LEU  82          HB1       LEU  82 -22.873   4.383 -11.298
  648    HG   LEU  82           HG       LEU  82 -22.654   2.416  -9.019
  649   1HD1  LEU  82          HD11      LEU  82 -24.688   4.564  -9.573
  650   2HD1  LEU  82          HD12      LEU  82 -23.493   4.572  -8.274
  651   3HD1  LEU  82          HD13      LEU  82 -24.776   3.361  -8.286
  652   1HD2  LEU  82          HD21      LEU  82 -24.663   2.670 -11.260
  653   2HD2  LEU  82          HD22      LEU  82 -24.747   1.524  -9.921
  654   3HD2  LEU  82          HD23      LEU  82 -23.441   1.409 -11.102
  655    H    ALA  83           HN       ALA  83 -20.166   2.238 -13.431
  656    HA   ALA  83           HA       ALA  83 -19.811   4.678 -14.833
  657   1HB   ALA  83          HB1       ALA  83 -17.904   4.855 -13.286
  658   2HB   ALA  83          HB2       ALA  83 -17.338   4.503 -14.920
  659   3HB   ALA  83          HB3       ALA  83 -17.396   3.220 -13.712
  660    H    ALA  84           HN       ALA  84 -18.971   4.117 -16.980
  661    HA   ALA  84           HA       ALA  84 -18.540   1.403 -17.708
  662   1HB   ALA  84          HB1       ALA  84 -20.981   1.300 -17.402
  663   2HB   ALA  84          HB2       ALA  84 -20.552   1.138 -19.105
  664   3HB   ALA  84          HB3       ALA  84 -21.180   2.668 -18.496
  665    HA   PRO  85           HA       PRO  85 -16.529   3.885 -20.832
  666   1HB   PRO  85          HB2       PRO  85 -16.399   1.272 -22.247
  667   2HB   PRO  85          HB1       PRO  85 -15.091   2.389 -21.840
  668   1HG   PRO  85          HG2       PRO  85 -15.387   0.110 -20.503
  669   2HG   PRO  85          HG1       PRO  85 -14.914   1.603 -19.666
  670   1HD   PRO  85          HD2       PRO  85 -17.585   0.258 -19.781
  671   2HD   PRO  85          HD1       PRO  85 -16.772   1.036 -18.406
  672    H    LYS  86           HN       LYS  86 -18.003   5.089 -21.851
  673    HA   LYS  86           HA       LYS  86 -19.876   3.719 -23.593
  674   1HB   LYS  86          HB2       LYS  86 -20.173   6.348 -22.144
  675   2HB   LYS  86          HB1       LYS  86 -21.269   5.801 -23.404
  676   1HG   LYS  86          HG2       LYS  86 -21.821   3.826 -22.032
  677   2HG   LYS  86          HG1       LYS  86 -20.764   4.445 -20.759
  678   1HD   LYS  86          HD2       LYS  86 -22.147   6.442 -20.562
  679   2HD   LYS  86          HD1       LYS  86 -23.172   5.874 -21.880
  680   1HE   LYS  86          HE2       LYS  86 -23.780   3.906 -20.524
  681   2HE   LYS  86          HE1       LYS  86 -22.794   4.532 -19.203
  682   1HZ   LYS  86          HZ1       LYS  86 -25.160   5.899 -20.378
  683   2HZ   LYS  86          HZ2       LYS  86 -24.247   6.459 -19.068
  684   3HZ   LYS  86          HZ3       LYS  86 -25.150   5.046 -18.922
  685    H    SER  87           HN       SER  87 -18.128   3.621 -25.022
  686    HA   SER  87           HA       SER  87 -17.287   6.044 -26.358
  687   1HB   SER  87          HB2       SER  87 -16.782   3.153 -27.085
  688   2HB   SER  87          HB1       SER  87 -15.836   4.560 -27.572
  689    HG   SER  87           HG       SER  87 -15.360   3.038 -25.556
  690    H    LYS  88           HN       LYS  88 -19.273   3.205 -26.804
  691    HA   LYS  88           HA       LYS  88 -20.455   4.357 -29.232
  692   1HB   LYS  88          HB2       LYS  88 -19.236   2.487 -29.986
  693   2HB   LYS  88          HB1       LYS  88 -19.668   1.525 -28.586
  694   1HG   LYS  88          HG2       LYS  88 -20.760   0.738 -30.626
  695   2HG   LYS  88          HG1       LYS  88 -21.932   1.276 -29.426
  696   1HD   LYS  88          HD2       LYS  88 -22.083   3.442 -30.658
  697   2HD   LYS  88          HD1       LYS  88 -21.029   2.748 -31.897
  698   1HE   LYS  88          HE2       LYS  88 -23.376   2.566 -32.545
  699   2HE   LYS  88          HE1       LYS  88 -22.657   0.977 -32.298
  700   1HZ   LYS  88          HZ1       LYS  88 -24.870   1.125 -31.327
  701   2HZ   LYS  88          HZ2       LYS  88 -24.424   2.403 -30.358
  702   3HZ   LYS  88          HZ3       LYS  88 -23.729   0.863 -30.122
  703    H    ASN  89           HN       ASN  89 -20.967   2.564 -26.252
  704    HA   ASN  89           HA       ASN  89 -22.751   2.095 -24.999
  705   1HB   ASN  89          HB2       ASN  89 -24.397   3.933 -26.815
  706   2HB   ASN  89          HB1       ASN  89 -25.013   3.159 -25.372
  707   1HD2  ASN  89          HD21      ASN  89 -21.923   4.810 -25.810
  708   2HD2  ASN  89          HD22      ASN  89 -22.269   6.088 -24.678
  Start of MODEL   29
    1   1H    GLY   1          HT1       GLY   1 -17.407   4.765  10.285
    2   2H    GLY   1          HT2       GLY   1 -17.201   4.943  11.961
    3   3H    GLY   1          HT3       GLY   1 -16.896   3.433  11.213
    4   1HA   GLY   1          HA1       GLY   1 -15.051   4.292  10.072
    5   2HA   GLY   1          HA2       GLY   1 -15.391   5.900  10.711
    6    H    ASP   2           HN       ASP   2 -13.695   3.063  11.166
    7    HA   ASP   2           HA       ASP   2 -13.213   3.728  13.981
    8   1HB   ASP   2          HB2       ASP   2 -12.493   1.217  12.420
    9   2HB   ASP   2          HB1       ASP   2 -11.976   1.530  14.072
   10    H    GLY   3           HN       GLY   3 -12.045   5.519  13.596
   11   1HA   GLY   3          HA2       GLY   3  -9.822   6.344  13.609
   12   2HA   GLY   3          HA1       GLY   3  -9.374   5.057  12.482
   13    H    GLU   4           HN       GLU   4 -10.204   5.115  10.371
   14    HA   GLU   4           HA       GLU   4 -11.732   7.290   9.385
   15   1HB   GLU   4          HB2       GLU   4  -9.555   8.445   9.581
   16   2HB   GLU   4          HB1       GLU   4  -8.770   7.204   8.631
   17   1HG   GLU   4          HG2       GLU   4 -10.155   7.867   6.697
   18   2HG   GLU   4          HG1       GLU   4 -10.877   9.139   7.680
   19    H    ALA   5           HN       ALA   5  -9.116   5.412   7.896
   20    HA   ALA   5           HA       ALA   5 -10.423   3.284   6.811
   21   1HB   ALA   5          HB1       ALA   5 -11.738   4.883   5.449
   22   2HB   ALA   5          HB2       ALA   5 -10.565   4.056   4.424
   23   3HB   ALA   5          HB3       ALA   5 -10.253   5.706   4.963
   24    H    GLN   6           HN       GLN   6  -8.840   2.722   4.736
   25    HA   GLN   6           HA       GLN   6  -6.239   3.451   5.806
   26   1HB   GLN   6          HB2       GLN   6  -6.801   1.005   5.410
   27   2HB   GLN   6          HB1       GLN   6  -6.776   1.358   3.685
   28   1HG   GLN   6          HG2       GLN   6  -4.466   1.963   3.773
   29   2HG   GLN   6          HG1       GLN   6  -4.452   1.845   5.530
   30   1HE2  GLN   6          HE21      GLN   6  -4.504  -0.198   6.478
   31   2HE2  GLN   6          HE22      GLN   6  -4.071  -1.612   5.567
   32    H    ARG   7           HN       ARG   7  -4.961   4.770   4.834
   33    HA   ARG   7           HA       ARG   7  -5.968   6.266   2.581
   34   1HB   ARG   7          HB2       ARG   7  -4.278   7.858   3.034
   35   2HB   ARG   7          HB1       ARG   7  -4.829   7.298   4.601
   36   1HG   ARG   7          HG2       ARG   7  -2.308   6.434   3.195
   37   2HG   ARG   7          HG1       ARG   7  -2.371   7.643   4.484
   38   1HD   ARG   7          HD2       ARG   7  -2.839   4.677   4.593
   39   2HD   ARG   7          HD1       ARG   7  -1.655   5.631   5.487
   40    HE   ARG   7           HE       ARG   7  -4.253   6.492   6.127
   41   1HH1  ARG   7          HH11      ARG   7  -1.963   3.900   6.864
   42   2HH1  ARG   7          HH12      ARG   7  -2.820   3.372   8.234
   43   1HH2  ARG   7          HH21      ARG   7  -5.407   5.779   7.888
   44   2HH2  ARG   7          HH22      ARG   7  -4.868   4.493   8.882
   45    H    ASP   8           HN       ASP   8  -4.032   7.049   1.059
   46    HA   ASP   8           HA       ASP   8  -3.290   4.915  -0.635
   47   1HB   ASP   8          HB2       ASP   8  -2.059   7.666  -0.302
   48   2HB   ASP   8          HB1       ASP   8  -1.626   6.542  -1.570
   49    H    LEU   9           HN       LEU   9  -1.870   3.353  -0.064
   50    HA   LEU   9           HA       LEU   9  -0.140   3.591   2.127
   51   1HB   LEU   9          HB2       LEU   9  -0.051   1.621  -0.149
   52   2HB   LEU   9          HB1       LEU   9   0.870   1.483   1.333
   53    HG   LEU   9           HG       LEU   9  -2.129   1.364   1.081
   54   1HD1  LEU   9          HD11      LEU   9  -1.846  -0.938   1.832
   55   2HD1  LEU   9          HD12      LEU   9  -0.095  -0.729   1.825
   56   3HD1  LEU   9          HD13      LEU   9  -1.001  -0.644   0.314
   57   1HD2  LEU   9          HD21      LEU   9  -1.465   2.490   3.128
   58   2HD2  LEU   9          HD22      LEU   9  -0.377   1.158   3.523
   59   3HD2  LEU   9          HD23      LEU   9  -2.126   0.889   3.475
   60    H    VAL  10           HN       VAL  10   0.198   4.591  -1.076
   61    HA   VAL  10           HA       VAL  10   3.009   4.703  -1.228
   62    HB   VAL  10           HB       VAL  10   0.862   6.249  -2.713
   63   1HG1  VAL  10          HG11      VAL  10   2.590   6.912  -4.325
   64   2HG1  VAL  10          HG12      VAL  10   3.831   6.182  -3.306
   65   3HG1  VAL  10          HG13      VAL  10   2.929   7.587  -2.731
   66   1HG2  VAL  10          HG21      VAL  10   0.921   3.871  -3.118
   67   2HG2  VAL  10          HG22      VAL  10   2.643   3.964  -3.495
   68   3HG2  VAL  10          HG23      VAL  10   1.466   4.763  -4.537
   69    H    LYS  11           HN       LYS  11   0.605   6.836   0.212
   70    HA   LYS  11           HA       LYS  11   2.320   9.086   0.493
   71   1HB   LYS  11          HB2       LYS  11  -0.165   8.345   2.066
   72   2HB   LYS  11          HB1       LYS  11   0.712   9.873   2.146
   73   1HG   LYS  11          HG2       LYS  11  -0.599   8.816  -0.352
   74   2HG   LYS  11          HG1       LYS  11  -1.344   9.972   0.754
   75   1HD   LYS  11          HD2       LYS  11   0.481  11.542   0.357
   76   2HD   LYS  11          HD1       LYS  11   1.263  10.377  -0.711
   77   1HE   LYS  11          HE2       LYS  11   0.111  12.039  -2.024
   78   2HE   LYS  11          HE1       LYS  11  -0.666  10.480  -2.218
   79   1HZ   LYS  11          HZ1       LYS  11  -2.473  11.199  -0.760
   80   2HZ   LYS  11          HZ2       LYS  11  -2.253  12.303  -1.972
   81   3HZ   LYS  11          HZ3       LYS  11  -1.691  12.664  -0.431
   82    H    ALA  12           HN       ALA  12   2.168   6.119   2.042
   83    HA   ALA  12           HA       ALA  12   3.668   7.118   4.354
   84   1HB   ALA  12          HB1       ALA  12   2.329   4.438   3.956
   85   2HB   ALA  12          HB2       ALA  12   1.675   5.789   4.879
   86   3HB   ALA  12          HB3       ALA  12   3.149   4.982   5.425
   87    H    VAL  13           HN       VAL  13   3.631   4.326   2.139
   88    HA   VAL  13           HA       VAL  13   6.192   3.394   2.797
   89    HB   VAL  13           HB       VAL  13   4.476   2.826   0.365
   90   1HG1  VAL  13          HG11      VAL  13   6.924   1.345   1.344
   91   2HG1  VAL  13          HG12      VAL  13   6.795   2.298  -0.137
   92   3HG1  VAL  13          HG13      VAL  13   5.849   0.819   0.043
   93   1HG2  VAL  13          HG21      VAL  13   3.933   0.746   1.555
   94   2HG2  VAL  13          HG22      VAL  13   3.448   2.177   2.471
   95   3HG2  VAL  13          HG23      VAL  13   4.899   1.288   2.929
   96    H    ALA  14           HN       ALA  14   5.108   5.423   0.065
   97    HA   ALA  14           HA       ALA  14   7.724   5.441  -1.067
   98   1HB   ALA  14          HB1       ALA  14   6.868   7.141  -2.625
   99   2HB   ALA  14          HB2       ALA  14   5.418   7.324  -1.625
  100   3HB   ALA  14          HB3       ALA  14   5.713   5.811  -2.469
  101    H    HIS  15           HN       HIS  15   6.050   7.260   1.308
  102    HA   HIS  15           HA       HIS  15   7.757   9.538   1.274
  103   1HB   HIS  15          HB2       HIS  15   5.439   9.540   2.236
  104   2HB   HIS  15          HB1       HIS  15   6.033   8.554   3.566
  105    HD1  HIS  15           HD1      HIS  15   6.848   9.807   5.553
  106    HD2  HIS  15           HD2      HIS  15   6.731  12.181   2.153
  107    HE1  HIS  15           HE1      HIS  15   7.435  12.126   6.326
  108    HE2  HIS  15           HE2      HIS  15   7.045  13.567   4.295
  109    H    ILE  16           HN       ILE  16   7.980   6.388   2.651
  110    HA   ILE  16           HA       ILE  16  10.024   6.881   4.550
  111    HB   ILE  16           HB       ILE  16   9.358   4.355   2.989
  112   1HG1  ILE  16          HG12      ILE  16   7.503   5.080   4.396
  113   2HG1  ILE  16          HG11      ILE  16   8.214   3.605   5.039
  114   1HG2  ILE  16          HG21      ILE  16  11.629   4.172   3.792
  115   2HG2  ILE  16          HG22      ILE  16  10.575   3.093   4.712
  116   3HG2  ILE  16          HG23      ILE  16  11.116   4.608   5.424
  117   1HD1  ILE  16          HD11      ILE  16   8.662   6.397   6.087
  118   2HD1  ILE  16          HD12      ILE  16   9.388   4.927   6.735
  119   3HD1  ILE  16          HD13      ILE  16   7.641   5.155   6.818
  120    H    LEU  17           HN       LEU  17   9.989   6.077   1.156
  121    HA   LEU  17           HA       LEU  17  12.847   5.915   0.823
  122   1HB   LEU  17          HB2       LEU  17  10.628   6.169  -1.202
  123   2HB   LEU  17          HB1       LEU  17  12.295   5.785  -1.568
  124    HG   LEU  17           HG       LEU  17  10.509   4.039   0.129
  125   1HD1  LEU  17          HD11      LEU  17   9.657   4.198  -2.142
  126   2HD1  LEU  17          HD12      LEU  17  10.365   2.614  -1.838
  127   3HD1  LEU  17          HD13      LEU  17  11.256   3.813  -2.777
  128   1HD2  LEU  17          HD21      LEU  17  13.171   3.543  -1.191
  129   2HD2  LEU  17          HD22      LEU  17  12.232   2.366  -0.272
  130   3HD2  LEU  17          HD23      LEU  17  12.906   3.785   0.535
  131    H    GLY  18           HN       GLY  18  10.352   8.306   0.333
  132   1HA   GLY  18          HA2       GLY  18  10.964  10.660   0.589
  133   2HA   GLY  18          HA1       GLY  18  12.435  10.298  -0.309
  134    H    ILE  19           HN       ILE  19   9.402   8.920  -1.232
  135    HA   ILE  19           HA       ILE  19   9.231  10.763  -3.461
  136    HB   ILE  19           HB       ILE  19   8.312   8.710  -4.696
  137   1HG1  ILE  19          HG12      ILE  19  10.132   7.317  -2.730
  138   2HG1  ILE  19          HG11      ILE  19   8.389   7.127  -2.865
  139   1HG2  ILE  19          HG21      ILE  19  10.569   8.217  -5.627
  140   2HG2  ILE  19          HG22      ILE  19  11.285   9.093  -4.275
  141   3HG2  ILE  19          HG23      ILE  19  10.268   9.943  -5.441
  142   1HD1  ILE  19          HD11      ILE  19   8.669   6.148  -5.082
  143   2HD1  ILE  19          HD12      ILE  19   9.576   5.253  -3.863
  144   3HD1  ILE  19          HD13      ILE  19  10.415   6.352  -4.956
  145    H    ARG  20           HN       ARG  20   7.179  10.262  -4.633
  146    HA   ARG  20           HA       ARG  20   4.882   9.141  -3.710
  147   1HB   ARG  20          HB2       ARG  20   4.839  10.761  -1.819
  148   2HB   ARG  20          HB1       ARG  20   5.051  12.103  -2.929
  149   1HG   ARG  20          HG2       ARG  20   2.644  10.328  -3.188
  150   2HG   ARG  20          HG1       ARG  20   2.689  11.571  -1.937
  151   1HD   ARG  20          HD2       ARG  20   2.829  13.312  -3.526
  152   2HD   ARG  20          HD1       ARG  20   3.273  12.202  -4.821
  153    HE   ARG  20           HE       ARG  20   0.946  11.308  -4.546
  154   1HH1  ARG  20          HH11      ARG  20   1.548  14.631  -3.487
  155   2HH1  ARG  20          HH12      ARG  20   0.119  15.258  -4.141
  156   1HH2  ARG  20          HH21      ARG  20  -1.044  12.186  -5.504
  157   2HH2  ARG  20          HH22      ARG  20  -1.359  13.853  -5.322
  158    H    ASP  21           HN       ASP  21   6.389  11.889  -5.099
  159    HA   ASP  21           HA       ASP  21   4.678  12.347  -7.314
  160   1HB   ASP  21          HB2       ASP  21   6.515  13.654  -8.180
  161   2HB   ASP  21          HB1       ASP  21   6.385  13.951  -6.451
  162    H    LEU  22           HN       LEU  22   7.620  10.417  -7.011
  163    HA   LEU  22           HA       LEU  22   8.364   8.631  -8.152
  164   1HB   LEU  22          HB2       LEU  22   5.483   8.550  -8.917
  165   2HB   LEU  22          HB1       LEU  22   6.610   7.531  -9.781
  166    HG   LEU  22           HG       LEU  22   5.450   6.366  -8.027
  167   1HD1  LEU  22          HD11      LEU  22   7.489   5.402  -6.928
  168   2HD1  LEU  22          HD12      LEU  22   8.403   6.773  -7.593
  169   3HD1  LEU  22          HD13      LEU  22   7.651   5.624  -8.672
  170   1HD2  LEU  22          HD21      LEU  22   5.954   6.796  -5.652
  171   2HD2  LEU  22          HD22      LEU  22   5.114   8.147  -6.405
  172   3HD2  LEU  22          HD23      LEU  22   6.849   8.240  -6.120
  173    H    ALA  23           HN       ALA  23   8.271  11.453  -9.283
  174    HA   ALA  23           HA       ALA  23   8.174  10.962 -12.077
  175   1HB   ALA  23          HB1       ALA  23   7.362  13.096 -11.232
  176   2HB   ALA  23          HB2       ALA  23   8.747  13.359 -12.293
  177   3HB   ALA  23          HB3       ALA  23   8.945  13.447 -10.542
  178    H    GLY  24           HN       GLY  24   9.823   9.482 -12.354
  179   1HA   GLY  24          HA2       GLY  24  12.223   9.712 -13.200
  180   2HA   GLY  24          HA1       GLY  24  12.467  10.417 -11.590
  181    H    ILE  25           HN       ILE  25  10.361   8.322 -10.759
  182    HA   ILE  25           HA       ILE  25  12.386   6.277 -10.150
  183    HB   ILE  25           HB       ILE  25   9.744   6.826  -8.748
  184   1HG1  ILE  25          HG12      ILE  25  11.377   8.689  -8.458
  185   2HG1  ILE  25          HG11      ILE  25  10.965   7.873  -6.958
  186   1HG2  ILE  25          HG21      ILE  25  12.058   5.052  -7.945
  187   2HG2  ILE  25          HG22      ILE  25  10.476   4.518  -8.511
  188   3HG2  ILE  25          HG23      ILE  25  10.620   5.365  -6.968
  189   1HD1  ILE  25          HD11      ILE  25  13.062   6.662  -7.041
  190   2HD1  ILE  25          HD12      ILE  25  13.309   8.407  -7.043
  191   3HD1  ILE  25          HD13      ILE  25  13.495   7.485  -8.546
  192    H    ASN  26           HN       ASN  26  11.891   4.190 -10.661
  193    HA   ASN  26           HA       ASN  26   9.894   3.931 -12.722
  194   1HB   ASN  26          HB2       ASN  26  11.897   1.939 -11.669
  195   2HB   ASN  26          HB1       ASN  26  10.691   1.525 -12.874
  196   1HD2  ASN  26          HD21      ASN  26  10.896   4.169 -14.221
  197   2HD2  ASN  26          HD22      ASN  26  12.379   4.100 -15.082
  198    H    LEU  27           HN       LEU  27   8.054   2.922 -12.700
  199    HA   LEU  27           HA       LEU  27   6.829   2.312 -10.107
  200   1HB   LEU  27          HB2       LEU  27   5.663   2.336 -12.896
  201   2HB   LEU  27          HB1       LEU  27   4.779   2.400 -11.385
  202    HG   LEU  27           HG       LEU  27   6.608   4.601 -12.359
  203   1HD1  LEU  27          HD11      LEU  27   4.728   4.329 -13.873
  204   2HD1  LEU  27          HD12      LEU  27   4.595   5.812 -12.928
  205   3HD1  LEU  27          HD13      LEU  27   3.609   4.406 -12.507
  206   1HD2  LEU  27          HD21      LEU  27   5.510   5.947 -10.668
  207   2HD2  LEU  27          HD22      LEU  27   6.235   4.525  -9.911
  208   3HD2  LEU  27          HD23      LEU  27   4.498   4.594 -10.208
  209    H    ASP  28           HN       ASP  28   8.707   0.699 -12.057
  210    HA   ASP  28           HA       ASP  28   7.177  -1.826 -12.068
  211   1HB   ASP  28          HB2       ASP  28   9.569  -1.049 -13.751
  212   2HB   ASP  28          HB1       ASP  28   8.752  -2.605 -13.800
  213    H    SER  29           HN       SER  29   9.418  -0.219 -10.334
  214    HA   SER  29           HA       SER  29  11.347  -2.307  -9.994
  215   1HB   SER  29          HB2       SER  29  10.893   0.264  -8.491
  216   2HB   SER  29          HB1       SER  29  12.342  -0.731  -8.400
  217    HG   SER  29           HG       SER  29  12.584  -0.349 -10.696
  218    H    SER  30           HN       SER  30  11.253  -3.861  -8.501
  219    HA   SER  30           HA       SER  30   8.984  -4.232  -6.858
  220   1HB   SER  30          HB2       SER  30  11.651  -5.561  -7.110
  221   2HB   SER  30          HB1       SER  30  10.472  -6.120  -5.941
  222    HG   SER  30           HG       SER  30   9.696  -5.788  -8.653
  223    H    LEU  31           HN       LEU  31   9.227  -4.598  -4.480
  224    HA   LEU  31           HA       LEU  31  10.101  -2.204  -3.274
  225   1HB   LEU  31          HB2       LEU  31   8.181  -3.692  -2.568
  226   2HB   LEU  31          HB1       LEU  31   9.378  -4.775  -1.885
  227    HG   LEU  31           HG       LEU  31  10.100  -3.023  -0.339
  228   1HD1  LEU  31          HD11      LEU  31   8.811  -0.931  -0.234
  229   2HD1  LEU  31          HD12      LEU  31   7.945  -1.457  -1.708
  230   3HD1  LEU  31          HD13      LEU  31   9.673  -1.161  -1.764
  231   1HD2  LEU  31          HD21      LEU  31   7.112  -3.414  -0.365
  232   2HD2  LEU  31          HD22      LEU  31   8.084  -2.916   1.021
  233   3HD2  LEU  31          HD23      LEU  31   8.292  -4.525   0.329
  234    H    ALA  32           HN       ALA  32  11.539  -5.281  -3.762
  235    HA   ALA  32           HA       ALA  32  13.542  -4.975  -1.810
  236   1HB   ALA  32          HB1       ALA  32  12.910  -7.182  -2.618
  237   2HB   ALA  32          HB2       ALA  32  14.640  -6.907  -2.840
  238   3HB   ALA  32          HB3       ALA  32  13.536  -6.784  -4.212
  239    H    ASP  33           HN       ASP  33  13.196  -3.938  -5.125
  240    HA   ASP  33           HA       ASP  33  15.892  -3.395  -5.712
  241   1HB   ASP  33          HB2       ASP  33  13.348  -2.068  -6.713
  242   2HB   ASP  33          HB1       ASP  33  14.941  -1.646  -7.308
  243    H    LEU  34           HN       LEU  34  13.239  -1.592  -4.466
  244    HA   LEU  34           HA       LEU  34  14.305   0.924  -3.992
  245   1HB   LEU  34          HB2       LEU  34  12.081  -0.655  -2.747
  246   2HB   LEU  34          HB1       LEU  34  12.466   0.947  -2.176
  247    HG   LEU  34           HG       LEU  34  11.584   1.980  -4.117
  248   1HD1  LEU  34          HD11      LEU  34  11.663  -0.671  -5.552
  249   2HD1  LEU  34          HD12      LEU  34  12.791   0.659  -5.817
  250   3HD1  LEU  34          HD13      LEU  34  11.083   0.862  -6.204
  251   1HD2  LEU  34          HD21      LEU  34   9.411   0.890  -4.476
  252   2HD2  LEU  34          HD22      LEU  34   9.878   0.983  -2.770
  253   3HD2  LEU  34          HD23      LEU  34  10.054  -0.536  -3.646
  254    H    GLY  35           HN       GLY  35  13.987  -1.804  -1.720
  255   1HA   GLY  35          HA2       GLY  35  16.413  -1.892  -0.630
  256   2HA   GLY  35          HA1       GLY  35  15.827  -0.399   0.065
  257    H    LEU  36           HN       LEU  36  13.478  -2.940  -0.366
  258    HA   LEU  36           HA       LEU  36  13.030  -3.119   2.375
  259   1HB   LEU  36          HB2       LEU  36  11.171  -3.730   1.387
  260   2HB   LEU  36          HB1       LEU  36  11.876  -4.428  -0.017
  261    HG   LEU  36           HG       LEU  36  12.347  -6.478   1.499
  262   1HD1  LEU  36          HD11      LEU  36  10.382  -5.049   3.270
  263   2HD1  LEU  36          HD12      LEU  36  12.073  -5.395   3.645
  264   3HD1  LEU  36          HD13      LEU  36  10.920  -6.718   3.453
  265   1HD2  LEU  36          HD21      LEU  36  10.611  -6.479  -0.190
  266   2HD2  LEU  36          HD22      LEU  36   9.505  -5.672   0.920
  267   3HD2  LEU  36          HD23      LEU  36  10.056  -7.313   1.262
  268    H    ASP  37           HN       ASP  37  14.217  -3.838   3.809
  269    HA   ASP  37           HA       ASP  37  15.634  -6.397   3.463
  270   1HB   ASP  37          HB2       ASP  37  17.536  -5.612   4.695
  271   2HB   ASP  37          HB1       ASP  37  17.202  -4.390   3.479
  272    H    SER  38           HN       SER  38  13.863  -4.196   5.560
  273    HA   SER  38           HA       SER  38  13.032  -6.407   7.167
  274   1HB   SER  38          HB2       SER  38  15.287  -5.802   8.122
  275   2HB   SER  38          HB1       SER  38  14.642  -4.209   8.503
  276    HG   SER  38           HG       SER  38  14.313  -6.620   9.706
  277    H    LEU  39           HN       LEU  39  13.357  -2.858   7.624
  278    HA   LEU  39           HA       LEU  39  10.880  -2.497   8.820
  279   1HB   LEU  39          HB2       LEU  39  12.678  -0.839   8.897
  280   2HB   LEU  39          HB1       LEU  39  12.430  -0.492   7.196
  281    HG   LEU  39           HG       LEU  39  10.101   0.218   7.753
  282   1HD1  LEU  39          HD11      LEU  39  11.076   0.019  10.588
  283   2HD1  LEU  39          HD12      LEU  39   9.813  -0.956   9.839
  284   3HD1  LEU  39          HD13      LEU  39   9.570   0.776  10.069
  285   1HD2  LEU  39          HD21      LEU  39  12.340   1.726   9.087
  286   2HD2  LEU  39          HD22      LEU  39  10.756   2.386   8.660
  287   3HD2  LEU  39          HD23      LEU  39  11.856   1.834   7.393
  288    H    MET  40           HN       MET  40  11.729  -2.434   5.418
  289    HA   MET  40           HA       MET  40   9.194  -1.384   4.603
  290   1HB   MET  40          HB2       MET  40  11.334  -2.700   2.946
  291   2HB   MET  40          HB1       MET  40   9.915  -1.866   2.316
  292   1HG   MET  40          HG2       MET  40  10.631   0.205   3.339
  293   2HG   MET  40          HG1       MET  40  12.019  -0.607   4.052
  294   1HE   MET  40          HE1       MET  40  12.461   2.022   2.557
  295   2HE   MET  40          HE2       MET  40  13.817   1.621   1.503
  296   3HE   MET  40          HE3       MET  40  13.776   1.012   3.158
  297    H    GLY  41           HN       GLY  41   9.850  -4.297   5.848
  298   1HA   GLY  41          HA2       GLY  41   7.540  -5.481   4.451
  299   2HA   GLY  41          HA1       GLY  41   8.769  -6.406   5.316
  300    H    VAL  42           HN       VAL  42   8.943  -4.601   7.520
  301    HA   VAL  42           HA       VAL  42   6.825  -5.642   9.134
  302    HB   VAL  42           HB       VAL  42   8.970  -3.601   9.834
  303   1HG1  VAL  42          HG11      VAL  42   7.173  -5.197  11.651
  304   2HG1  VAL  42          HG12      VAL  42   7.086  -3.459  11.353
  305   3HG1  VAL  42          HG13      VAL  42   8.496  -4.143  12.161
  306   1HG2  VAL  42          HG21      VAL  42  10.115  -5.460  10.920
  307   2HG2  VAL  42          HG22      VAL  42   9.913  -5.755   9.190
  308   3HG2  VAL  42          HG23      VAL  42   8.858  -6.560  10.359
  309    H    GLU  43           HN       GLU  43   7.682  -2.400   7.951
  310    HA   GLU  43           HA       GLU  43   5.725  -0.917   9.251
  311   1HB   GLU  43          HB2       GLU  43   7.628   0.001   7.899
  312   2HB   GLU  43          HB1       GLU  43   6.791  -0.503   6.442
  313   1HG   GLU  43          HG2       GLU  43   6.349   1.812   6.653
  314   2HG   GLU  43          HG1       GLU  43   4.898   0.975   7.162
  315    H    VAL  44           HN       VAL  44   5.702  -2.641   6.217
  316    HA   VAL  44           HA       VAL  44   3.133  -1.924   5.316
  317    HB   VAL  44           HB       VAL  44   4.777  -4.398   4.673
  318   1HG1  VAL  44          HG11      VAL  44   3.442  -4.555   2.627
  319   2HG1  VAL  44          HG12      VAL  44   2.433  -3.217   3.187
  320   3HG1  VAL  44          HG13      VAL  44   2.453  -4.741   4.076
  321   1HG2  VAL  44          HG21      VAL  44   5.946  -2.339   4.145
  322   2HG2  VAL  44          HG22      VAL  44   4.555  -1.756   3.228
  323   3HG2  VAL  44          HG23      VAL  44   5.457  -3.169   2.673
  324    H    ARG  45           HN       ARG  45   4.298  -4.813   7.022
  325    HA   ARG  45           HA       ARG  45   1.728  -5.911   7.183
  326   1HB   ARG  45          HB2       ARG  45   4.316  -6.620   8.451
  327   2HB   ARG  45          HB1       ARG  45   2.858  -7.411   9.022
  328   1HG   ARG  45          HG2       ARG  45   2.381  -7.999   6.613
  329   2HG   ARG  45          HG1       ARG  45   4.003  -7.419   6.244
  330   1HD   ARG  45          HD2       ARG  45   3.387  -9.586   8.235
  331   2HD   ARG  45          HD1       ARG  45   3.801  -9.886   6.549
  332    HE   ARG  45           HE       ARG  45   5.833  -8.356   7.457
  333   1HH1  ARG  45          HH11      ARG  45   4.354 -11.351   8.640
  334   2HH1  ARG  45          HH12      ARG  45   5.812 -12.020   9.205
  335   1HH2  ARG  45          HH21      ARG  45   7.882  -9.324   8.199
  336   2HH2  ARG  45          HH22      ARG  45   7.837 -10.837   8.980
  337    H    GLN  46           HN       GLN  46   3.348  -3.693   9.317
  338    HA   GLN  46           HA       GLN  46   1.240  -4.032  11.251
  339   1HB   GLN  46          HB2       GLN  46   3.506  -2.034  11.159
  340   2HB   GLN  46          HB1       GLN  46   2.312  -2.102  12.449
  341   1HG   GLN  46          HG2       GLN  46   3.029  -4.440  12.911
  342   2HG   GLN  46          HG1       GLN  46   4.277  -4.241  11.698
  343   1HE2  GLN  46          HE21      GLN  46   3.311  -1.706  13.918
  344   2HE2  GLN  46          HE22      GLN  46   4.781  -1.687  14.818
  345    H    ILE  47           HN       ILE  47   1.101  -2.805   8.366
  346    HA   ILE  47           HA       ILE  47  -0.862  -0.750   9.151
  347    HB   ILE  47           HB       ILE  47   0.324  -1.278   6.385
  348   1HG1  ILE  47          HG12      ILE  47   0.717   1.104   8.187
  349   2HG1  ILE  47          HG11      ILE  47   1.867  -0.232   8.053
  350   1HG2  ILE  47          HG21      ILE  47  -1.968  -0.466   6.274
  351   2HG2  ILE  47          HG22      ILE  47  -0.846   0.781   5.718
  352   3HG2  ILE  47          HG23      ILE  47  -1.559   0.884   7.331
  353   1HD1  ILE  47          HD11      ILE  47   2.600   1.664   6.725
  354   2HD1  ILE  47          HD12      ILE  47   1.065   1.673   5.853
  355   3HD1  ILE  47          HD13      ILE  47   2.175   0.315   5.673
  356    H    LEU  48           HN       LEU  48  -0.339  -3.386   6.836
  357    HA   LEU  48           HA       LEU  48  -3.059  -3.593   6.202
  358   1HB   LEU  48          HB2       LEU  48  -0.726  -5.367   5.578
  359   2HB   LEU  48          HB1       LEU  48  -2.349  -5.829   5.122
  360    HG   LEU  48           HG       LEU  48  -1.372  -4.885   3.203
  361   1HD1  LEU  48          HD11      LEU  48  -2.730  -2.932   2.732
  362   2HD1  LEU  48          HD12      LEU  48  -3.065  -2.770   4.452
  363   3HD1  LEU  48          HD13      LEU  48  -3.649  -4.191   3.574
  364   1HD2  LEU  48          HD21      LEU  48  -0.354  -2.655   3.110
  365   2HD2  LEU  48          HD22      LEU  48   0.516  -3.722   4.210
  366   3HD2  LEU  48          HD23      LEU  48  -0.567  -2.488   4.854
  367    H    GLU  49           HN       GLU  49  -1.075  -5.664   8.364
  368    HA   GLU  49           HA       GLU  49  -3.287  -7.337   9.011
  369   1HB   GLU  49          HB2       GLU  49  -0.723  -6.850  10.545
  370   2HB   GLU  49          HB1       GLU  49  -1.894  -8.095  10.927
  371   1HG   GLU  49          HG2       GLU  49  -1.460  -9.127   8.728
  372   2HG   GLU  49          HG1       GLU  49  -0.226  -7.902   8.429
  373    H    ARG  50           HN       ARG  50  -2.093  -4.379  10.123
  374    HA   ARG  50           HA       ARG  50  -3.262  -4.240  12.695
  375   1HB   ARG  50          HB2       ARG  50  -1.359  -2.906  11.826
  376   2HB   ARG  50          HB1       ARG  50  -2.482  -2.029  10.815
  377   1HG   ARG  50          HG2       ARG  50  -1.918  -0.689  12.697
  378   2HG   ARG  50          HG1       ARG  50  -3.594  -1.204  12.871
  379   1HD   ARG  50          HD2       ARG  50  -1.291  -2.618  14.174
  380   2HD   ARG  50          HD1       ARG  50  -2.147  -1.287  14.951
  381    HE   ARG  50           HE       ARG  50  -4.176  -2.711  14.606
  382   1HH1  ARG  50          HH11      ARG  50  -0.970  -4.112  15.058
  383   2HH1  ARG  50          HH12      ARG  50  -1.501  -5.515  15.852
  384   1HH2  ARG  50          HH21      ARG  50  -4.967  -4.619  15.620
  385   2HH2  ARG  50          HH22      ARG  50  -3.879  -5.859  16.127
  386    H    GLU  51           HN       GLU  51  -4.189  -2.704   9.617
  387    HA   GLU  51           HA       GLU  51  -6.705  -1.801  10.702
  388   1HB   GLU  51          HB2       GLU  51  -5.468  -1.570   7.980
  389   2HB   GLU  51          HB1       GLU  51  -7.051  -0.933   8.384
  390   1HG   GLU  51          HG2       GLU  51  -4.482  -0.152   9.719
  391   2HG   GLU  51          HG1       GLU  51  -5.317   0.772   8.469
  392    H    HIS  52           HN       HIS  52  -5.709  -4.080   8.193
  393    HA   HIS  52           HA       HIS  52  -8.557  -4.640   7.696
  394   1HB   HIS  52          HB2       HIS  52  -7.113  -3.623   5.893
  395   2HB   HIS  52          HB1       HIS  52  -6.187  -5.108   5.877
  396    HD1  HIS  52           HD1      HIS  52  -9.336  -3.567   4.701
  397    HD2  HIS  52           HD2      HIS  52  -7.497  -7.285   4.589
  398    HE1  HIS  52           HE1      HIS  52 -10.548  -4.873   2.919
  399    HE2  HIS  52           HE2      HIS  52  -9.046  -6.858   2.603
  400    H    ASP  53           HN       ASP  53  -6.113  -5.932   9.438
  401    HA   ASP  53           HA       ASP  53  -5.426  -7.998  10.159
  402   1HB   ASP  53          HB2       ASP  53  -8.160  -8.863   9.124
  403   2HB   ASP  53          HB1       ASP  53  -7.100  -9.898  10.062
  404    H    LEU  54           HN       LEU  54  -4.936  -7.116   7.455
  405    HA   LEU  54           HA       LEU  54  -5.121  -9.439   5.742
  406   1HB   LEU  54          HB2       LEU  54  -5.760  -7.238   4.954
  407   2HB   LEU  54          HB1       LEU  54  -4.147  -6.646   5.255
  408    HG   LEU  54           HG       LEU  54  -3.271  -8.112   3.496
  409   1HD1  LEU  54          HD11      LEU  54  -4.910  -9.933   3.715
  410   2HD1  LEU  54          HD12      LEU  54  -4.818  -9.343   2.055
  411   3HD1  LEU  54          HD13      LEU  54  -6.169  -8.869   3.084
  412   1HD2  LEU  54          HD21      LEU  54  -5.643  -6.479   2.703
  413   2HD2  LEU  54          HD22      LEU  54  -4.308  -6.945   1.629
  414   3HD2  LEU  54          HD23      LEU  54  -4.022  -5.858   3.000
  415    H    VAL  55           HN       VAL  55  -3.638 -10.874   6.050
  416    HA   VAL  55           HA       VAL  55  -0.956 -10.115   6.839
  417    HB   VAL  55           HB       VAL  55  -2.072 -12.889   6.335
  418   1HG1  VAL  55          HG11      VAL  55   0.458 -12.002   7.735
  419   2HG1  VAL  55          HG12      VAL  55   0.361 -12.799   6.165
  420   3HG1  VAL  55          HG13      VAL  55  -0.125 -13.664   7.623
  421   1HG2  VAL  55          HG21      VAL  55  -2.226 -13.080   8.779
  422   2HG2  VAL  55          HG22      VAL  55  -3.266 -11.797   8.158
  423   3HG2  VAL  55          HG23      VAL  55  -1.734 -11.395   8.934
  424    H    LEU  56           HN       LEU  56   0.135  -9.336   5.223
  425    HA   LEU  56           HA       LEU  56   0.319 -10.944   2.780
  426   1HB   LEU  56          HB2       LEU  56   0.925  -8.012   3.149
  427   2HB   LEU  56          HB1       LEU  56   1.135  -8.907   1.669
  428    HG   LEU  56           HG       LEU  56  -1.527  -8.348   2.983
  429   1HD1  LEU  56          HD11      LEU  56  -1.897  -6.867   1.065
  430   2HD1  LEU  56          HD12      LEU  56  -0.251  -7.177   0.516
  431   3HD1  LEU  56          HD13      LEU  56  -0.528  -6.340   2.043
  432   1HD2  LEU  56          HD21      LEU  56  -0.873  -9.638   0.330
  433   2HD2  LEU  56          HD22      LEU  56  -2.491  -9.264   0.926
  434   3HD2  LEU  56          HD23      LEU  56  -1.501 -10.469   1.752
  435    HA   PRO  57           HA       PRO  57   4.335 -11.501   4.775
  436   1HB   PRO  57          HB2       PRO  57   4.532 -13.640   2.772
  437   2HB   PRO  57          HB1       PRO  57   4.646 -13.761   4.533
  438   1HG   PRO  57          HG2       PRO  57   2.520 -14.717   3.216
  439   2HG   PRO  57          HG1       PRO  57   2.326 -13.903   4.783
  440   1HD   PRO  57          HD2       PRO  57   1.917 -12.816   2.020
  441   2HD   PRO  57          HD1       PRO  57   0.870 -12.666   3.451
  442    H    ILE  58           HN       ILE  58   6.559 -11.553   3.869
  443    HA   ILE  58           HA       ILE  58   6.834  -9.523   1.947
  444    HB   ILE  58           HB       ILE  58   8.891 -11.248   3.355
  445   1HG1  ILE  58          HG12      ILE  58   9.676  -9.052   4.245
  446   2HG1  ILE  58          HG11      ILE  58   8.378  -8.265   3.367
  447   1HG2  ILE  58          HG21      ILE  58   9.597  -9.201   1.254
  448   2HG2  ILE  58          HG22      ILE  58   9.858 -10.942   1.150
  449   3HG2  ILE  58          HG23      ILE  58  10.735  -9.990   2.344
  450   1HD1  ILE  58          HD11      ILE  58   6.746  -9.467   4.727
  451   2HD1  ILE  58          HD12      ILE  58   7.847  -8.505   5.715
  452   3HD1  ILE  58          HD13      ILE  58   8.059 -10.253   5.602
  453    H    ARG  59           HN       ARG  59   6.525 -12.836   1.576
  454    HA   ARG  59           HA       ARG  59   7.771 -13.383  -0.879
  455   1HB   ARG  59          HB2       ARG  59   5.050 -14.385   0.015
  456   2HB   ARG  59          HB1       ARG  59   5.960 -15.032  -1.325
  457   1HG   ARG  59          HG2       ARG  59   6.109 -16.544   0.506
  458   2HG   ARG  59          HG1       ARG  59   7.686 -15.785   0.312
  459   1HD   ARG  59          HD2       ARG  59   7.594 -14.825   2.345
  460   2HD   ARG  59          HD1       ARG  59   5.898 -14.390   2.159
  461    HE   ARG  59           HE       ARG  59   5.578 -16.903   2.545
  462   1HH1  ARG  59          HH11      ARG  59   8.140 -15.032   4.124
  463   2HH1  ARG  59          HH12      ARG  59   7.922 -15.746   5.654
  464   1HH2  ARG  59          HH21      ARG  59   5.246 -17.862   4.660
  465   2HH2  ARG  59          HH22      ARG  59   6.211 -17.404   5.981
  466    H    GLU  60           HN       GLU  60   4.804 -11.691  -0.127
  467    HA   GLU  60           HA       GLU  60   4.332 -11.143  -2.963
  468   1HB   GLU  60          HB2       GLU  60   2.525 -10.979  -0.575
  469   2HB   GLU  60          HB1       GLU  60   2.057 -10.489  -2.200
  470   1HG   GLU  60          HG2       GLU  60   2.451 -12.753  -3.001
  471   2HG   GLU  60          HG1       GLU  60   2.978 -13.227  -1.388
  472    H    VAL  61           HN       VAL  61   5.087  -9.690   0.071
  473    HA   VAL  61           HA       VAL  61   4.477  -7.030  -0.673
  474    HB   VAL  61           HB       VAL  61   6.230  -8.121   1.561
  475   1HG1  VAL  61          HG11      VAL  61   5.318  -5.274   1.171
  476   2HG1  VAL  61          HG12      VAL  61   6.978  -5.854   1.023
  477   3HG1  VAL  61          HG13      VAL  61   6.160  -5.911   2.585
  478   1HG2  VAL  61          HG21      VAL  61   3.473  -6.928   1.562
  479   2HG2  VAL  61          HG22      VAL  61   4.348  -7.523   2.977
  480   3HG2  VAL  61          HG23      VAL  61   3.865  -8.638   1.695
  481    H    ARG  62           HN       ARG  62   7.266  -9.033  -1.146
  482    HA   ARG  62           HA       ARG  62   9.140  -7.024  -1.646
  483   1HB   ARG  62          HB2       ARG  62   9.770  -9.315  -1.176
  484   2HB   ARG  62          HB1       ARG  62   9.034  -9.847  -2.679
  485   1HG   ARG  62          HG2       ARG  62  10.651  -8.642  -3.952
  486   2HG   ARG  62          HG1       ARG  62  11.343  -7.947  -2.481
  487   1HD   ARG  62          HD2       ARG  62  11.994 -10.184  -1.740
  488   2HD   ARG  62          HD1       ARG  62  11.214 -10.899  -3.148
  489    HE   ARG  62           HE       ARG  62  12.945  -9.288  -4.308
  490   1HH1  ARG  62          HH11      ARG  62  13.327 -11.709  -1.780
  491   2HH1  ARG  62          HH12      ARG  62  15.004 -11.950  -1.986
  492   1HH2  ARG  62          HH21      ARG  62  15.264  -9.636  -4.686
  493   2HH2  ARG  62          HH22      ARG  62  16.150 -10.684  -3.686
  494    H    GLN  63           HN       GLN  63   6.503  -8.017  -3.618
  495    HA   GLN  63           HA       GLN  63   7.850  -6.808  -5.906
  496   1HB   GLN  63          HB2       GLN  63   6.231  -7.904  -7.442
  497   2HB   GLN  63          HB1       GLN  63   7.165  -9.068  -6.531
  498   1HG   GLN  63          HG2       GLN  63   4.507  -8.303  -5.463
  499   2HG   GLN  63          HG1       GLN  63   4.549  -9.274  -6.928
  500   1HE2  GLN  63          HE21      GLN  63   7.053  -9.621  -4.565
  501   2HE2  GLN  63          HE22      GLN  63   6.512 -11.141  -3.937
  502    H    LEU  64           HN       LEU  64   6.265  -5.754  -3.546
  503    HA   LEU  64           HA       LEU  64   4.148  -4.340  -4.794
  504   1HB   LEU  64          HB2       LEU  64   5.675  -3.746  -2.249
  505   2HB   LEU  64          HB1       LEU  64   4.315  -2.790  -2.795
  506    HG   LEU  64           HG       LEU  64   4.207  -5.711  -2.017
  507   1HD1  LEU  64          HD11      LEU  64   3.231  -3.244  -0.594
  508   2HD1  LEU  64          HD12      LEU  64   4.594  -4.255  -0.110
  509   3HD1  LEU  64          HD13      LEU  64   2.958  -4.907  -0.080
  510   1HD2  LEU  64          HD21      LEU  64   1.777  -5.410  -2.142
  511   2HD2  LEU  64          HD22      LEU  64   2.553  -5.176  -3.705
  512   3HD2  LEU  64          HD23      LEU  64   2.012  -3.777  -2.770
  513    H    THR  65           HN       THR  65   4.703  -3.256  -6.569
  514    HA   THR  65           HA       THR  65   7.224  -2.036  -6.996
  515    HB   THR  65           HB       THR  65   6.059  -1.553  -9.211
  516    HG1  THR  65           HG1      THR  65   4.047  -2.725  -9.413
  517   1HG2  THR  65          HG21      THR  65   6.105  -3.911  -9.835
  518   2HG2  THR  65          HG22      THR  65   6.023  -4.318  -8.110
  519   3HG2  THR  65          HG23      THR  65   7.469  -3.522  -8.755
  520    H    LEU  66           HN       LEU  66   6.052  -0.765  -4.957
  521    HA   LEU  66           HA       LEU  66   5.623   1.212  -4.025
  522   1HB   LEU  66          HB2       LEU  66   7.579   1.788  -5.607
  523   2HB   LEU  66          HB1       LEU  66   6.378   2.555  -6.619
  524    HG   LEU  66           HG       LEU  66   7.613   4.162  -5.211
  525   1HD1  LEU  66          HD11      LEU  66   5.378   4.742  -5.902
  526   2HD1  LEU  66          HD12      LEU  66   5.704   5.368  -4.281
  527   3HD1  LEU  66          HD13      LEU  66   4.713   3.918  -4.494
  528   1HD2  LEU  66          HD21      LEU  66   6.336   2.697  -2.911
  529   2HD2  LEU  66          HD22      LEU  66   7.237   4.208  -2.793
  530   3HD2  LEU  66          HD23      LEU  66   8.055   2.731  -3.307
  531    H    ARG  67           HN       ARG  67   4.401   1.515  -7.369
  532    HA   ARG  67           HA       ARG  67   2.146   2.963  -6.346
  533   1HB   ARG  67          HB2       ARG  67   2.867   2.121  -9.135
  534   2HB   ARG  67          HB1       ARG  67   1.305   2.840  -8.764
  535   1HG   ARG  67          HG2       ARG  67   3.982   4.106  -8.229
  536   2HG   ARG  67          HG1       ARG  67   2.896   4.507  -9.566
  537   1HD   ARG  67          HD2       ARG  67   1.151   5.087  -7.914
  538   2HD   ARG  67          HD1       ARG  67   2.282   4.723  -6.646
  539    HE   ARG  67           HE       ARG  67   3.469   6.627  -7.042
  540   1HH1  ARG  67          HH11      ARG  67   1.029   6.423  -9.625
  541   2HH1  ARG  67          HH12      ARG  67   0.813   8.102  -9.752
  542   1HH2  ARG  67          HH21      ARG  67   3.117   9.033  -7.210
  543   2HH2  ARG  67          HH22      ARG  67   2.006   9.605  -8.337
  544    H    LYS  68           HN       LYS  68   2.844  -0.278  -6.877
  545    HA   LYS  68           HA       LYS  68   0.193  -1.231  -6.990
  546   1HB   LYS  68          HB2       LYS  68   2.260  -2.647  -7.365
  547   2HB   LYS  68          HB1       LYS  68   2.495  -2.633  -5.617
  548   1HG   LYS  68          HG2       LYS  68   0.360  -3.685  -5.279
  549   2HG   LYS  68          HG1       LYS  68   0.054  -3.660  -7.012
  550   1HD   LYS  68          HD2       LYS  68   2.000  -5.127  -7.334
  551   2HD   LYS  68          HD1       LYS  68   2.207  -5.194  -5.577
  552   1HE   LYS  68          HE2       LYS  68  -0.116  -5.992  -5.386
  553   2HE   LYS  68          HE1       LYS  68  -0.210  -6.053  -7.141
  554   1HZ   LYS  68          HZ1       LYS  68   1.585  -7.643  -5.405
  555   2HZ   LYS  68          HZ2       LYS  68   1.586  -7.733  -7.113
  556   3HZ   LYS  68          HZ3       LYS  68   0.221  -8.182  -6.209
  557    H    LEU  69           HN       LEU  69   2.060   0.123  -4.555
  558    HA   LEU  69           HA       LEU  69   0.616  -0.734  -2.252
  559   1HB   LEU  69          HB2       LEU  69   2.282   1.724  -2.697
  560   2HB   LEU  69          HB1       LEU  69   1.344   1.562  -1.234
  561    HG   LEU  69           HG       LEU  69   3.607   0.961  -0.792
  562   1HD1  LEU  69          HD11      LEU  69   3.349  -1.303   0.075
  563   2HD1  LEU  69          HD12      LEU  69   1.866  -1.480  -0.868
  564   3HD1  LEU  69          HD13      LEU  69   1.958  -0.277   0.419
  565   1HD2  LEU  69          HD21      LEU  69   4.732  -0.927  -1.882
  566   2HD2  LEU  69          HD22      LEU  69   4.338   0.349  -3.037
  567   3HD2  LEU  69          HD23      LEU  69   3.354  -1.115  -2.965
  568    H    GLN  70           HN       GLN  70  -0.138   1.736  -4.612
  569    HA   GLN  70           HA       GLN  70  -2.454   2.429  -3.012
  570   1HB   GLN  70          HB2       GLN  70  -2.879   4.173  -4.891
  571   2HB   GLN  70          HB1       GLN  70  -1.569   4.449  -3.758
  572   1HG   GLN  70          HG2       GLN  70   0.033   3.673  -5.384
  573   2HG   GLN  70          HG1       GLN  70  -1.265   3.341  -6.547
  574   1HE2  GLN  70          HE21      GLN  70  -2.134   5.096  -7.646
  575   2HE2  GLN  70          HE22      GLN  70  -1.376   6.659  -7.602
  576    H    GLU  71           HN       GLU  71  -1.777   0.032  -4.874
  577    HA   GLU  71           HA       GLU  71  -4.462  -0.229  -6.067
  578   1HB   GLU  71          HB2       GLU  71  -2.010  -1.999  -6.286
  579   2HB   GLU  71          HB1       GLU  71  -3.534  -2.268  -7.112
  580   1HG   GLU  71          HG2       GLU  71  -1.753   0.114  -7.539
  581   2HG   GLU  71          HG1       GLU  71  -1.742  -1.344  -8.530
  582    H    MET  72           HN       MET  72  -2.432  -1.174  -3.516
  583    HA   MET  72           HA       MET  72  -4.310  -3.241  -2.558
  584   1HB   MET  72          HB2       MET  72  -1.374  -2.788  -1.942
  585   2HB   MET  72          HB1       MET  72  -2.374  -3.992  -1.165
  586   1HG   MET  72          HG2       MET  72  -1.882  -3.985  -4.135
  587   2HG   MET  72          HG1       MET  72  -0.777  -4.735  -3.002
  588   1HE   MET  72          HE1       MET  72  -5.102  -6.273  -3.789
  589   2HE   MET  72          HE2       MET  72  -4.349  -4.966  -4.706
  590   3HE   MET  72          HE3       MET  72  -4.802  -4.714  -3.021
  591    H    SER  73           HN       SER  73  -4.294  -0.208  -2.337
  592    HA   SER  73           HA       SER  73  -3.436   0.455   0.258
  593   1HB   SER  73          HB2       SER  73  -4.620   2.641  -0.251
  594   2HB   SER  73          HB1       SER  73  -3.354   2.137  -1.347
  595    HG   SER  73           HG       SER  73  -5.192   2.821  -2.508
  596    H    SER  74           HN       SER  74  -6.190  -1.108  -0.843
  597    HA   SER  74           HA       SER  74  -7.957  -2.037   0.233
  598   1HB   SER  74          HB2       SER  74  -6.416  -1.295   2.724
  599   2HB   SER  74          HB1       SER  74  -7.723  -2.477   2.631
  600    HG   SER  74           HG       SER  74  -5.189  -2.557   1.385
  601    H    LYS  75           HN       LYS  75  -7.857   0.953  -0.170
  602    HA   LYS  75           HA       LYS  75  -9.568   1.969   1.871
  603   1HB   LYS  75          HB2       LYS  75  -9.760   3.987   0.365
  604   2HB   LYS  75          HB1       LYS  75  -8.142   3.591   0.915
  605   1HG   LYS  75          HG2       LYS  75  -7.584   2.668  -1.232
  606   2HG   LYS  75          HG1       LYS  75  -9.251   2.849  -1.784
  607   1HD   LYS  75          HD2       LYS  75  -7.823   4.629  -2.667
  608   2HD   LYS  75          HD1       LYS  75  -9.066   5.269  -1.598
  609   1HE   LYS  75          HE2       LYS  75  -7.400   5.416   0.214
  610   2HE   LYS  75          HE1       LYS  75  -6.166   4.796  -0.884
  611   1HZ   LYS  75          HZ1       LYS  75  -7.666   7.358  -1.223
  612   2HZ   LYS  75          HZ2       LYS  75  -6.580   6.720  -2.325
  613   3HZ   LYS  75          HZ3       LYS  75  -6.021   7.215  -0.854
  614    H    ALA  76           HN       ALA  76 -11.638   1.916   2.009
  615    HA   ALA  76           HA       ALA  76 -13.409   1.800  -0.230
  616   1HB   ALA  76          HB1       ALA  76 -14.452  -0.344   0.389
  617   2HB   ALA  76          HB2       ALA  76 -13.209  -0.597   1.614
  618   3HB   ALA  76          HB3       ALA  76 -12.770  -0.574  -0.093
  619    H    GLY  77           HN       GLY  77 -15.702   1.613   0.661
  620   1HA   GLY  77          HA2       GLY  77 -16.900   1.567   2.898
  621   2HA   GLY  77          HA1       GLY  77 -15.846   2.923   3.288
  622    H    SER  78           HN       SER  78 -16.357   4.878   2.654
  623    HA   SER  78           HA       SER  78 -18.964   5.328   1.507
  624   1HB   SER  78          HB2       SER  78 -18.107   6.664   3.430
  625   2HB   SER  78          HB1       SER  78 -16.814   7.278   2.403
  626    HG   SER  78           HG       SER  78 -19.074   7.704   1.129
  627    H    ASP  79           HN       ASP  79 -15.595   5.546   0.680
  628    HA   ASP  79           HA       ASP  79 -16.319   6.141  -2.114
  629   1HB   ASP  79          HB2       ASP  79 -14.733   7.818  -1.010
  630   2HB   ASP  79          HB1       ASP  79 -13.599   6.495  -0.790
  631    H    THR  80           HN       THR  80 -15.673   4.620  -3.547
  632    HA   THR  80           HA       THR  80 -14.972   2.702  -4.396
  633    HB   THR  80           HB       THR  80 -13.356   2.215  -1.861
  634    HG1  THR  80           HG1      THR  80 -13.044   4.173  -3.494
  635   1HG2  THR  80          HG21      THR  80 -12.002   0.756  -3.318
  636   2HG2  THR  80          HG22      THR  80 -13.080   1.110  -4.673
  637   3HG2  THR  80          HG23      THR  80 -13.682   0.219  -3.275
  638    H    GLU  81           HN       GLU  81 -16.939   1.970  -4.425
  639    HA   GLU  81           HA       GLU  81 -17.998   0.549  -2.108
  640   1HB   GLU  81          HB2       GLU  81 -19.396   1.537  -4.589
  641   2HB   GLU  81          HB1       GLU  81 -20.155   0.860  -3.150
  642   1HG   GLU  81          HG2       GLU  81 -19.349   2.735  -1.826
  643   2HG   GLU  81          HG1       GLU  81 -18.566   3.412  -3.252
  644    H    LEU  82           HN       LEU  82 -17.735  -1.534  -2.161
  645    HA   LEU  82           HA       LEU  82 -17.316  -2.896  -4.696
  646   1HB   LEU  82          HB2       LEU  82 -17.004  -3.832  -1.838
  647   2HB   LEU  82          HB1       LEU  82 -16.860  -4.906  -3.206
  648    HG   LEU  82           HG       LEU  82 -14.919  -3.483  -3.987
  649   1HD1  LEU  82          HD11      LEU  82 -13.771  -2.098  -2.337
  650   2HD1  LEU  82          HD12      LEU  82 -15.121  -2.315  -1.223
  651   3HD1  LEU  82          HD13      LEU  82 -15.362  -1.453  -2.741
  652   1HD2  LEU  82          HD21      LEU  82 -14.595  -5.629  -2.913
  653   2HD2  LEU  82          HD22      LEU  82 -14.671  -4.867  -1.323
  654   3HD2  LEU  82          HD23      LEU  82 -13.340  -4.494  -2.418
  655    H    ALA  83           HN       ALA  83 -18.827  -4.038  -5.647
  656    HA   ALA  83           HA       ALA  83 -21.444  -4.184  -4.438
  657   1HB   ALA  83          HB1       ALA  83 -21.232  -3.612  -6.818
  658   2HB   ALA  83          HB2       ALA  83 -22.133  -5.115  -6.609
  659   3HB   ALA  83          HB3       ALA  83 -20.447  -5.161  -7.124
  660    H    ALA  84           HN       ALA  84 -22.521  -6.107  -4.021
  661    HA   ALA  84           HA       ALA  84 -20.913  -8.146  -2.901
  662   1HB   ALA  84          HB1       ALA  84 -23.040  -9.296  -2.478
  663   2HB   ALA  84          HB2       ALA  84 -23.871  -8.150  -3.527
  664   3HB   ALA  84          HB3       ALA  84 -23.135  -7.596  -2.023
  665    HA   PRO  85           HA       PRO  85 -20.076 -10.475  -6.652
  666   1HB   PRO  85          HB2       PRO  85 -19.701 -12.624  -4.612
  667   2HB   PRO  85          HB1       PRO  85 -18.613 -12.121  -5.909
  668   1HG   PRO  85          HG2       PRO  85 -18.078 -11.459  -3.400
  669   2HG   PRO  85          HG1       PRO  85 -17.820 -10.292  -4.712
  670   1HD   PRO  85          HD2       PRO  85 -20.036 -10.436  -2.714
  671   2HD   PRO  85          HD1       PRO  85 -19.191  -9.014  -3.360
  672    H    LYS  86           HN       LYS  86 -21.187 -12.042  -7.816
  673    HA   LYS  86           HA       LYS  86 -23.879 -12.217  -7.617
  674   1HB   LYS  86          HB2       LYS  86 -22.575 -12.838  -9.602
  675   2HB   LYS  86          HB1       LYS  86 -22.056 -14.312  -8.802
  676   1HG   LYS  86          HG2       LYS  86 -24.450 -15.012  -8.686
  677   2HG   LYS  86          HG1       LYS  86 -24.856 -13.593  -9.652
  678   1HD   LYS  86          HD2       LYS  86 -23.004 -15.831 -10.493
  679   2HD   LYS  86          HD1       LYS  86 -24.665 -15.616 -11.033
  680   1HE   LYS  86          HE2       LYS  86 -22.422 -13.652 -11.485
  681   2HE   LYS  86          HE1       LYS  86 -22.988 -14.828 -12.668
  682   1HZ   LYS  86          HZ1       LYS  86 -24.638 -12.616 -11.520
  683   2HZ   LYS  86          HZ2       LYS  86 -25.145 -13.734 -12.676
  684   3HZ   LYS  86          HZ3       LYS  86 -23.910 -12.641 -13.038
  685    H    SER  87           HN       SER  87 -24.854 -12.776  -5.819
  686    HA   SER  87           HA       SER  87 -24.522 -15.556  -4.947
  687   1HB   SER  87          HB2       SER  87 -25.296 -13.159  -3.266
  688   2HB   SER  87          HB1       SER  87 -25.170 -14.823  -2.691
  689    HG   SER  87           HG       SER  87 -23.023 -13.683  -4.034
  690    H    LYS  88           HN       LYS  88 -26.474 -13.185  -6.301
  691    HA   LYS  88           HA       LYS  88 -28.987 -14.367  -5.582
  692   1HB   LYS  88          HB2       LYS  88 -29.945 -12.750  -7.128
  693   2HB   LYS  88          HB1       LYS  88 -28.816 -11.957  -6.046
  694   1HG   LYS  88          HG2       LYS  88 -27.138 -11.899  -7.809
  695   2HG   LYS  88          HG1       LYS  88 -28.233 -12.759  -8.892
  696   1HD   LYS  88          HD2       LYS  88 -28.710 -10.038  -7.673
  697   2HD   LYS  88          HD1       LYS  88 -28.255 -10.359  -9.348
  698   1HE   LYS  88          HE2       LYS  88 -30.333 -11.595  -9.685
  699   2HE   LYS  88          HE1       LYS  88 -30.783 -11.311  -8.004
  700   1HZ   LYS  88          HZ1       LYS  88 -30.785  -8.937  -8.468
  701   2HZ   LYS  88          HZ2       LYS  88 -31.880  -9.756  -9.476
  702   3HZ   LYS  88          HZ3       LYS  88 -30.399  -9.241 -10.087
  703    H    ASN  89           HN       ASN  89 -30.400 -15.261  -7.274
  704    HA   ASN  89           HA       ASN  89 -28.898 -16.427  -9.470
  705   1HB   ASN  89          HB2       ASN  89 -30.643 -18.039  -7.585
  706   2HB   ASN  89          HB1       ASN  89 -30.075 -18.627  -9.144
  707   1HD2  ASN  89          HD21      ASN  89 -29.245 -17.933  -5.872
  708   2HD2  ASN  89          HD22      ASN  89 -27.658 -18.614  -5.901
  Start of MODEL   30
    1   1H    GLY   1          HT1       GLY   1 -13.382  10.668  14.597
    2   2H    GLY   1          HT2       GLY   1 -15.030  10.272  14.644
    3   3H    GLY   1          HT3       GLY   1 -14.452  11.618  15.490
    4   1HA   GLY   1          HA1       GLY   1 -15.560  12.197  13.374
    5   2HA   GLY   1          HA2       GLY   1 -13.869  12.700  13.448
    6    H    ASP   2           HN       ASP   2 -14.373  12.610  11.026
    7    HA   ASP   2           HA       ASP   2 -13.223  10.168  10.064
    8   1HB   ASP   2          HB2       ASP   2 -15.605   9.587  10.026
    9   2HB   ASP   2          HB1       ASP   2 -15.945  11.023   9.065
   10    H    GLY   3           HN       GLY   3 -11.685  10.825   8.900
   11   1HA   GLY   3          HA2       GLY   3 -12.081  12.879   6.875
   12   2HA   GLY   3          HA1       GLY   3 -10.856  13.201   8.100
   13    H    GLU   4           HN       GLU   4  -9.526  11.078   8.534
   14    HA   GLU   4           HA       GLU   4  -9.136   9.493   6.205
   15   1HB   GLU   4          HB2       GLU   4  -6.691   9.962   6.006
   16   2HB   GLU   4          HB1       GLU   4  -7.704  11.316   5.545
   17   1HG   GLU   4          HG2       GLU   4  -7.266  12.351   7.733
   18   2HG   GLU   4          HG1       GLU   4  -6.204  11.002   8.136
   19    H    ALA   5           HN       ALA   5  -9.273   7.624   7.013
   20    HA   ALA   5           HA       ALA   5  -8.369   6.930   9.640
   21   1HB   ALA   5          HB1       ALA   5 -10.217   5.723   8.573
   22   2HB   ALA   5          HB2       ALA   5  -8.898   4.619   8.956
   23   3HB   ALA   5          HB3       ALA   5  -9.134   5.171   7.299
   24    H    GLN   6           HN       GLN   6  -7.242   6.666   6.390
   25    HA   GLN   6           HA       GLN   6  -4.489   6.463   7.203
   26   1HB   GLN   6          HB2       GLN   6  -5.832   4.531   5.255
   27   2HB   GLN   6          HB1       GLN   6  -4.096   4.682   5.477
   28   1HG   GLN   6          HG2       GLN   6  -4.239   3.837   7.711
   29   2HG   GLN   6          HG1       GLN   6  -5.998   3.876   7.663
   30   1HE2  GLN   6          HE21      GLN   6  -6.200   1.737   8.135
   31   2HE2  GLN   6          HE22      GLN   6  -5.839   0.485   7.029
   32    H    ARG   7           HN       ARG   7  -3.220   7.370   5.429
   33    HA   ARG   7           HA       ARG   7  -4.916   9.166   3.877
   34   1HB   ARG   7          HB2       ARG   7  -2.896  10.381   3.202
   35   2HB   ARG   7          HB1       ARG   7  -2.908  10.175   4.939
   36   1HG   ARG   7          HG2       ARG   7  -1.446   8.082   3.487
   37   2HG   ARG   7          HG1       ARG   7  -0.780   9.700   3.300
   38   1HD   ARG   7          HD2       ARG   7  -1.404   8.433   5.964
   39   2HD   ARG   7          HD1       ARG   7   0.178   8.361   5.189
   40    HE   ARG   7           HE       ARG   7  -0.804  11.019   5.371
   41   1HH1  ARG   7          HH11      ARG   7   0.868   8.491   7.292
   42   2HH1  ARG   7          HH12      ARG   7   1.610   9.632   8.307
   43   1HH2  ARG   7          HH21      ARG   7   0.248  12.525   6.814
   44   2HH2  ARG   7          HH22      ARG   7   1.235  11.941   8.050
   45    H    ASP   8           HN       ASP   8  -2.636   6.606   3.417
   46    HA   ASP   8           HA       ASP   8  -3.509   5.320   1.224
   47   1HB   ASP   8          HB2       ASP   8  -3.335   7.323  -0.167
   48   2HB   ASP   8          HB1       ASP   8  -1.719   7.649   0.434
   49    H    LEU   9           HN       LEU   9  -1.645   3.992   0.278
   50    HA   LEU   9           HA       LEU   9   0.124   3.485   2.503
   51   1HB   LEU   9          HB2       LEU   9  -0.313   1.855   0.010
   52   2HB   LEU   9          HB1       LEU   9   0.665   1.376   1.376
   53    HG   LEU   9           HG       LEU   9  -2.318   1.686   1.286
   54   1HD1  LEU   9          HD11      LEU   9  -1.480  -0.393   0.397
   55   2HD1  LEU   9          HD12      LEU   9  -2.300  -0.652   1.940
   56   3HD1  LEU   9          HD13      LEU   9  -0.540  -0.660   1.867
   57   1HD2  LEU   9          HD21      LEU   9  -2.337   1.075   3.647
   58   2HD2  LEU   9          HD22      LEU   9  -1.515   2.613   3.382
   59   3HD2  LEU   9          HD23      LEU   9  -0.574   1.151   3.679
   60    H    VAL  10           HN       VAL  10   0.314   4.665  -0.807
   61    HA   VAL  10           HA       VAL  10   3.157   4.383  -0.960
   62    HB   VAL  10           HB       VAL  10   1.166   5.892  -2.697
   63   1HG1  VAL  10          HG11      VAL  10   2.985   6.274  -4.289
   64   2HG1  VAL  10          HG12      VAL  10   4.139   5.572  -3.156
   65   3HG1  VAL  10          HG13      VAL  10   3.327   7.085  -2.761
   66   1HG2  VAL  10          HG21      VAL  10   2.802   3.417  -3.080
   67   2HG2  VAL  10          HG22      VAL  10   1.884   4.206  -4.342
   68   3HG2  VAL  10          HG23      VAL  10   1.044   3.524  -2.929
   69    H    LYS  11           HN       LYS  11   0.855   6.859  -0.198
   70    HA   LYS  11           HA       LYS  11   2.657   9.026   0.065
   71   1HB   LYS  11          HB2       LYS  11   0.174   8.680   1.755
   72   2HB   LYS  11          HB1       LYS  11   0.955  10.183   1.296
   73   1HG   LYS  11          HG2       LYS  11  -0.514   8.295  -0.542
   74   2HG   LYS  11          HG1       LYS  11  -1.102   9.837   0.054
   75   1HD   LYS  11          HD2       LYS  11   0.561  11.017  -1.216
   76   2HD   LYS  11          HD1       LYS  11   1.354   9.504  -1.657
   77   1HE   LYS  11          HE2       LYS  11  -0.034  10.375  -3.495
   78   2HE   LYS  11          HE1       LYS  11  -0.600   8.807  -2.929
   79   1HZ   LYS  11          HZ1       LYS  11  -2.358   9.946  -1.681
   80   2HZ   LYS  11          HZ2       LYS  11  -2.438  10.358  -3.310
   81   3HZ   LYS  11          HZ3       LYS  11  -1.783  11.434  -2.196
   82    H    ALA  12           HN       ALA  12   2.290   6.272   1.961
   83    HA   ALA  12           HA       ALA  12   3.717   7.439   4.240
   84   1HB   ALA  12          HB1       ALA  12   3.122   5.392   5.449
   85   2HB   ALA  12          HB2       ALA  12   2.379   4.743   3.988
   86   3HB   ALA  12          HB3       ALA  12   1.684   6.158   4.772
   87    H    VAL  13           HN       VAL  13   3.779   4.415   2.310
   88    HA   VAL  13           HA       VAL  13   6.312   3.582   3.174
   89    HB   VAL  13           HB       VAL  13   4.772   2.786   0.677
   90   1HG1  VAL  13          HG11      VAL  13   7.128   2.276   0.369
   91   2HG1  VAL  13          HG12      VAL  13   6.201   0.792   0.595
   92   3HG1  VAL  13          HG13      VAL  13   7.175   1.436   1.918
   93   1HG2  VAL  13          HG21      VAL  13   5.046   1.452   3.373
   94   2HG2  VAL  13          HG22      VAL  13   4.185   0.786   1.982
   95   3HG2  VAL  13          HG23      VAL  13   3.608   2.264   2.749
   96    H    ALA  14           HN       ALA  14   5.389   5.366   0.234
   97    HA   ALA  14           HA       ALA  14   8.062   5.349  -0.736
   98   1HB   ALA  14          HB1       ALA  14   7.253   6.941  -2.468
   99   2HB   ALA  14          HB2       ALA  14   5.727   7.099  -1.587
  100   3HB   ALA  14          HB3       ALA  14   6.163   5.564  -2.302
  101    H    HIS  15           HN       HIS  15   6.230   7.349   1.404
  102    HA   HIS  15           HA       HIS  15   7.937   9.641   1.303
  103   1HB   HIS  15          HB2       HIS  15   5.568   9.589   2.272
  104   2HB   HIS  15          HB1       HIS  15   6.255   8.799   3.682
  105    HD1  HIS  15           HD1      HIS  15   5.493  12.052   2.295
  106    HD2  HIS  15           HD2      HIS  15   8.139  10.575   5.131
  107    HE1  HIS  15           HE1      HIS  15   6.279  14.050   3.594
  108    HE2  HIS  15           HE2      HIS  15   7.386  13.002   5.557
  109    H    ILE  16           HN       ILE  16   7.960   6.641   3.051
  110    HA   ILE  16           HA       ILE  16  10.008   7.152   4.907
  111    HB   ILE  16           HB       ILE  16   9.247   4.573   3.498
  112   1HG1  ILE  16          HG12      ILE  16   7.459   5.485   4.890
  113   2HG1  ILE  16          HG11      ILE  16   8.087   3.998   5.586
  114   1HG2  ILE  16          HG21      ILE  16  10.449   3.347   5.251
  115   2HG2  ILE  16          HG22      ILE  16  11.055   4.875   5.893
  116   3HG2  ILE  16          HG23      ILE  16  11.526   4.349   4.279
  117   1HD1  ILE  16          HD11      ILE  16   8.734   6.794   6.504
  118   2HD1  ILE  16          HD12      ILE  16   9.368   5.307   7.208
  119   3HD1  ILE  16          HD13      ILE  16   7.643   5.661   7.303
  120    H    LEU  17           HN       LEU  17  10.058   6.188   1.552
  121    HA   LEU  17           HA       LEU  17  12.915   5.855   1.419
  122   1HB   LEU  17          HB2       LEU  17  10.925   6.139  -0.831
  123   2HB   LEU  17          HB1       LEU  17  12.558   5.520  -0.961
  124    HG   LEU  17           HG       LEU  17  10.234   4.222   0.438
  125   1HD1  LEU  17          HD11      LEU  17  11.796   3.420  -2.005
  126   2HD1  LEU  17          HD12      LEU  17  10.147   4.042  -1.971
  127   3HD1  LEU  17          HD13      LEU  17  10.516   2.476  -1.245
  128   1HD2  LEU  17          HD21      LEU  17  12.273   3.818   1.695
  129   2HD2  LEU  17          HD22      LEU  17  13.093   3.293   0.225
  130   3HD2  LEU  17          HD23      LEU  17  11.751   2.348   0.872
  131    H    GLY  18           HN       GLY  18  10.574   8.298   0.591
  132   1HA   GLY  18          HA2       GLY  18  11.322  10.639   0.892
  133   2HA   GLY  18          HA1       GLY  18  12.785  10.174   0.032
  134    H    ILE  19           HN       ILE  19   9.678   8.955  -0.938
  135    HA   ILE  19           HA       ILE  19   9.653  10.769  -3.205
  136    HB   ILE  19           HB       ILE  19   8.695   8.678  -4.411
  137   1HG1  ILE  19          HG12      ILE  19  10.606   7.362  -2.470
  138   2HG1  ILE  19          HG11      ILE  19   8.865   7.140  -2.523
  139   1HG2  ILE  19          HG21      ILE  19  11.646   9.199  -4.055
  140   2HG2  ILE  19          HG22      ILE  19  10.540   9.950  -5.219
  141   3HG2  ILE  19          HG23      ILE  19  10.942   8.241  -5.366
  142   1HD1  ILE  19          HD11      ILE  19   9.068   6.118  -4.739
  143   2HD1  ILE  19          HD12      ILE  19  10.026   5.260  -3.531
  144   3HD1  ILE  19          HD13      ILE  19  10.815   6.343  -4.675
  145    H    ARG  20           HN       ARG  20   7.648  10.772  -4.316
  146    HA   ARG  20           HA       ARG  20   5.320   9.528  -3.318
  147   1HB   ARG  20          HB2       ARG  20   5.447  11.284  -1.586
  148   2HB   ARG  20          HB1       ARG  20   5.567  12.501  -2.861
  149   1HG   ARG  20          HG2       ARG  20   3.337  12.094  -3.583
  150   2HG   ARG  20          HG1       ARG  20   3.196  10.680  -2.547
  151   1HD   ARG  20          HD2       ARG  20   1.981  12.604  -1.643
  152   2HD   ARG  20          HD1       ARG  20   3.287  12.102  -0.574
  153    HE   ARG  20           HE       ARG  20   4.507  14.014  -1.210
  154   1HH1  ARG  20          HH11      ARG  20   1.340  14.022  -2.812
  155   2HH1  ARG  20          HH12      ARG  20   1.158  15.712  -2.738
  156   1HH2  ARG  20          HH21      ARG  20   4.194  16.363  -1.059
  157   2HH2  ARG  20          HH22      ARG  20   2.798  17.078  -1.718
  158    H    ASP  21           HN       ASP  21   6.813  12.055  -5.212
  159    HA   ASP  21           HA       ASP  21   4.683  12.437  -7.005
  160   1HB   ASP  21          HB2       ASP  21   7.628  12.997  -7.346
  161   2HB   ASP  21          HB1       ASP  21   6.405  13.457  -8.522
  162    H    LEU  22           HN       LEU  22   7.640  10.526  -7.344
  163    HA   LEU  22           HA       LEU  22   8.095   8.655  -8.521
  164   1HB   LEU  22          HB2       LEU  22   5.102   8.531  -8.530
  165   2HB   LEU  22          HB1       LEU  22   6.004   7.421  -9.529
  166    HG   LEU  22           HG       LEU  22   5.276   6.441  -7.408
  167   1HD1  LEU  22          HD11      LEU  22   7.263   5.632  -8.575
  168   2HD1  LEU  22          HD12      LEU  22   7.382   5.419  -6.826
  169   3HD1  LEU  22          HD13      LEU  22   8.247   6.736  -7.619
  170   1HD2  LEU  22          HD21      LEU  22   7.181   8.390  -6.104
  171   2HD2  LEU  22          HD22      LEU  22   6.361   7.057  -5.296
  172   3HD2  LEU  22          HD23      LEU  22   5.430   8.406  -5.942
  173    H    ALA  23           HN       ALA  23   7.816  11.327  -9.778
  174    HA   ALA  23           HA       ALA  23   6.813  10.934 -12.411
  175   1HB   ALA  23          HB1       ALA  23   6.860  13.162 -11.357
  176   2HB   ALA  23          HB2       ALA  23   7.708  13.152 -12.901
  177   3HB   ALA  23          HB3       ALA  23   8.621  13.126 -11.392
  178    H    GLY  24           HN       GLY  24   9.751  10.508 -10.903
  179   1HA   GLY  24          HA2       GLY  24  10.833   9.465 -13.406
  180   2HA   GLY  24          HA1       GLY  24  11.866  10.544 -12.444
  181    H    ILE  25           HN       ILE  25   9.659   8.221 -11.168
  182    HA   ILE  25           HA       ILE  25  11.933   6.575 -10.349
  183    HB   ILE  25           HB       ILE  25   9.356   7.068  -8.834
  184   1HG1  ILE  25          HG12      ILE  25  10.809   9.065  -8.778
  185   2HG1  ILE  25          HG11      ILE  25  10.641   8.334  -7.187
  186   1HG2  ILE  25          HG21      ILE  25  10.267   4.845  -8.392
  187   2HG2  ILE  25          HG22      ILE  25  10.433   5.865  -6.963
  188   3HG2  ILE  25          HG23      ILE  25  11.835   5.550  -7.984
  189   1HD1  ILE  25          HD11      ILE  25  12.912   9.079  -7.592
  190   2HD1  ILE  25          HD12      ILE  25  13.009   8.054  -9.027
  191   3HD1  ILE  25          HD13      ILE  25  12.841   7.325  -7.425
  192    H    ASN  26           HN       ASN  26  11.492   4.313 -10.513
  193    HA   ASN  26           HA       ASN  26   9.616   3.716 -12.575
  194   1HB   ASN  26          HB2       ASN  26  11.529   2.010 -11.003
  195   2HB   ASN  26          HB1       ASN  26  10.427   1.349 -12.201
  196   1HD2  ASN  26          HD21      ASN  26  10.866   1.601 -14.324
  197   2HD2  ASN  26          HD22      ASN  26  12.311   2.301 -14.945
  198    H    LEU  27           HN       LEU  27   7.681   2.992 -12.441
  199    HA   LEU  27           HA       LEU  27   6.415   2.341  -9.849
  200   1HB   LEU  27          HB2       LEU  27   5.190   2.320 -12.610
  201   2HB   LEU  27          HB1       LEU  27   4.373   2.484 -11.073
  202    HG   LEU  27           HG       LEU  27   6.097   4.590 -12.381
  203   1HD1  LEU  27          HD11      LEU  27   3.109   4.406 -12.061
  204   2HD1  LEU  27          HD12      LEU  27   4.012   4.220 -13.565
  205   3HD1  LEU  27          HD13      LEU  27   3.995   5.775 -12.733
  206   1HD2  LEU  27          HD21      LEU  27   5.260   6.077 -10.646
  207   2HD2  LEU  27          HD22      LEU  27   6.128   4.718  -9.926
  208   3HD2  LEU  27          HD23      LEU  27   4.364   4.750  -9.923
  209    H    ASP  28           HN       ASP  28   8.032   0.951 -12.362
  210    HA   ASP  28           HA       ASP  28   6.645  -1.613 -12.274
  211   1HB   ASP  28          HB2       ASP  28   8.043  -2.266 -14.152
  212   2HB   ASP  28          HB1       ASP  28   7.270  -0.724 -14.484
  213    H    SER  29           HN       SER  29   8.918  -0.163 -10.428
  214    HA   SER  29           HA       SER  29  10.606  -2.497 -10.254
  215   1HB   SER  29          HB2       SER  29  10.780   0.189  -8.883
  216   2HB   SER  29          HB1       SER  29  11.915  -1.143  -8.658
  217    HG   SER  29           HG       SER  29  11.968  -1.008 -11.120
  218    H    SER  30           HN       SER  30  10.250  -3.978  -8.886
  219    HA   SER  30           HA       SER  30   8.147  -3.839  -6.955
  220   1HB   SER  30          HB2       SER  30  10.312  -5.851  -7.570
  221   2HB   SER  30          HB1       SER  30   9.045  -6.151  -6.401
  222    HG   SER  30           HG       SER  30   8.994  -6.040  -9.195
  223    H    LEU  31           HN       LEU  31   8.631  -4.045  -4.636
  224    HA   LEU  31           HA       LEU  31  10.734  -2.464  -3.717
  225   1HB   LEU  31          HB2       LEU  31   9.309  -4.649  -2.171
  226   2HB   LEU  31          HB1       LEU  31  10.238  -3.348  -1.470
  227    HG   LEU  31           HG       LEU  31   7.604  -3.087  -2.927
  228   1HD1  LEU  31          HD11      LEU  31   8.322  -2.727  -0.028
  229   2HD1  LEU  31          HD12      LEU  31   7.366  -4.038  -0.721
  230   3HD1  LEU  31          HD13      LEU  31   6.749  -2.388  -0.749
  231   1HD2  LEU  31          HD21      LEU  31   7.671  -0.735  -2.269
  232   2HD2  LEU  31          HD22      LEU  31   9.013  -1.149  -3.343
  233   3HD2  LEU  31          HD23      LEU  31   9.292  -0.973  -1.610
  234    H    ALA  32           HN       ALA  32  10.615  -5.774  -4.584
  235    HA   ALA  32           HA       ALA  32  12.932  -6.708  -3.411
  236   1HB   ALA  32          HB1       ALA  32  12.889  -8.496  -5.096
  237   2HB   ALA  32          HB2       ALA  32  11.702  -7.579  -6.026
  238   3HB   ALA  32          HB3       ALA  32  11.286  -8.195  -4.423
  239    H    ASP  33           HN       ASP  33  12.402  -4.760  -6.283
  240    HA   ASP  33           HA       ASP  33  14.953  -5.220  -7.445
  241   1HB   ASP  33          HB2       ASP  33  12.925  -3.014  -7.918
  242   2HB   ASP  33          HB1       ASP  33  14.449  -3.093  -8.776
  243    H    LEU  34           HN       LEU  34  13.551  -3.130  -5.193
  244    HA   LEU  34           HA       LEU  34  15.580  -1.074  -5.112
  245   1HB   LEU  34          HB2       LEU  34  13.511  -1.613  -3.022
  246   2HB   LEU  34          HB1       LEU  34  14.220  -0.084  -3.497
  247    HG   LEU  34           HG       LEU  34  12.323  -1.695  -5.187
  248   1HD1  LEU  34          HD11      LEU  34  11.800   0.735  -3.515
  249   2HD1  LEU  34          HD12      LEU  34  11.287  -0.934  -3.214
  250   3HD1  LEU  34          HD13      LEU  34  10.667  -0.069  -4.626
  251   1HD2  LEU  34          HD21      LEU  34  13.352   1.112  -5.508
  252   2HD2  LEU  34          HD22      LEU  34  12.102   0.313  -6.475
  253   3HD2  LEU  34          HD23      LEU  34  13.765  -0.291  -6.512
  254    H    GLY  35           HN       GLY  35  14.454  -3.689  -3.029
  255   1HA   GLY  35          HA2       GLY  35  15.899  -5.049  -1.698
  256   2HA   GLY  35          HA1       GLY  35  17.035  -3.703  -1.628
  257    H    LEU  36           HN       LEU  36  13.939  -4.877  -0.481
  258    HA   LEU  36           HA       LEU  36  13.725  -2.661   1.364
  259   1HB   LEU  36          HB2       LEU  36  11.528  -3.446   1.915
  260   2HB   LEU  36          HB1       LEU  36  11.692  -3.558   0.188
  261    HG   LEU  36           HG       LEU  36  12.152  -6.118   0.701
  262   1HD1  LEU  36          HD11      LEU  36  10.903  -6.922   2.622
  263   2HD1  LEU  36          HD12      LEU  36  10.544  -5.264   3.088
  264   3HD1  LEU  36          HD13      LEU  36  12.215  -5.854   3.156
  265   1HD2  LEU  36          HD21      LEU  36  10.253  -5.250  -0.550
  266   2HD2  LEU  36          HD22      LEU  36   9.433  -4.881   0.973
  267   3HD2  LEU  36          HD23      LEU  36   9.771  -6.552   0.539
  268    H    ASP  37           HN       ASP  37  14.437  -2.680   3.417
  269    HA   ASP  37           HA       ASP  37  15.052  -5.322   4.526
  270   1HB   ASP  37          HB2       ASP  37  17.145  -4.252   3.852
  271   2HB   ASP  37          HB1       ASP  37  16.775  -2.876   4.890
  272    H    SER  38           HN       SER  38  13.439  -5.520   5.846
  273    HA   SER  38           HA       SER  38  12.705  -5.717   7.922
  274   1HB   SER  38          HB2       SER  38  14.424  -3.347   8.704
  275   2HB   SER  38          HB1       SER  38  13.679  -4.519   9.792
  276    HG   SER  38           HG       SER  38  15.930  -4.729   8.175
  277    H    LEU  39           HN       LEU  39  13.038  -2.274   7.458
  278    HA   LEU  39           HA       LEU  39  10.490  -1.823   8.765
  279   1HB   LEU  39          HB2       LEU  39  12.272  -0.137   8.927
  280   2HB   LEU  39          HB1       LEU  39  12.114   0.172   7.205
  281    HG   LEU  39           HG       LEU  39   9.702   0.732   7.667
  282   1HD1  LEU  39          HD11      LEU  39   9.141   1.465   9.917
  283   2HD1  LEU  39          HD12      LEU  39  10.680   0.835  10.498
  284   3HD1  LEU  39          HD13      LEU  39   9.473  -0.264   9.825
  285   1HD2  LEU  39          HD21      LEU  39  11.341   2.374   7.129
  286   2HD2  LEU  39          HD22      LEU  39  11.859   2.465   8.821
  287   3HD2  LEU  39          HD23      LEU  39  10.236   3.005   8.354
  288    H    MET  40           HN       MET  40  11.688  -1.566   5.505
  289    HA   MET  40           HA       MET  40   9.267  -0.845   4.270
  290   1HB   MET  40          HB2       MET  40  11.710  -2.217   3.214
  291   2HB   MET  40          HB1       MET  40  10.358  -1.810   2.187
  292   1HG   MET  40          HG2       MET  40  10.698   0.585   2.794
  293   2HG   MET  40          HG1       MET  40  12.105   0.093   3.734
  294   1HE   MET  40          HE1       MET  40  11.788  -0.385  -0.859
  295   2HE   MET  40          HE2       MET  40  10.538   0.352   0.144
  296   3HE   MET  40          HE3       MET  40  10.876  -1.372   0.284
  297    H    GLY  41           HN       GLY  41   9.757  -3.583   5.906
  298   1HA   GLY  41          HA2       GLY  41   7.750  -5.002   4.295
  299   2HA   GLY  41          HA1       GLY  41   8.920  -5.817   5.337
  300    H    VAL  42           HN       VAL  42   8.895  -4.220   7.548
  301    HA   VAL  42           HA       VAL  42   6.634  -5.241   8.889
  302    HB   VAL  42           HB       VAL  42   8.685  -3.251   9.906
  303   1HG1  VAL  42          HG11      VAL  42   6.651  -3.154  11.241
  304   2HG1  VAL  42          HG12      VAL  42   7.952  -3.919  12.157
  305   3HG1  VAL  42          HG13      VAL  42   6.678  -4.905  11.439
  306   1HG2  VAL  42          HG21      VAL  42   8.495  -6.238  10.242
  307   2HG2  VAL  42          HG22      VAL  42   9.686  -5.180  11.009
  308   3HG2  VAL  42          HG23      VAL  42   9.667  -5.362   9.256
  309    H    GLU  43           HN       GLU  43   7.498  -1.895   8.022
  310    HA   GLU  43           HA       GLU  43   5.338  -0.599   9.250
  311   1HB   GLU  43          HB2       GLU  43   7.226   0.613   8.227
  312   2HB   GLU  43          HB1       GLU  43   6.712   0.078   6.633
  313   1HG   GLU  43          HG2       GLU  43   5.950   2.348   6.853
  314   2HG   GLU  43          HG1       GLU  43   4.575   1.287   7.015
  315    H    VAL  44           HN       VAL  44   5.720  -2.046   6.120
  316    HA   VAL  44           HA       VAL  44   3.259  -1.392   4.937
  317    HB   VAL  44           HB       VAL  44   4.860  -3.901   4.461
  318   1HG1  VAL  44          HG11      VAL  44   3.991  -3.770   2.192
  319   2HG1  VAL  44          HG12      VAL  44   3.027  -2.362   2.653
  320   3HG1  VAL  44          HG13      VAL  44   2.719  -3.931   3.404
  321   1HG2  VAL  44          HG21      VAL  44   6.352  -2.038   4.371
  322   2HG2  VAL  44          HG22      VAL  44   5.288  -1.178   3.239
  323   3HG2  VAL  44          HG23      VAL  44   6.091  -2.688   2.760
  324    H    ARG  45           HN       ARG  45   4.375  -4.353   6.529
  325    HA   ARG  45           HA       ARG  45   1.954  -5.722   6.272
  326   1HB   ARG  45          HB2       ARG  45   4.352  -6.580   6.854
  327   2HB   ARG  45          HB1       ARG  45   3.826  -6.324   8.517
  328   1HG   ARG  45          HG2       ARG  45   1.830  -7.735   8.001
  329   2HG   ARG  45          HG1       ARG  45   2.581  -8.120   6.458
  330   1HD   ARG  45          HD2       ARG  45   3.549  -8.780   9.221
  331   2HD   ARG  45          HD1       ARG  45   3.079  -9.874   7.920
  332    HE   ARG  45           HE       ARG  45   5.333  -8.185   7.357
  333   1HH1  ARG  45          HH11      ARG  45   4.173 -11.379   8.428
  334   2HH1  ARG  45          HH12      ARG  45   5.713 -12.104   8.393
  335   1HH2  ARG  45          HH21      ARG  45   7.466  -9.191   7.427
  336   2HH2  ARG  45          HH22      ARG  45   7.634 -10.831   7.877
  337    H    GLN  46           HN       GLN  46   3.216  -3.656   8.865
  338    HA   GLN  46           HA       GLN  46   1.065  -4.298  10.612
  339   1HB   GLN  46          HB2       GLN  46   2.994  -1.977  10.733
  340   2HB   GLN  46          HB1       GLN  46   1.843  -2.388  12.000
  341   1HG   GLN  46          HG2       GLN  46   4.110  -4.088  11.018
  342   2HG   GLN  46          HG1       GLN  46   4.052  -3.221  12.553
  343   1HE2  GLN  46          HE21      GLN  46   4.373  -6.119  11.957
  344   2HE2  GLN  46          HE22      GLN  46   3.122  -6.897  12.831
  345    H    ILE  47           HN       ILE  47   1.148  -2.380   7.875
  346    HA   ILE  47           HA       ILE  47  -1.164  -0.835   8.746
  347    HB   ILE  47           HB       ILE  47  -0.047  -1.066   5.929
  348   1HG1  ILE  47          HG12      ILE  47   0.429   1.144   7.919
  349   2HG1  ILE  47          HG11      ILE  47   1.608  -0.128   7.610
  350   1HG2  ILE  47          HG21      ILE  47  -2.356  -0.283   6.092
  351   2HG2  ILE  47          HG22      ILE  47  -1.301   1.043   5.592
  352   3HG2  ILE  47          HG23      ILE  47  -1.873   0.947   7.258
  353   1HD1  ILE  47          HD11      ILE  47   1.710   0.652   5.242
  354   2HD1  ILE  47          HD12      ILE  47   2.265   1.837   6.413
  355   3HD1  ILE  47          HD13      ILE  47   0.659   2.004   5.687
  356    H    LEU  48           HN       LEU  48  -0.320  -3.262   6.329
  357    HA   LEU  48           HA       LEU  48  -2.991  -3.700   5.544
  358   1HB   LEU  48          HB2       LEU  48  -0.465  -5.185   4.954
  359   2HB   LEU  48          HB1       LEU  48  -1.997  -5.813   4.408
  360    HG   LEU  48           HG       LEU  48  -1.111  -4.708   2.570
  361   1HD1  LEU  48          HD11      LEU  48  -2.582  -2.821   2.136
  362   2HD1  LEU  48          HD12      LEU  48  -2.979  -2.753   3.849
  363   3HD1  LEU  48          HD13      LEU  48  -3.437  -4.170   2.898
  364   1HD2  LEU  48          HD21      LEU  48  -0.477  -2.342   4.326
  365   2HD2  LEU  48          HD22      LEU  48  -0.227  -2.420   2.580
  366   3HD2  LEU  48          HD23      LEU  48   0.685  -3.484   3.654
  367    H    GLU  49           HN       GLU  49  -0.866  -5.736   7.521
  368    HA   GLU  49           HA       GLU  49  -2.760  -7.810   7.889
  369   1HB   GLU  49          HB2       GLU  49  -0.331  -8.092   8.081
  370   2HB   GLU  49          HB1       GLU  49  -0.314  -7.037   9.479
  371   1HG   GLU  49          HG2       GLU  49  -1.788  -8.728  10.613
  372   2HG   GLU  49          HG1       GLU  49  -1.468  -9.792   9.240
  373    H    ARG  50           HN       ARG  50  -1.606  -5.233   9.981
  374    HA   ARG  50           HA       ARG  50  -3.189  -5.824  12.226
  375   1HB   ARG  50          HB2       ARG  50  -1.238  -4.530  12.496
  376   2HB   ARG  50          HB1       ARG  50  -1.784  -3.331  11.336
  377   1HG   ARG  50          HG2       ARG  50  -3.611  -2.743  12.925
  378   2HG   ARG  50          HG1       ARG  50  -2.846  -3.813  14.104
  379   1HD   ARG  50          HD2       ARG  50  -1.431  -1.538  12.738
  380   2HD   ARG  50          HD1       ARG  50  -2.229  -1.376  14.304
  381    HE   ARG  50           HE       ARG  50  -0.575  -3.457  14.654
  382   1HH1  ARG  50          HH11      ARG  50   0.039  -0.264  13.185
  383   2HH1  ARG  50          HH12      ARG  50   1.558  -0.058  13.872
  384   1HH2  ARG  50          HH21      ARG  50   1.592  -3.157  15.648
  385   2HH2  ARG  50          HH22      ARG  50   2.420  -1.711  15.347
  386    H    GLU  51           HN       GLU  51  -3.634  -3.279   9.774
  387    HA   GLU  51           HA       GLU  51  -6.123  -2.520  11.020
  388   1HB   GLU  51          HB2       GLU  51  -4.714  -1.422   8.613
  389   2HB   GLU  51          HB1       GLU  51  -6.143  -0.723   9.352
  390   1HG   GLU  51          HG2       GLU  51  -3.485  -1.052  10.739
  391   2HG   GLU  51          HG1       GLU  51  -4.085   0.446  10.021
  392    H    HIS  52           HN       HIS  52  -5.110  -3.792   7.869
  393    HA   HIS  52           HA       HIS  52  -7.912  -3.786   7.027
  394   1HB   HIS  52          HB2       HIS  52  -5.443  -4.414   5.388
  395   2HB   HIS  52          HB1       HIS  52  -7.100  -4.348   4.804
  396    HD1  HIS  52           HD1      HIS  52  -8.141  -2.067   4.418
  397    HD2  HIS  52           HD2      HIS  52  -4.226  -1.913   5.782
  398    HE1  HIS  52           HE1      HIS  52  -7.371   0.278   3.995
  399    HE2  HIS  52           HE2      HIS  52  -5.056   0.396   4.897
  400    H    ASP  53           HN       ASP  53  -5.793  -5.937   8.437
  401    HA   ASP  53           HA       ASP  53  -5.684  -8.129   8.792
  402   1HB   ASP  53          HB2       ASP  53  -8.136  -7.969   9.311
  403   2HB   ASP  53          HB1       ASP  53  -8.499  -8.308   7.628
  404    H    LEU  54           HN       LEU  54  -4.478  -7.180   6.599
  405    HA   LEU  54           HA       LEU  54  -4.675  -9.447   4.736
  406   1HB   LEU  54          HB2       LEU  54  -3.781  -6.623   4.306
  407   2HB   LEU  54          HB1       LEU  54  -3.088  -7.878   3.299
  408    HG   LEU  54           HG       LEU  54  -5.394  -8.387   2.486
  409   1HD1  LEU  54          HD11      LEU  54  -6.694  -7.592   4.351
  410   2HD1  LEU  54          HD12      LEU  54  -7.160  -6.725   2.880
  411   3HD1  LEU  54          HD13      LEU  54  -6.106  -5.960   4.074
  412   1HD2  LEU  54          HD21      LEU  54  -3.933  -6.942   1.204
  413   2HD2  LEU  54          HD22      LEU  54  -4.468  -5.543   2.137
  414   3HD2  LEU  54          HD23      LEU  54  -5.604  -6.389   1.084
  415    H    VAL  55           HN       VAL  55  -3.496 -10.876   5.882
  416    HA   VAL  55           HA       VAL  55  -0.909 -10.254   6.935
  417    HB   VAL  55           HB       VAL  55  -2.143 -12.981   6.397
  418   1HG1  VAL  55          HG11      VAL  55   0.272 -13.099   6.680
  419   2HG1  VAL  55          HG12      VAL  55  -0.551 -13.814   8.062
  420   3HG1  VAL  55          HG13      VAL  55   0.152 -12.203   8.193
  421   1HG2  VAL  55          HG21      VAL  55  -3.547 -11.686   7.898
  422   2HG2  VAL  55          HG22      VAL  55  -2.155 -11.330   8.922
  423   3HG2  VAL  55          HG23      VAL  55  -2.744 -12.987   8.781
  424    H    LEU  56           HN       LEU  56   0.328  -9.477   5.341
  425    HA   LEU  56           HA       LEU  56   0.896 -11.247   3.076
  426   1HB   LEU  56          HB2       LEU  56   1.409  -8.288   3.338
  427   2HB   LEU  56          HB1       LEU  56   1.697  -9.263   1.918
  428    HG   LEU  56           HG       LEU  56  -1.020  -8.642   3.084
  429   1HD1  LEU  56          HD11      LEU  56  -1.327  -7.301   1.064
  430   2HD1  LEU  56          HD12      LEU  56   0.341  -7.631   0.593
  431   3HD1  LEU  56          HD13      LEU  56   0.001  -6.702   2.054
  432   1HD2  LEU  56          HD21      LEU  56  -1.898  -9.696   1.067
  433   2HD2  LEU  56          HD22      LEU  56  -0.944 -10.841   2.011
  434   3HD2  LEU  56          HD23      LEU  56  -0.262 -10.110   0.559
  435    HA   PRO  57           HA       PRO  57   4.823 -11.511   5.342
  436   1HB   PRO  57          HB2       PRO  57   5.275 -13.727   3.475
  437   2HB   PRO  57          HB1       PRO  57   5.219 -13.777   5.240
  438   1HG   PRO  57          HG2       PRO  57   3.271 -14.881   3.756
  439   2HG   PRO  57          HG1       PRO  57   2.891 -14.027   5.266
  440   1HD   PRO  57          HD2       PRO  57   2.722 -13.030   2.441
  441   2HD   PRO  57          HD1       PRO  57   1.514 -12.916   3.746
  442    H    ILE  58           HN       ILE  58   7.179 -12.097   4.177
  443    HA   ILE  58           HA       ILE  58   7.640  -9.838   2.583
  444    HB   ILE  58           HB       ILE  58   9.473 -12.218   3.091
  445   1HG1  ILE  58          HG12      ILE  58  10.833 -10.469   4.336
  446   2HG1  ILE  58          HG11      ILE  58   9.458  -9.392   4.126
  447   1HG2  ILE  58          HG21      ILE  58  10.091 -11.336   0.931
  448   2HG2  ILE  58          HG22      ILE  58  11.333 -10.936   2.115
  449   3HG2  ILE  58          HG23      ILE  58  10.193  -9.702   1.584
  450   1HD1  ILE  58          HD11      ILE  58   8.081 -10.921   5.428
  451   2HD1  ILE  58          HD12      ILE  58   9.496 -10.389   6.336
  452   3HD1  ILE  58          HD13      ILE  58   9.458 -12.004   5.617
  453    H    ARG  59           HN       ARG  59   7.195 -13.196   1.796
  454    HA   ARG  59           HA       ARG  59   7.817 -12.976  -0.919
  455   1HB   ARG  59          HB2       ARG  59   6.574 -15.070  -1.333
  456   2HB   ARG  59          HB1       ARG  59   7.742 -15.170  -0.034
  457   1HG   ARG  59          HG2       ARG  59   4.878 -14.661   0.619
  458   2HG   ARG  59          HG1       ARG  59   5.393 -16.287   0.163
  459   1HD   ARG  59          HD2       ARG  59   6.496 -14.615   2.420
  460   2HD   ARG  59          HD1       ARG  59   5.439 -16.015   2.585
  461    HE   ARG  59           HE       ARG  59   7.873 -16.542   1.149
  462   1HH1  ARG  59          HH11      ARG  59   6.272 -16.713   4.315
  463   2HH1  ARG  59          HH12      ARG  59   7.558 -17.522   5.070
  464   1HH2  ARG  59          HH21      ARG  59   9.611 -17.683   2.207
  465   2HH2  ARG  59          HH22      ARG  59   9.458 -18.145   3.850
  466    H    GLU  60           HN       GLU  60   5.181 -11.536   0.557
  467    HA   GLU  60           HA       GLU  60   4.003 -11.245  -2.104
  468   1HB   GLU  60          HB2       GLU  60   2.581 -11.183   0.552
  469   2HB   GLU  60          HB1       GLU  60   1.844 -10.641  -0.953
  470   1HG   GLU  60          HG2       GLU  60   2.251 -12.872  -1.912
  471   2HG   GLU  60          HG1       GLU  60   2.861 -13.398  -0.345
  472    H    VAL  61           HN       VAL  61   5.168  -9.603   0.701
  473    HA   VAL  61           HA       VAL  61   4.348  -6.996  -0.138
  474    HB   VAL  61           HB       VAL  61   6.347  -7.902   1.965
  475   1HG1  VAL  61          HG11      VAL  61   6.264  -5.629   2.869
  476   2HG1  VAL  61          HG12      VAL  61   5.284  -5.116   1.495
  477   3HG1  VAL  61          HG13      VAL  61   6.949  -5.646   1.243
  478   1HG2  VAL  61          HG21      VAL  61   4.612  -7.237   3.551
  479   2HG2  VAL  61          HG22      VAL  61   4.057  -8.506   2.461
  480   3HG2  VAL  61          HG23      VAL  61   3.542  -6.837   2.208
  481    H    ARG  62           HN       ARG  62   7.140  -8.989  -0.659
  482    HA   ARG  62           HA       ARG  62   8.872  -6.858  -1.297
  483   1HB   ARG  62          HB2       ARG  62   9.594  -9.033  -0.419
  484   2HB   ARG  62          HB1       ARG  62   9.167  -9.777  -1.948
  485   1HG   ARG  62          HG2       ARG  62  10.836  -8.451  -3.078
  486   2HG   ARG  62          HG1       ARG  62  11.262  -7.665  -1.557
  487   1HD   ARG  62          HD2       ARG  62  12.813  -9.479  -2.123
  488   2HD   ARG  62          HD1       ARG  62  11.942  -9.805  -0.626
  489    HE   ARG  62           HE       ARG  62  10.716 -10.912  -2.981
  490   1HH1  ARG  62          HH11      ARG  62  13.063 -11.492  -0.351
  491   2HH1  ARG  62          HH12      ARG  62  12.986 -13.182  -0.473
  492   1HH2  ARG  62          HH21      ARG  62  10.646 -13.264  -3.160
  493   2HH2  ARG  62          HH22      ARG  62  11.587 -14.219  -2.127
  494    H    GLN  63           HN       GLN  63   6.411  -8.318  -3.180
  495    HA   GLN  63           HA       GLN  63   7.790  -7.473  -5.635
  496   1HB   GLN  63          HB2       GLN  63   6.175  -8.716  -6.993
  497   2HB   GLN  63          HB1       GLN  63   6.940  -9.783  -5.831
  498   1HG   GLN  63          HG2       GLN  63   4.367  -8.587  -5.020
  499   2HG   GLN  63          HG1       GLN  63   4.312  -9.746  -6.343
  500   1HE2  GLN  63          HE21      GLN  63   6.779 -10.080  -3.947
  501   2HE2  GLN  63          HE22      GLN  63   6.047 -11.433  -3.150
  502    H    LEU  64           HN       LEU  64   6.082  -6.093  -3.463
  503    HA   LEU  64           HA       LEU  64   4.020  -4.818  -4.929
  504   1HB   LEU  64          HB2       LEU  64   5.567  -3.746  -2.542
  505   2HB   LEU  64          HB1       LEU  64   4.092  -3.062  -3.181
  506    HG   LEU  64           HG       LEU  64   4.341  -5.787  -1.907
  507   1HD1  LEU  64          HD11      LEU  64   3.041  -4.830  -0.090
  508   2HD1  LEU  64          HD12      LEU  64   3.116  -3.247  -0.867
  509   3HD1  LEU  64          HD13      LEU  64   4.592  -4.019  -0.290
  510   1HD2  LEU  64          HD21      LEU  64   1.879  -5.792  -1.972
  511   2HD2  LEU  64          HD22      LEU  64   2.603  -5.791  -3.575
  512   3HD2  LEU  64          HD23      LEU  64   1.917  -4.300  -2.917
  513    H    THR  65           HN       THR  65   4.244  -3.398  -6.580
  514    HA   THR  65           HA       THR  65   6.824  -2.564  -7.475
  515    HB   THR  65           HB       THR  65   5.380  -1.685  -9.339
  516    HG1  THR  65           HG1      THR  65   3.277  -1.699  -9.056
  517   1HG2  THR  65          HG21      THR  65   4.771  -3.912 -10.127
  518   2HG2  THR  65          HG22      THR  65   4.862  -4.508  -8.468
  519   3HG2  THR  65          HG23      THR  65   6.338  -3.984  -9.288
  520    H    LEU  66           HN       LEU  66   5.948  -1.361  -5.051
  521    HA   LEU  66           HA       LEU  66   5.627   0.511  -3.898
  522   1HB   LEU  66          HB2       LEU  66   7.649   1.268  -5.134
  523   2HB   LEU  66          HB1       LEU  66   6.640   1.900  -6.405
  524    HG   LEU  66           HG       LEU  66   7.684   3.572  -4.755
  525   1HD1  LEU  66          HD11      LEU  66   5.726   5.005  -4.762
  526   2HD1  LEU  66          HD12      LEU  66   4.718   3.590  -5.118
  527   3HD1  LEU  66          HD13      LEU  66   5.906   4.148  -6.303
  528   1HD2  LEU  66          HD21      LEU  66   5.428   2.571  -3.064
  529   2HD2  LEU  66          HD22      LEU  66   6.461   3.950  -2.697
  530   3HD2  LEU  66          HD23      LEU  66   7.142   2.314  -2.703
  531    H    ARG  67           HN       ARG  67   4.377   1.178  -7.158
  532    HA   ARG  67           HA       ARG  67   2.222   2.646  -5.981
  533   1HB   ARG  67          HB2       ARG  67   2.824   1.967  -8.837
  534   2HB   ARG  67          HB1       ARG  67   1.325   2.762  -8.363
  535   1HG   ARG  67          HG2       ARG  67   4.118   3.795  -7.893
  536   2HG   ARG  67          HG1       ARG  67   2.943   4.414  -9.062
  537   1HD   ARG  67          HD2       ARG  67   1.408   4.906  -7.151
  538   2HD   ARG  67          HD1       ARG  67   2.711   4.390  -6.074
  539    HE   ARG  67           HE       ARG  67   3.909   6.295  -6.593
  540   1HH1  ARG  67          HH11      ARG  67   0.935   6.310  -8.523
  541   2HH1  ARG  67          HH12      ARG  67   0.710   7.992  -8.437
  542   1HH2  ARG  67          HH21      ARG  67   3.591   8.749  -6.552
  543   2HH2  ARG  67          HH22      ARG  67   2.252   9.351  -7.375
  544    H    LYS  68           HN       LYS  68   2.720  -0.578  -6.381
  545    HA   LYS  68           HA       LYS  68  -0.006  -1.345  -6.657
  546   1HB   LYS  68          HB2       LYS  68   1.933  -2.927  -7.020
  547   2HB   LYS  68          HB1       LYS  68   2.179  -2.925  -5.275
  548   1HG   LYS  68          HG2       LYS  68  -0.016  -3.853  -4.926
  549   2HG   LYS  68          HG1       LYS  68  -0.339  -3.798  -6.656
  550   1HD   LYS  68          HD2       LYS  68   1.464  -5.390  -7.042
  551   2HD   LYS  68          HD1       LYS  68   1.803  -5.431  -5.303
  552   1HE   LYS  68          HE2       LYS  68  -0.463  -6.208  -4.891
  553   2HE   LYS  68          HE1       LYS  68  -0.797  -6.193  -6.616
  554   1HZ   LYS  68          HZ1       LYS  68   1.044  -7.853  -6.843
  555   2HZ   LYS  68          HZ2       LYS  68  -0.338  -8.369  -6.031
  556   3HZ   LYS  68          HZ3       LYS  68   1.046  -8.003  -5.136
  557    H    LEU  69           HN       LEU  69   1.923  -0.154  -4.128
  558    HA   LEU  69           HA       LEU  69   0.423  -0.907  -1.873
  559   1HB   LEU  69          HB2       LEU  69   2.131   1.508  -2.379
  560   2HB   LEU  69          HB1       LEU  69   1.165   1.431  -0.930
  561    HG   LEU  69           HG       LEU  69   3.414   0.810  -0.424
  562   1HD1  LEU  69          HD11      LEU  69   1.707  -0.316   0.821
  563   2HD1  LEU  69          HD12      LEU  69   3.086  -1.390   0.577
  564   3HD1  LEU  69          HD13      LEU  69   1.623  -1.598  -0.385
  565   1HD2  LEU  69          HD21      LEU  69   4.175   0.052  -2.610
  566   2HD2  LEU  69          HD22      LEU  69   3.143  -1.370  -2.492
  567   3HD2  LEU  69          HD23      LEU  69   4.501  -1.170  -1.381
  568    H    GLN  70           HN       GLN  70  -0.069   1.886  -4.007
  569    HA   GLN  70           HA       GLN  70  -2.471   2.609  -2.594
  570   1HB   GLN  70          HB2       GLN  70  -2.784   4.265  -4.535
  571   2HB   GLN  70          HB1       GLN  70  -1.459   4.520  -3.422
  572   1HG   GLN  70          HG2       GLN  70   0.121   3.760  -5.002
  573   2HG   GLN  70          HG1       GLN  70  -1.151   3.168  -6.087
  574   1HE2  GLN  70          HE21      GLN  70  -2.153   4.597  -7.406
  575   2HE2  GLN  70          HE22      GLN  70  -1.646   6.232  -7.598
  576    H    GLU  71           HN       GLU  71  -1.898   0.166  -4.517
  577    HA   GLU  71           HA       GLU  71  -4.493   0.209  -5.858
  578   1HB   GLU  71          HB2       GLU  71  -2.543  -0.411  -7.203
  579   2HB   GLU  71          HB1       GLU  71  -2.131  -1.673  -6.057
  580   1HG   GLU  71          HG2       GLU  71  -4.014  -2.971  -6.705
  581   2HG   GLU  71          HG1       GLU  71  -4.671  -1.645  -7.664
  582    H    MET  72           HN       MET  72  -2.804  -1.024  -3.159
  583    HA   MET  72           HA       MET  72  -5.061  -2.807  -2.455
  584   1HB   MET  72          HB2       MET  72  -2.160  -3.017  -1.595
  585   2HB   MET  72          HB1       MET  72  -3.454  -4.095  -1.103
  586   1HG   MET  72          HG2       MET  72  -2.349  -3.758  -3.880
  587   2HG   MET  72          HG1       MET  72  -2.072  -5.111  -2.793
  588   1HE   MET  72          HE1       MET  72  -3.067  -5.373  -5.792
  589   2HE   MET  72          HE2       MET  72  -4.289  -6.631  -5.626
  590   3HE   MET  72          HE3       MET  72  -2.768  -6.752  -4.737
  591    H    SER  73           HN       SER  73  -4.499   0.070  -2.062
  592    HA   SER  73           HA       SER  73  -3.670   0.364   0.627
  593   1HB   SER  73          HB2       SER  73  -4.143   2.798   0.278
  594   2HB   SER  73          HB1       SER  73  -3.046   2.065  -0.870
  595    HG   SER  73           HG       SER  73  -5.394   1.746  -1.966
  596    H    SER  74           HN       SER  74  -6.774   0.437  -1.036
  597    HA   SER  74           HA       SER  74  -8.904   0.575  -0.389
  598   1HB   SER  74          HB2       SER  74  -7.883  -0.788   2.117
  599   2HB   SER  74          HB1       SER  74  -9.551  -0.785   1.558
  600    HG   SER  74           HG       SER  74  -8.337  -1.703  -0.485
  601    H    LYS  75           HN       LYS  75  -8.938   2.909  -0.279
  602    HA   LYS  75           HA       LYS  75  -8.463   4.186   2.271
  603   1HB   LYS  75          HB2       LYS  75  -9.574   5.286  -0.317
  604   2HB   LYS  75          HB1       LYS  75  -9.536   6.223   1.158
  605   1HG   LYS  75          HG2       LYS  75  -7.699   6.954  -0.045
  606   2HG   LYS  75          HG1       LYS  75  -7.013   5.834   1.120
  607   1HD   LYS  75          HD2       LYS  75  -6.882   4.114  -0.578
  608   2HD   LYS  75          HD1       LYS  75  -7.659   5.185  -1.756
  609   1HE   LYS  75          HE2       LYS  75  -5.799   6.776  -1.497
  610   2HE   LYS  75          HE1       LYS  75  -5.024   5.662  -0.378
  611   1HZ   LYS  75          HZ1       LYS  75  -4.019   5.343  -2.400
  612   2HZ   LYS  75          HZ2       LYS  75  -5.466   5.285  -3.295
  613   3HZ   LYS  75          HZ3       LYS  75  -5.042   4.022  -2.238
  614    H    ALA  76           HN       ALA  76 -11.161   3.028   0.410
  615    HA   ALA  76           HA       ALA  76 -13.405   2.940   0.726
  616   1HB   ALA  76          HB1       ALA  76 -12.842   1.729   2.825
  617   2HB   ALA  76          HB2       ALA  76 -14.266   2.744   3.057
  618   3HB   ALA  76          HB3       ALA  76 -12.699   3.268   3.676
  619    H    GLY  77           HN       GLY  77 -12.517   5.099  -0.224
  620   1HA   GLY  77          HA2       GLY  77 -14.197   7.150  -0.005
  621   2HA   GLY  77          HA1       GLY  77 -13.056   7.476   1.301
  622    H    SER  78           HN       SER  78 -13.445   7.121  -2.127
  623    HA   SER  78           HA       SER  78 -10.736   7.502  -2.806
  624   1HB   SER  78          HB2       SER  78 -11.693   7.925  -5.135
  625   2HB   SER  78          HB1       SER  78 -12.057   6.364  -4.398
  626    HG   SER  78           HG       SER  78 -14.113   7.062  -3.936
  627    H    ASP  79           HN       ASP  79 -12.816   9.677  -1.496
  628    HA   ASP  79           HA       ASP  79 -11.656  11.965  -2.891
  629   1HB   ASP  79          HB2       ASP  79 -13.859  11.850  -0.819
  630   2HB   ASP  79          HB1       ASP  79 -13.240  13.330  -1.532
  631    H    THR  80           HN       THR  80  -9.994  10.314  -1.189
  632    HA   THR  80           HA       THR  80  -9.511  11.941   1.152
  633    HB   THR  80           HB       THR  80  -7.846   9.665  -0.025
  634    HG1  THR  80           HG1      THR  80  -9.819   8.823   0.650
  635   1HG2  THR  80          HG21      THR  80  -6.834   9.524   2.221
  636   2HG2  THR  80          HG22      THR  80  -7.798  10.909   2.741
  637   3HG2  THR  80          HG23      THR  80  -6.552  11.114   1.510
  638    H    GLU  81           HN       GLU  81  -8.380  11.608  -2.098
  639    HA   GLU  81           HA       GLU  81  -6.437  13.775  -1.854
  640   1HB   GLU  81          HB2       GLU  81  -6.103  11.842  -3.420
  641   2HB   GLU  81          HB1       GLU  81  -7.550  12.320  -4.284
  642   1HG   GLU  81          HG2       GLU  81  -6.484  14.378  -4.988
  643   2HG   GLU  81          HG1       GLU  81  -5.046  13.976  -4.046
  644    H    LEU  82           HN       LEU  82  -9.635  13.282  -2.075
  645    HA   LEU  82           HA       LEU  82 -11.522  14.327  -2.432
  646   1HB   LEU  82          HB2       LEU  82  -9.883  16.849  -2.099
  647   2HB   LEU  82          HB1       LEU  82 -11.620  16.857  -2.280
  648    HG   LEU  82           HG       LEU  82 -11.661  15.410  -0.150
  649   1HD1  LEU  82          HD11      LEU  82  -9.790  15.692   1.376
  650   2HD1  LEU  82          HD12      LEU  82  -8.871  16.491   0.101
  651   3HD1  LEU  82          HD13      LEU  82  -9.330  14.795  -0.071
  652   1HD2  LEU  82          HD21      LEU  82 -11.545  17.380   1.291
  653   2HD2  LEU  82          HD22      LEU  82 -12.408  17.719  -0.210
  654   3HD2  LEU  82          HD23      LEU  82 -10.748  18.278   0.001
  655    H    ALA  83           HN       ALA  83  -9.900  16.920  -4.032
  656    HA   ALA  83           HA       ALA  83 -10.119  16.211  -6.669
  657   1HB   ALA  83          HB1       ALA  83 -12.551  16.071  -6.308
  658   2HB   ALA  83          HB2       ALA  83 -12.175  17.494  -7.283
  659   3HB   ALA  83          HB3       ALA  83 -12.549  17.672  -5.568
  660    H    ALA  84           HN       ALA  84 -10.332  18.516  -7.865
  661    HA   ALA  84           HA       ALA  84  -8.806  20.367  -6.191
  662   1HB   ALA  84          HB1       ALA  84  -7.875  21.251  -8.282
  663   2HB   ALA  84          HB2       ALA  84  -8.827  20.086  -9.201
  664   3HB   ALA  84          HB3       ALA  84  -7.548  19.524  -8.125
  665    HA   PRO  85           HA       PRO  85 -12.626  22.667  -6.913
  666   1HB   PRO  85          HB2       PRO  85 -12.125  24.067  -4.454
  667   2HB   PRO  85          HB1       PRO  85 -13.350  22.836  -4.762
  668   1HG   PRO  85          HG2       PRO  85 -11.184  22.500  -3.081
  669   2HG   PRO  85          HG1       PRO  85 -12.081  21.178  -3.848
  670   1HD   PRO  85          HD2       PRO  85  -9.483  22.427  -4.654
  671   2HD   PRO  85          HD1       PRO  85  -9.972  20.718  -4.684
  672    H    LYS  86           HN       LYS  86 -11.948  23.976  -8.539
  673    HA   LYS  86           HA       LYS  86  -9.818  25.882  -8.024
  674   1HB   LYS  86          HB2       LYS  86 -11.263  25.239 -10.593
  675   2HB   LYS  86          HB1       LYS  86  -9.827  26.249 -10.434
  676   1HG   LYS  86          HG2       LYS  86  -8.561  24.322  -9.612
  677   2HG   LYS  86          HG1       LYS  86  -9.995  23.314  -9.765
  678   1HD   LYS  86          HD2       LYS  86  -8.557  24.717 -12.018
  679   2HD   LYS  86          HD1       LYS  86  -8.468  22.996 -11.646
  680   1HE   LYS  86          HE2       LYS  86 -10.909  24.530 -12.538
  681   2HE   LYS  86          HE1       LYS  86  -9.984  23.376 -13.495
  682   1HZ   LYS  86          HZ1       LYS  86 -11.942  22.336 -12.676
  683   2HZ   LYS  86          HZ2       LYS  86 -11.660  22.786 -11.106
  684   3HZ   LYS  86          HZ3       LYS  86 -10.664  21.631 -11.833
  685    H    SER  87           HN       SER  87 -13.240  25.790  -8.283
  686    HA   SER  87           HA       SER  87 -13.268  28.710  -8.392
  687   1HB   SER  87          HB2       SER  87 -14.345  27.683 -10.357
  688   2HB   SER  87          HB1       SER  87 -15.402  26.755  -9.297
  689    HG   SER  87           HG       SER  87 -16.432  28.620 -10.065
  690    H    LYS  88           HN       LYS  88 -13.605  29.484  -6.450
  691    HA   LYS  88           HA       LYS  88 -15.130  27.922  -4.539
  692   1HB   LYS  88          HB2       LYS  88 -13.355  30.291  -4.269
  693   2HB   LYS  88          HB1       LYS  88 -14.553  29.974  -3.024
  694   1HG   LYS  88          HG2       LYS  88 -13.613  27.694  -2.786
  695   2HG   LYS  88          HG1       LYS  88 -12.336  28.158  -3.912
  696   1HD   LYS  88          HD2       LYS  88 -11.414  29.689  -2.426
  697   2HD   LYS  88          HD1       LYS  88 -12.908  29.810  -1.490
  698   1HE   LYS  88          HE2       LYS  88 -11.118  27.388  -1.630
  699   2HE   LYS  88          HE1       LYS  88 -11.174  28.546  -0.296
  700   1HZ   LYS  88          HZ1       LYS  88 -13.405  26.784  -1.194
  701   2HZ   LYS  88          HZ2       LYS  88 -13.577  27.963  -0.048
  702   3HZ   LYS  88          HZ3       LYS  88 -12.570  26.643   0.259
  703    H    ASN  89           HN       ASN  89 -15.831  30.143  -6.811
  704    HA   ASN  89           HA       ASN  89 -18.358  30.695  -5.463
  705   1HB   ASN  89          HB2       ASN  89 -16.992  32.772  -5.409
  706   2HB   ASN  89          HB1       ASN  89 -16.831  32.699  -7.157
  707   1HD2  ASN  89          HD21      ASN  89 -18.599  33.275  -8.436
  708   2HD2  ASN  89          HD22      ASN  89 -19.976  34.090  -7.781